G4VM27_SCHMA Loading...

Putative zinc finger protein

AlphaFold DB , UniProt , Accession G4VM27, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 357 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.6	Very low	28	Very low	224 Å²	224	101.5 Å²	101.5	100%	1.103	55%	0.546	S	S	*	.				0	102.1	0	-73.4	-176.7	-163.1	0	0	108.4	I3	M1-I3 PolarHBondContact O-N 2.9Å
2	E	23	Very low	28.4	Very low	187 Å²	187	99.8 Å²	99.8	87%	0.874	54%	0.535	S	S	*	.			trans	-58.7	125.7	179.4	-65.3	176.5	153.7	0	0	110.8
3	I	24.3	Very low	28.2	Very low	68 Å²	68	101.3 Å²	101.3	35%	0.349	54%	0.543	S	S	.	.			trans	-94.5	103.1	169	-62.3	-168.5	0	0	0	107.1	M1 I5 K282 I286	M1-I3 PolarHBondContact O-N 2.9Å; I3-I5 PolarHBondContact O-N 3.48Å; I3-K282 HydrophobicContact CD1-CD 3.67Å; I3-K282 HydrophobicContact CD1-CG 3.82Å; I3-I286 HydrophobicContact CD1-CD1 3.01Å; I3-I286 HydrophobicContact CD1-CG1 4.46Å; I3-I286 HydrophobicContact CG1-CD1 4.02Å
4	S	23	Very low	28	Very low	90 Å²	90	106.3 Å²	106.3	63%	0.629	56%	0.558	S	S	*	*			trans	-67.2	111.8	160.8	35.9	0	0	0	0	108.1	F6	S4-F6 PolarHBondContact O-N 3.3Å; S4-F6 VanDerWaalsContact O-N 3.14Å
5	I	25.6	Very low	27.9	Very low	128 Å²	128	108.4 Å²	108.4	66%	0.656	56%	0.561	S	S	*	*			trans	-71.7	103	160	-61.5	173.9	0	0	0	104.8	I3 D7 Y283	I3-I5 PolarHBondContact O-N 3.48Å; I5-D7 PolarHBondContact O-N 2.97Å; I5-Y283 HydrophobicContact CD1-CD2 4.17Å; I5-Y283 HydrophobicContact CD1-CE2 4.04Å
6	F	24.2	Very low	27.7	Very low	169 Å²	169	108.8 Å²	108.8	74%	0.741	57%	0.57	S	S	*	*			trans	-72	94.6	178.3	-154.7	-95.8	0	0	0	107.7	S4 P8	S4-F6 PolarHBondContact O-N 3.3Å; S4-F6 VanDerWaalsContact O-N 3.14Å; F6-P8 HydrophobicContact CD1-CB 4.27Å; F6-P8 HydrophobicContact CD1-CG 4.34Å; F6-P8 HydrophobicContact CE1-CB 4.31Å; F6-P8 VanDerWaalsContact O-CD 3.29Å; F6-P8 WeakPolarHBondContact O-CD 3.37Å
7	D	28.7	Very low	27.6	Very low	71 Å²	71	112.8 Å²	112.8	38%	0.38	59%	0.585	S	S	.	*			trans	-73.1	109.4	156.1	-167.4	-3.3	0	0	0	105.7	I5 C9 S10	I5-D7 PolarHBondContact O-N 2.97Å; D7-C9 PolarHBondContact O-N 3.25Å; D7-S10 VanDerWaalsContact CG-OG 3.3Å; D7-S10 PolarHBondContact O-N 2.89Å; D7-S10 WeakPolarHBondContact OD2-CB 3.42Å; D7-S10 PolarHBondContact OD2-OG 3.29Å
8	P	30.9	Very low	27.5	Very low	95 Å²	95	116.7 Å²	116.7	62%	0.617	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	-13.5	-169.1	-21.3	32.2	0	0	0	113.8	F6	F6-P8 HydrophobicContact CD1-CB 4.27Å; F6-P8 HydrophobicContact CD1-CG 4.34Å; F6-P8 HydrophobicContact CE1-CB 4.31Å; F6-P8 VanDerWaalsContact O-CD 3.29Å; F6-P8 WeakPolarHBondContact O-CD 3.37Å
9	C	37	Very low	27.5	Very low	43 Å²	43	117.1 Å²	117.1	29%	0.291	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-128.2	-3.1	-170.9	-70.6	0	0	0	0	114.9	D7 C227	D7-C9 PolarHBondContact O-N 3.25Å; C9-C227 HydrophobicContact CB-CB 3.41Å; C9-C227 VanDerWaalsContact CB-CB 3.41Å; C9-C227 WeakPolarHBondContact CB-SG 3.24Å; C9-C227 WeakPolarHBondContact SG-CB 3.49Å; C9-C227 CovalentContact SG-SG 2Å; C9-C227 PolarHBondContact SG-SG 2.81Å
10	S	33	Very low	27.5	Very low	18 Å²	18	117.6 Å²	117.6	13%	0.126	62%	0.618	C	S	.	*			trans	-131.6	103.8	179.7	-28.4	0	0	0	0	107.2	D7 I12	D7-S10 VanDerWaalsContact CG-OG 3.3Å; D7-S10 PolarHBondContact O-N 2.89Å; D7-S10 WeakPolarHBondContact OD2-CB 3.42Å; D7-S10 PolarHBondContact OD2-OG 3.29Å; S10-I12 VanDerWaalsContact CB-CD1 3.47Å; S10-I12 PolarHBondContact O-N 3.45Å
11	G	31	Very low	27.3	Very low	23 Å²	23	121 Å²	121	24%	0.237	63%	0.631	C	S	.	*			trans	-68.2	37.9	171.2	0	0	0	0	0	113.2	N13 Y200	G11-N13 PolarHBondContact O-N 3.19Å; G11-Y200 VanDerWaalsContact N-CE1 3.3Å
12	I	32	Very low	27.5	Very low	82 Å²	82	117.6 Å²	117.6	42%	0.421	62%	0.617	S	S	.	*			trans	-84.2	107.6	-178.4	-54.2	170.7	0	0	0	106.6	S10 F14	S10-I12 VanDerWaalsContact CB-CD1 3.47Å; S10-I12 PolarHBondContact O-N 3.45Å; I12-F14 HydrophobicContact CB-CE2 4.32Å; I12-F14 HydrophobicContact CG2-CD2 3.77Å; I12-F14 HydrophobicContact CG2-CE1 4.34Å; I12-F14 HydrophobicContact CG2-CE2 3.55Å; I12-F14 HydrophobicContact CG2-CG 4.27Å; I12-F14 HydrophobicContact CG2-CZ 3.86Å; I12-F14 PolarHBondContact O-N 3.39Å
13	N	26.8	Very low	27.6	Very low	119 Å²	119	116 Å²	116	64%	0.636	61%	0.614	S	S	*	*			trans	-89.2	100.4	167.3	-145.9	-3.3	0	0	0	106.7	G11 K15	G11-N13 PolarHBondContact O-N 3.19Å; N13-K15 PolarHBondContact O-N 3.26Å
14	F	25	Very low	27.6	Very low	171 Å²	171	120.4 Å²	120.4	75%	0.75	64%	0.639	S	S	*	*			trans	-70.2	98.4	169.6	-75.8	-82.1	0	0	0	107.8	I12 T16	I12-F14 HydrophobicContact CB-CE2 4.32Å; I12-F14 HydrophobicContact CG2-CD2 3.77Å; I12-F14 HydrophobicContact CG2-CE1 4.34Å; I12-F14 HydrophobicContact CG2-CE2 3.55Å; I12-F14 HydrophobicContact CG2-CG 4.27Å; I12-F14 HydrophobicContact CG2-CZ 3.86Å; I12-F14 PolarHBondContact O-N 3.39Å; F14-T16 PolarHBondContact O-N 3.25Å
15	K	26.7	Very low	27.9	Very low	138 Å²	138	122 Å²	122	60%	0.6	65%	0.646	S	S	*	*			trans	-63	115.2	161	-77.2	179	167.1	-173.4	0	107.6	N13 E194	N13-K15 PolarHBondContact O-N 3.26Å; K15-E194 IonicContact NZ-OE2 2.82Å; K15-E194 PolarHBondContact NZ-OE2 3.3Å
16	T	24.9	Very low	27.9	Very low	115 Å²	115	121.7 Å²	121.7	71%	0.706	65%	0.651	S	S	*	*			trans	-73.2	122.2	153.3	48.9	0	0	0	0	106.8	F14 E18	F14-T16 PolarHBondContact O-N 3.25Å; T16-E18 PolarHBondContact O-N 3.07Å
17	E	25	Very low	28.2	Very low	176 Å²	176	122.4 Å²	122.4	82%	0.822	66%	0.658	S	S	*	*			trans	-43	133.4	173.7	-66.6	166.5	157.7	0	0	111.5
18	E	27	Very low	28.1	Very low	183 Å²	183	127.4 Å²	127.4	86%	0.855	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-60.9	140.6	166.4	-73.6	171.3	154.8	0	0	109	T16 V20	T16-E18 PolarHBondContact O-N 3.07Å; E18-V20 PolarHBondContact O-N 2.87Å
19	P	27.5	Very low	28.1	Very low	124 Å²	124	128.3 Å²	128.3	81%	0.805	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-69.9	125.9	165.7	29.9	-27.7	0	0	0	108	E21	P19-E21 PolarHBondContact O-N 3.33Å
20	V	26.4	Very low	27.8	Very low	127 Å²	127	131.3 Å²	131.3	77%	0.77	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-50	125.8	169.5	179.6	0	0	0	0	109	E18 L22	E18-V20 PolarHBondContact O-N 2.87Å; V20-L22 PolarHBondContact O-N 3Å
21	E	24.3	Very low	27.5	Very low	190 Å²	190	139.1 Å²	139.1	89%	0.888	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-56.6	121.2	167.6	-69.9	-178.5	158.3	0	0	108.6	P19	P19-E21 PolarHBondContact O-N 3.33Å
22	L	30.5	Very low	27.6	Very low	153 Å²	153	148 Å²	148	80%	0.801	77%	0.773	S	S	*	*			trans	-122.5	129.5	163.6	-80	170.7	0	0	0	107.5	V20	V20-L22 PolarHBondContact O-N 3Å
23	D	26.7	Very low	27.2	Very low	154 Å²	154	149.1 Å²	149.1	82%	0.824	79%	0.788	S	S	*	*			trans	-51.3	140.3	-164.8	-60.1	-69	0	0	0	115.3
24	D	24.1	Very low	27.4	Very low	160 Å²	160	150 Å²	150	86%	0.856	80%	0.798	S	S	*	*			trans	-60.2	147.1	163.3	-79.5	-42.7	0	0	0	111.1
25	P	29.6	Very low	27.3	Very low	122 Å²	122	146.7 Å²	146.7	79%	0.792	80%	0.795	S	S	*	*				-129.2	118.3	126.6	31.2	-19.1	0	0	0	112.5
26	V	24	Very low	27.6	Very low	123 Å²	123	149.3 Å²	149.3	75%	0.745	81%	0.807	S	S	*	*			trans	1	119.7	143.8	-177.4	0	0	0	0	115.8
27	M	30.9	Very low	27.6	Very low	183 Å²	183	151.2 Å²	151.2	90%	0.901	81%	0.813	S	S	*	*			trans	-152	145.8	135	-98.7	-54.9	-165	0	0	111.9
28	K	27.6	Very low	27.9	Very low	177 Å²	177	149.3 Å²	149.3	77%	0.77	81%	0.813	S	S	*	*			trans	-83.3	170.7	-159.6	-73.1	159.8	165.2	170.1	0	114.5
29	S	29.5	Very low	27.9	Very low	113 Å²	113	147.8 Å²	147.8	79%	0.79	81%	0.811	S	S	*	*			trans	86.2	138	150.6	78.7	0	0	0	0	116.4
30	S	31.4	Very low	27.8	Very low	106 Å²	106	148.5 Å²	148.5	74%	0.741	81%	0.812	S	S	*	*			cis	-159.9	145.5	-1.1	-96	0	0	0	0	110.5
31	Q	26.4	Very low	27.9	Very low	183 Å²	183	148.3 Å²	148.3	86%	0.855	81%	0.811	S	S	*	*			trans	0.9	131.6	153.9	-60.8	175.4	-28.8	0	0	119.8
32	K	32.3	Very low	28.1	Very low	210 Å²	210	144.3 Å²	144.3	91%	0.913	80%	0.802	S	S	*	*				-160.4	124.4	113.7	-109.7	173.1	-176.5	178.6	0	112.2
33	S	25.1	Very low	27.9	Very low	104 Å²	104	146 Å²	146	73%	0.727	81%	0.806	S	S	*	*			trans	-69	139.6	173	39.9	0	0	0	0	112.6
34	V	29.5	Very low	28	Very low	138 Å²	138	148.2 Å²	148.2	84%	0.836	81%	0.808	S	S	*	*			trans	-146.1	113.1	137.7	-176.9	0	0	0	0	108.5
35	S	24.9	Very low	28	Very low	101 Å²	101	148.1 Å²	148.1	71%	0.706	81%	0.808	S	S	*	*			trans	-65.6	137.2	171.1	-36.9	0	0	0	0	111.1
36	K	32.9	Very low	27.9	Very low	193 Å²	193	149.5 Å²	149.5	84%	0.839	81%	0.807	S	S	*	*			trans	-143.9	126.3	147.2	-76.3	-163.9	178.5	176.8	0	109.8
37	D	25	Very low	27.9	Very low	155 Å²	155	153 Å²	153	83%	0.829	81%	0.812	S	S	*	*			trans	-60.4	132.7	-173.7	-51.9	-72.6	0	0	0	112.4
38	V	30	Very low	27.7	Very low	136 Å²	136	150.2 Å²	150.2	82%	0.824	81%	0.805	S	S	*	*			trans	-122.7	112.7	158.8	179.9	0	0	0	0	107.1	V40	V38-V40 PolarHBondContact O-N 3.24Å
39	N	27.8	Very low	27.6	Very low	151 Å²	151	148.6 Å²	148.6	81%	0.807	80%	0.8	S	S	*	*			trans	-45.9	117	173.3	-83.4	-52.7	0	0	0	111.8
40	V	25	Very low	27.3	Very low	139 Å²	139	151 Å²	151	84%	0.842	80%	0.804	S	S	*	*			trans	-84.6	110	160	177.3	0	0	0	0	106.7	V38	V38-V40 PolarHBondContact O-N 3.24Å
41	V	28.6	Very low	27.2	Very low	124 Å²	124	154.2 Å²	154.2	75%	0.752	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-83.7	133.5	167.7	-178.7	0	0	0	0	107.3
42	P	28.5	Very low	27.1	Very low	106 Å²	106	153.5 Å²	153.5	69%	0.688	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-77.1	141.8	-169.1	30	-31.6	0	0	0	111.9	K44	P42-K44 PolarHBondContact O-N 3.39Å
43	E	26.9	Very low	27.1	Very low	189 Å²	189	151.7 Å²	151.7	88%	0.883	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-58	123.3	172.3	-67.4	-178.5	148.2	0	0	109.8
44	K	29.1	Very low	27.3	Very low	199 Å²	199	149.9 Å²	149.9	87%	0.865	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-80.6	118.6	168.7	-76.2	-178.7	176.4	180	0	108.3	P42 I46	P42-K44 PolarHBondContact O-N 3.39Å; K44-I46 PolarHBondContact O-N 2.97Å
45	D	23.3	Very low	27.1	Very low	159 Å²	159	150.5 Å²	150.5	85%	0.85	79%	0.79	S	S	*	*			trans	-50.1	105.7	170.8	-64	-58	0	0	0	111.6	K47	D45-K47 PolarHBondContact O-N 3.45Å
46	I	27.2	Very low	27.4	Very low	151 Å²	151	150.8 Å²	150.8	77%	0.774	79%	0.79	S	S	*	*			trans	-89.3	100.8	161.2	-61.4	175.6	0	0	0	106	K44 V48	K44-I46 PolarHBondContact O-N 2.97Å; I46-V48 PolarHBondContact O-N 3.46Å
47	K	24.7	Very low	27.2	Very low	195 Å²	195	145.1 Å²	145.1	85%	0.848	78%	0.779	S	S	*	*			trans	-54	109.4	167.2	-74.5	179.1	175.1	-179.8	0	108.9	D45 E49	D45-K47 PolarHBondContact O-N 3.45Å; K47-E49 PolarHBondContact O-N 2.87Å
48	V	26.7	Very low	27.3	Very low	126 Å²	126	145.2 Å²	145.2	76%	0.764	78%	0.779	S	S	*	*			trans	-85.2	103.8	165.1	-178.1	0	0	0	0	105.9	I46 D50	I46-V48 PolarHBondContact O-N 3.46Å; V48-D50 PolarHBondContact O-N 3.22Å
49	E	25	Very low	27.3	Very low	142 Å²	142	143.1 Å²	143.1	66%	0.664	77%	0.767	S	S	*	*			trans	-66.1	122.9	169.5	-71.7	-176.9	157.9	0	0	109.5	K47 R51	K47-E49 PolarHBondContact O-N 2.87Å; E49-R51 VanDerWaalsContact C-N 3.34Å; E49-R51 PolarHBondContact O-N 3.46Å; E49-R51 IonicContact OE2-NH2 3.35Å
50	D	24	Very low	27.5	Very low	164 Å²	164	141.3 Å²	141.3	88%	0.877	76%	0.757	S	S	*	*			trans	-60.7	90.5	169	-75.4	-45.7	0	0	0	110.3	V48 N52	V48-D50 PolarHBondContact O-N 3.22Å; D50-N52 PolarHBondContact O-N 3.43Å
51	R	28.4	Very low	28.1	Very low	174 Å²	174	138.6 Å²	138.6	66%	0.657	74%	0.737	S	S	*	*			trans	-87.4	97.1	164.1	-67	-170.3	-170.1	-178.3	3.4	108.9	E49 F53	E49-R51 VanDerWaalsContact C-N 3.34Å; E49-R51 PolarHBondContact O-N 3.46Å; E49-R51 IonicContact OE2-NH2 3.35Å; R51-F53 HydrophobicContact CB-CD2 3.82Å; R51-F53 HydrophobicContact CB-CE2 3.37Å; R51-F53 HydrophobicContact CB-CZ 4.07Å; R51-F53 HydrophobicContact CG-CE2 4.35Å; R51-F53 VanDerWaalsContact O-CD2 3.28Å; R51-F53 WeakPolarHBondContact O-CD2 3.38Å; R51-F53 PolarHBondContact O-N 3.04Å
52	N	25.1	Very low	28.4	Very low	167 Å²	167	139.4 Å²	139.4	89%	0.893	74%	0.738	S	S	*	*			trans	-58.8	95.3	165.4	-141.9	-7.7	0	0	0	108.4	D50 G54	D50-N52 PolarHBondContact O-N 3.43Å; N52-G54 PolarHBondContact O-N 2.88Å
53	F	32.5	Very low	29	Very low	173 Å²	173	142.7 Å²	142.7	76%	0.759	74%	0.744	S	S	*	*			trans	-90.5	103.7	175.4	-80.2	-77.2	0	0	0	109.6	R51	R51-F53 HydrophobicContact CB-CD2 3.82Å; R51-F53 HydrophobicContact CB-CE2 3.37Å; R51-F53 HydrophobicContact CB-CZ 4.07Å; R51-F53 HydrophobicContact CG-CE2 4.35Å; R51-F53 VanDerWaalsContact O-CD2 3.28Å; R51-F53 WeakPolarHBondContact O-CD2 3.38Å; R51-F53 PolarHBondContact O-N 3.04Å
54	G	28.6	Very low	29.8	Very low	65 Å²	65	136.3 Å²	136.3	67%	0.67	72%	0.716	S	S	*	*			trans	-55.3	161.1	171	0	0	0	0	0	113.5	N52	N52-G54 PolarHBondContact O-N 2.88Å
55	N	25.4	Very low	30.3	Very low	151 Å²	151	129 Å²	129	81%	0.807	70%	0.697	S	S	*	*			trans	-52.5	119	179.7	-155.8	11.8	0	0	0	111.5	A57	N55-A57 PolarHBondContact O-N 3.24Å
56	P	30.4	Very low	31.3	Very low	108 Å²	108	123.6 Å²	123.6	70%	0.701	67%	0.667	S	S	*	*			trans	-85.9	73.5	175.1	34.4	-29.3	0	0	0	108.3	V59	P56-V59 HydrophobicContact CB-CG2 4.1Å
57	A	28.3	Very low	32.3	Very low	73 Å²	73	121.3 Å²	121.3	60%	0.603	66%	0.656	S	S	*	*	S	Bend	trans	-89.2	-12.9	165.9	0	0	0	0	0	112.1	N55	N55-A57 PolarHBondContact O-N 3.24Å
58	D	27.3	Very low	33.3	Very low	157 Å²	157	119 Å²	119	84%	0.84	64%	0.641	S	S	*	*			trans	-132.4	72.4	-175.9	-64.5	-49.4	0	0	0	111.8
59	V	31.1	Very low	34.2	Very low	92 Å²	92	115.8 Å²	115.8	56%	0.558	62%	0.62	S	S	*	*			trans	-112.1	111.6	164.6	-164.3	0	0	0	0	108	P56 L61	P56-V59 HydrophobicContact CB-CG2 4.1Å; V59-L61 PolarHBondContact O-N 3.05Å
60	N	31.7	Very low	34.8	Very low	113 Å²	113	113.8 Å²	113.8	60%	0.604	61%	0.614	S	S	*	*			trans	-62.6	128.3	-177.4	-163.9	-10.8	0	0	0	110.4	D62	N60-D62 PolarHBondContact O-N 3Å
61	L	36.9	Very low	35.4	Very low	82 Å²	82	113.7 Å²	113.7	43%	0.429	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.2	-9.4	-168.1	-83.9	160.6	0	0	0	114.2	V59 I66	V59-L61 PolarHBondContact O-N 3.05Å; L61-I66 HydrophobicContact CD2-CD1 4.41Å
62	D	34.8	Very low	35.4	Very low	142 Å²	142	111 Å²	111	76%	0.759	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-16.9	-176.9	-62.2	-25.5	0	0	0	113.3	N60 L64	N60-D62 PolarHBondContact O-N 3Å; D62-L64 PolarHBondContact O-N 3.36Å
63	E	40.7	Very low	35.7	Very low	174 Å²	174	108.4 Å²	108.4	81%	0.813	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-7.9	178	-93.4	-171.5	152.1	0	0	114.4
64	L	44.7	Very low	35.5	Very low	56 Å²	56	107.6 Å²	107.6	29%	0.293	62%	0.615	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.4	6.6	-174.2	-66.8	179.3	0	0	0	114.9	D62 I66 L146	D62-L64 PolarHBondContact O-N 3.36Å; L64-I66 HydrophobicContact CB-CD1 4.21Å; L64-I66 HydrophobicContact CB-CG1 4.02Å; L64-I66 PolarHBondContact O-N 2.95Å; L64-L146 HydrophobicContact CD1-CD2 3.6Å
65	G	39.3	Very low	35.4	Very low	45 Å²	45	112.6 Å²	112.6	46%	0.464	63%	0.625	S	S	.	*			trans	55.5	37.6	174.3	0	0	0	0	0	113.7	I67	G65-I67 PolarHBondContact O-N 3.49Å
66	I	44.3	Very low	35.4	Very low	45 Å²	45	114 Å²	114	23%	0.231	63%	0.627	C	S	.	*			trans	-78.9	100.9	-178.2	-56.7	175	0	0	0	108.5	L61 L64 Y130 L145 L146	L61-I66 HydrophobicContact CD2-CD1 4.41Å; L64-I66 HydrophobicContact CB-CD1 4.21Å; L64-I66 HydrophobicContact CB-CG1 4.02Å; L64-I66 PolarHBondContact O-N 2.95Å; I66-Y130 HydrophobicContact CG2-CD1 4.32Å; I66-L145 HydrophobicContact CG1-CD2 4.32Å; I66-L145 HydrophobicContact CG2-CD2 4.17Å; I66-L146 HydrophobicContact CD1-CD2 4.35Å
67	I	48.7	Very low	35.1	Very low	104 Å²	104	117.5 Å²	117.5	53%	0.533	63%	0.634	S	S	.	*			trans	-83.6	125.6	171.9	-54.7	175.5	0	0	0	108.1	G65 D69	G65-I67 PolarHBondContact O-N 3.49Å; I67-D69 WeakPolarHBondContact CG2-OD1 3.42Å
68	R	45	Very low	35	Very low	145 Å²	145	118.4 Å²	118.4	55%	0.547	64%	0.636	S	S	.	*	B	Isolated β-bridge	trans	-99	98.5	171.5	-172.8	-179.8	-177.9	176.9	-1.3	107.5	N70	R68-N70 PolarHBondContact O-N 3.38Å
69	D	45.8	Very low	34.9	Very low	60 Å²	60	121.1 Å²	121.1	32%	0.321	64%	0.641	S	S	.	*			trans	-80.8	108.7	176.3	-74.9	-29.7	0	0	0	110.1	I67	I67-D69 WeakPolarHBondContact CG2-OD1 3.42Å
70	N	37.7	Very low	34.5	Very low	99 Å²	99	125.8 Å²	125.8	53%	0.529	65%	0.653	S	S	.	*			trans	-98.3	82.3	165.7	-72.7	-14.6	0	0	0	107.6	R68 S72	R68-N70 PolarHBondContact O-N 3.38Å; N70-S72 PolarHBondContact O-N 2.87Å
71	Q	37.2	Very low	34.3	Very low	163 Å²	163	129.2 Å²	129.2	76%	0.762	67%	0.665	S	S	*	*			trans	-90.6	90.8	169.4	-71.7	-169	0.7	0	0	109.5
72	S	28.5	Very low	33.6	Very low	118 Å²	118	132.7 Å²	132.7	83%	0.825	68%	0.679	S	S	*	*			trans	-83.8	106.6	164.5	-48.1	0	0	0	0	108.3	N70	N70-S72 PolarHBondContact O-N 2.87Å
73	S	31.6	Very low	33.2	Very low	111 Å²	111	132 Å²	132	78%	0.776	68%	0.684	S	S	*	*			trans	-135.1	132.9	161.2	58.2	0	0	0	0	109.2
74	N	26.7	Very low	32.3	Very low	157 Å²	157	130.6 Å²	130.6	84%	0.84	68%	0.682	S	S	*	*			trans	-45.6	133.2	-169.8	-74.7	-41.4	0	0	0	114.9
75	L	28.3	Very low	31.5	Very low	170 Å²	170	133 Å²	133	89%	0.89	70%	0.703	S	S	*	*			trans	-154	93.9	141.1	-99.9	150.9	0	0	0	107.2	E77	L75-E77 PolarHBondContact O-N 3.2Å
76	E	23.6	Very low	31	Very low	180 Å²	180	138.4 Å²	138.4	84%	0.841	72%	0.722	S	S	*	*			trans	-61.6	121.8	152.3	-71.3	-176.5	142.6	0	0	107.3
77	E	26	Very low	30.1	Very low	181 Å²	181	146.1 Å²	146.1	85%	0.846	75%	0.754	S	S	*	*				178.7	119.9	129.6	-101	178.9	165.1	0	0	111.6	L75	L75-E77 PolarHBondContact O-N 3.2Å
78	S	24.3	Very low	29.1	Very low	93 Å²	93	145.8 Å²	145.8	65%	0.65	77%	0.767	S	S	*	*			trans	51.8	99.6	146.5	56.7	0	0	0	0	119.8
79	F	25.3	Very low	28.3	Very low	214 Å²	214	144.9 Å²	144.9	94%	0.939	78%	0.779	S	S	*	*				-148.8	98.7	128.1	-95	-76	0	0	0	109.4	H81	F79-H81 PolarHBondContact O-N 3.24Å
80	K	23.7	Very low	27.5	Very low	190 Å²	190	145.4 Å²	145.4	83%	0.826	80%	0.799	S	S	*	*			trans	-66	124.9	162.2	-72.5	176.3	175	-177.6	0	107.7
81	H	27.9	Very low	27.2	Very low	184 Å²	184	147.9 Å²	147.9	85%	0.852	82%	0.818	S	S	*	*			trans	-127.8	99.9	153.8	-134.7	-44.3	0	0	0	108.1	F79	F79-H81 PolarHBondContact O-N 3.24Å
82	E	21.8	Very low	26.8	Very low	155 Å²	155	147.8 Å²	147.8	72%	0.724	82%	0.822	S	S	*	*			trans	-62.9	136.4	163.1	-71.3	165	166	0	0	108.8
83	C	25.7	Very low	26.9	Very low	128 Å²	128	148.8 Å²	148.8	87%	0.865	82%	0.819	S	S	*	*			trans	-139.4	83.8	154.8	65.8	0	0	0	0	108.6
84	D	22.5	Very low	26.9	Very low	145 Å²	145	151.4 Å²	151.4	78%	0.775	82%	0.823	S	S	*	*			trans	-76.1	172.8	156.6	-82.8	-47	0	0	0	110.8
85	S	28.5	Very low	27.1	Very low	105 Å²	105	148.6 Å²	148.6	73%	0.734	81%	0.811	S	S	*	*			trans	89.2	128.3	177.2	62.5	0	0	0	0	116.6
86	D	28.3	Very low	27.5	Very low	159 Å²	159	145.4 Å²	145.4	85%	0.85	80%	0.799	S	S	*	*			cis	-163.9	154.1	-5.3	-96.6	-40	0	0	0	109.1
87	K	26	Very low	28.3	Very low	207 Å²	207	143.4 Å²	143.4	90%	0.9	79%	0.794	S	S	*	*			trans	-76.9	145.6	167.7	-88.7	176.1	173.4	175	0	111
88	A	26.1	Very low	29	Very low	98 Å²	98	144.2 Å²	144.2	81%	0.81	79%	0.79	S	S	*	*			trans	-157	155.1	143.6	0	0	0	0	0	112.1
89	P	29.1	Very low	29.6	Very low	125 Å²	125	142.3 Å²	142.3	81%	0.812	78%	0.779	S	S	*	*			trans	-113.4	163.3	-149.4	37.1	-23.5	0	0	0	116.2
90	G	30	Very low	30.6	Very low	72 Å²	72	137 Å²	137	74%	0.742	76%	0.76	S	S	*	*			trans	37.8	124.3	149.2	0	0	0	0	0	122.3
91	V	31	Very low	31.6	Very low	151 Å²	151	135.4 Å²	135.4	92%	0.915	75%	0.753	S	S	*	*			trans	-159.6	150.7	135	-88	0	0	0	0	110.8
92	D	27.4	Very low	32.3	Very low	160 Å²	160	131.8 Å²	131.8	86%	0.856	74%	0.739	S	S	*	*			trans	-72	169.5	-160	-61.3	-60.1	0	0	0	118.2
93	D	31.6	Very low	33.4	Very low	140 Å²	140	127.5 Å²	127.5	75%	0.749	73%	0.726	S	S	*	*			trans	-40.4	137.1	179.8	-72.1	-48.2	0	0	0	117.2
94	L	30.8	Very low	34.4	Very low	165 Å²	165	126.4 Å²	126.4	86%	0.864	71%	0.708	S	S	*	*			trans	157.2	52.7	136.5	-82.3	166.1	0	0	0	113.5
95	V	31.6	Very low	35.5	Very low	98 Å²	98	123.8 Å²	123.8	59%	0.594	69%	0.694	S	S	*	*			trans	-152.8	72.4	159.6	-168.8	0	0	0	0	110.8	D97 R98 A99	V95-D97 PolarHBondContact O-N 2.82Å; V95-R98 HydrophobicContact CG1-CB 4.03Å; V95-A99 VanDerWaalsContact O-CB 3.22Å; V95-A99 WeakPolarHBondContact O-CB 3.45Å
96	T	37.3	Very low	36.7	Very low	104 Å²	104	123.4 Å²	123.4	64%	0.638	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-9.3	-167.6	35.4	0	0	0	0	117.1	I100	T96-I100 WeakPolarHBondContact O-CD1 3.32Å; T96-I100 WeakPolarHBondContact O-CG1 3.39Å
97	D	38.7	Very low	37.8	Very low	138 Å²	138	124.9 Å²	124.9	74%	0.738	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	-29.5	178.1	-83.6	-22.1	0	0	0	115.5	V95	V95-D97 PolarHBondContact O-N 2.82Å
98	R	41.8	Very low	39	Very low	198 Å²	198	118.5 Å²	118.5	75%	0.747	65%	0.653	S	S	*	*	H	α-helix	trans	-84.2	-30.4	178	-146.2	170.7	-174	156.5	-0.9	111.8	V95 L102	V95-R98 HydrophobicContact CG1-CB 4.03Å; R98-L102 PolarHBondContact O-N 2.96Å
99	A	36.5	Very low	40.4	Very low	53 Å²	53	119.9 Å²	119.9	44%	0.438	64%	0.641	S	S	.	*	H	α-helix	trans	-68.7	-31.8	174.6	0	0	0	0	0	112.5	V95 S103	V95-A99 VanDerWaalsContact O-CB 3.22Å; V95-A99 WeakPolarHBondContact O-CB 3.45Å; A99-S103 VanDerWaalsContact O-CB 3.24Å; A99-S103 WeakPolarHBondContact O-CB 3.49Å; A99-S103 PolarHBondContact O-N 3.13Å; A99-S103 PolarHBondContact O-OG 3.48Å; A99-S103 VanDerWaalsContact O-OG 3.08Å
100	I	46.9	Very low	41.8	Very low	103 Å²	103	118.9 Å²	118.9	53%	0.528	63%	0.628	S	S	.	*	H	α-helix	trans	-69.8	-40.2	177.2	-65.3	174.3	0	0	0	111.8	T96 S103 H104	T96-I100 WeakPolarHBondContact O-CD1 3.32Å; T96-I100 WeakPolarHBondContact O-CG1 3.39Å; I100-S103 WeakPolarHBondContact CA-OG 3.48Å; I100-S103 PolarHBondContact O-N 3.42Å; I100-S103 PolarHBondContact O-OG 2.77Å; I100-H104 VanDerWaalsContact O-CB 3.23Å; I100-H104 WeakPolarHBondContact O-CB 3.23Å; I100-H104 PolarHBondContact O-N 3.31Å
101	K	44.3	Very low	43.5	Very low	156 Å²	156	122.2 Å²	122.2	68%	0.678	62%	0.623	S	S	*	*	H	α-helix	trans	-65.7	-43.6	175.9	-81.2	179.4	-179.4	170.2	0	112	H104 D105	K101-H104 PolarHBondContact O-N 2.95Å; K101-D105 WeakPolarHBondContact O-CB 3.48Å; K101-D105 PolarHBondContact O-N 3.38Å
102	L	43.5	Very low	45.5	Very low	108 Å²	108	118.2 Å²	118.2	57%	0.565	60%	0.601	S	S	*	*	H	α-helix	trans	-66	-41	176.3	-77.7	162.7	0	0	0	111.7	R98 D105 L106	R98-L102 PolarHBondContact O-N 2.96Å; L102-D105 PolarHBondContact O-N 3.44Å; L102-L106 WeakPolarHBondContact O-CB 3.37Å; L102-L106 WeakPolarHBondContact O-CG 3.43Å; L102-L106 PolarHBondContact O-N 3.08Å
103	S	43.2	Very low	47.7	Very low	65 Å²	65	115.9 Å²	115.9	46%	0.455	59%	0.588	S	S	.	*	H	α-helix	trans	-68.9	-34.5	176.6	70.3	0	0	0	0	112.5	A99 I100 R107	A99-S103 VanDerWaalsContact O-CB 3.24Å; A99-S103 WeakPolarHBondContact O-CB 3.49Å; A99-S103 PolarHBondContact O-N 3.13Å; A99-S103 PolarHBondContact O-OG 3.48Å; A99-S103 VanDerWaalsContact O-OG 3.08Å; I100-S103 WeakPolarHBondContact CA-OG 3.48Å; I100-S103 PolarHBondContact O-N 3.42Å; I100-S103 PolarHBondContact O-OG 2.77Å; S103-R107 WeakPolarHBondContact O-CB 3.5Å; S103-R107 PolarHBondContact O-N 3.38Å
104	H	48.3	Very low	49.8	Very low	105 Å²	105	115 Å²	115	49%	0.486	58%	0.577	S	S	.	*	H	α-helix	trans	-69.6	-40.2	173.1	-168.8	-98.6	0	0	0	111.7	I100 K101 R107 N108	I100-H104 VanDerWaalsContact O-CB 3.23Å; I100-H104 WeakPolarHBondContact O-CB 3.23Å; I100-H104 PolarHBondContact O-N 3.31Å; K101-H104 PolarHBondContact O-N 2.95Å; H104-R107 PolarHBondContact O-N 3.47Å; H104-N108 PolarHBondContact CE1-ND2 3.28Å; H104-N108 PolarHBondContact ND1-ND2 3.43Å; H104-N108 WeakPolarHBondContact O-CB 3.47Å; H104-N108 PolarHBondContact O-N 3.2Å; H104-N108 PolarHBondContact O-ND2 3.01Å; H104-N108 VanDerWaalsContact O-ND2 3.17Å
105	D	45.5	Very low	52.1	Low	90 Å²	90	110.5 Å²	110.5	48%	0.481	56%	0.557	S	S	.	*	H	α-helix	trans	-68.1	-37.3	175.2	-78	-15.9	0	0	0	112.3	K101 L102 K109	K101-D105 WeakPolarHBondContact O-CB 3.48Å; K101-D105 PolarHBondContact O-N 3.38Å; L102-D105 PolarHBondContact O-N 3.44Å; D105-K109 WeakPolarHBondContact O-CB 3.31Å; D105-K109 VanDerWaalsContact O-CG 3.26Å; D105-K109 WeakPolarHBondContact O-CG 3.43Å; D105-K109 PolarHBondContact O-N 2.88Å
106	L	52.2	Low	54.6	Low	96 Å²	96	110.1 Å²	110.1	50%	0.503	56%	0.555	S	S	.	*	H	α-helix	trans	-68.1	-48	172.4	-70.3	171.4	0	0	0	110.9	L102 N108 K109 D110	L102-L106 WeakPolarHBondContact O-CB 3.37Å; L102-L106 WeakPolarHBondContact O-CG 3.43Å; L102-L106 PolarHBondContact O-N 3.08Å; L106-N108 VanDerWaalsContact C-N 3.3Å; L106-N108 PolarHBondContact O-N 3.4Å; L106-K109 CarbonylContact O-C 3.57Å; L106-K109 WeakPolarHBondContact O-CB 3.41Å; L106-K109 PolarHBondContact O-N 3.28Å; L106-K109 VanDerWaalsContact O-N 3.09Å; L106-D110 VanDerWaalsContact O-CG 3.24Å; L106-D110 PolarHBondContact O-N 3.26Å
107	R	52.8	Low	56.7	Low	191 Å²	191	112.2 Å²	112.2	72%	0.721	55%	0.551	S	S	*	*	H	α-helix	trans	-60.8	-36.6	176.2	-176.4	-179.9	-88.7	-169.5	-4.9	112.3	S103 H104 D110 F111	S103-R107 WeakPolarHBondContact O-CB 3.5Å; S103-R107 PolarHBondContact O-N 3.38Å; H104-R107 PolarHBondContact O-N 3.47Å; R107-D110 PolarHBondContact O-N 3.24Å; R107-F111 VanDerWaalsContact O-CB 3.29Å; R107-F111 WeakPolarHBondContact O-CB 3.35Å; R107-F111 PolarHBondContact O-N 3.33Å
108	N	51.2	Low	58.9	Low	73 Å²	73	108.1 Å²	108.1	39%	0.39	53%	0.529	S	S	.	.	H	α-helix	trans	-69.9	-38.2	174.4	-76.8	-24.3	0	0	0	112.4	H104 L106 S112	H104-N108 PolarHBondContact CE1-ND2 3.28Å; H104-N108 PolarHBondContact ND1-ND2 3.43Å; H104-N108 WeakPolarHBondContact O-CB 3.47Å; H104-N108 PolarHBondContact O-N 3.2Å; H104-N108 PolarHBondContact O-ND2 3.01Å; H104-N108 VanDerWaalsContact O-ND2 3.17Å; L106-N108 VanDerWaalsContact C-N 3.3Å; L106-N108 PolarHBondContact O-N 3.4Å; N108-S112 WeakPolarHBondContact O-CB 3.34Å; N108-S112 PolarHBondContact O-N 3.14Å
109	K	54.8	Low	60.9	Low	127 Å²	127	101.5 Å²	101.5	55%	0.552	51%	0.508	S	S	*	.	H	α-helix	trans	-63.6	-45.3	172	-77.4	172	-175.3	172.7	0	110.6	D105 L106 S112 I113	D105-K109 WeakPolarHBondContact O-CB 3.31Å; D105-K109 VanDerWaalsContact O-CG 3.26Å; D105-K109 WeakPolarHBondContact O-CG 3.43Å; D105-K109 PolarHBondContact O-N 2.88Å; L106-K109 CarbonylContact O-C 3.57Å; L106-K109 WeakPolarHBondContact O-CB 3.41Å; L106-K109 PolarHBondContact O-N 3.28Å; L106-K109 VanDerWaalsContact O-N 3.09Å; K109-S112 PolarHBondContact O-N 2.87Å; K109-I113 WeakPolarHBondContact O-CB 3.31Å; K109-I113 VanDerWaalsContact O-CG1 3.22Å; K109-I113 WeakPolarHBondContact O-CG1 3.34Å; K109-I113 PolarHBondContact O-N 3.32Å
110	D	59	Low	63	Low	103 Å²	103	103.8 Å²	103.8	55%	0.551	51%	0.51	S	S	*	.	H	α-helix	trans	-62.9	-44.1	178.2	-65.7	-22.6	0	0	0	111.4	L106 R107 S112 I113 K114	L106-D110 VanDerWaalsContact O-CG 3.24Å; L106-D110 PolarHBondContact O-N 3.26Å; R107-D110 PolarHBondContact O-N 3.24Å; D110-S112 PolarHBondContact O-N 3.04Å; D110-I113 PolarHBondContact O-N 3.33Å; D110-K114 WeakPolarHBondContact O-CB 3.48Å; D110-K114 PolarHBondContact O-N 3.25Å
111	F	64.7	Low	64.6	Low	143 Å²	143	101.3 Å²	101.3	63%	0.627	50%	0.497	S	S	*	.	H	α-helix	trans	-63.2	-41.4	174.2	-175.8	-97.6	0	0	0	112	R107 K114 T115	R107-F111 VanDerWaalsContact O-CB 3.29Å; R107-F111 WeakPolarHBondContact O-CB 3.35Å; R107-F111 PolarHBondContact O-N 3.33Å; F111-K114 PolarHBondContact O-N 2.7Å; F111-T115 WeakPolarHBondContact O-CB 3.44Å; F111-T115 PolarHBondContact O-N 3.43Å; F111-T115 PolarHBondContact O-OG1 2.98Å
112	S	72.6	Confident	66.6	Low	67 Å²	67	98.4 Å²	98.4	47%	0.469	48%	0.484	S	S	.	.	H	α-helix	trans	-66.3	-42.6	177.8	-179.1	0	0	0	0	112.2	N108 K109 D110 T115 T116	N108-S112 WeakPolarHBondContact O-CB 3.34Å; N108-S112 PolarHBondContact O-N 3.14Å; K109-S112 PolarHBondContact O-N 2.87Å; D110-S112 PolarHBondContact O-N 3.04Å; S112-T115 PolarHBondContact O-N 2.9Å; S112-T116 WeakPolarHBondContact O-CB 3.48Å; S112-T116 PolarHBondContact O-N 3.28Å; S112-T116 PolarHBondContact O-OG1 2.72Å
113	I	74.2	Confident	68.5	Low	111 Å²	111	95.3 Å²	95.3	57%	0.569	47%	0.47	S	S	*	.	H	α-helix	trans	-65.7	-45.8	175.7	-68.1	164.4	0	0	0	109.7	K109 D110 T115 T116 R117	K109-I113 WeakPolarHBondContact O-CB 3.31Å; K109-I113 VanDerWaalsContact O-CG1 3.22Å; K109-I113 WeakPolarHBondContact O-CG1 3.34Å; K109-I113 PolarHBondContact O-N 3.32Å; D110-I113 PolarHBondContact O-N 3.33Å; I113-T115 PolarHBondContact O-N 3.32Å; I113-T116 PolarHBondContact O-N 3.47Å; I113-R117 WeakPolarHBondContact O-CB 3.45Å; I113-R117 PolarHBondContact O-N 2.85Å
114	K	75.8	Confident	70.3	Confident	122 Å²	122	95 Å²	95	53%	0.53	47%	0.471	S	S	.	.	H	α-helix	trans	-57.3	-48.8	175.7	-175.1	176.5	179.3	179	0	111.2	D110 F111 T116 R117 D118	D110-K114 WeakPolarHBondContact O-CB 3.48Å; D110-K114 PolarHBondContact O-N 3.25Å; F111-K114 PolarHBondContact O-N 2.7Å; K114-T116 VanDerWaalsContact C-N 3.3Å; K114-T116 PolarHBondContact O-N 2.78Å; K114-R117 PolarHBondContact O-N 3.43Å; K114-D118 WeakPolarHBondContact O-CB 3.45Å; K114-D118 PolarHBondContact O-N 3.14Å
115	T	80.2	Confident	71.8	Confident	70 Å²	70	96.6 Å²	96.6	43%	0.429	48%	0.478	S	S	.	.	H	α-helix	trans	-61	-39.8	177.5	-53.3	0	0	0	0	112	F111 S112 I113 L119	F111-T115 WeakPolarHBondContact O-CB 3.44Å; F111-T115 PolarHBondContact O-N 3.43Å; F111-T115 PolarHBondContact O-OG1 2.98Å; S112-T115 PolarHBondContact O-N 2.9Å; I113-T115 PolarHBondContact O-N 3.32Å; T115-L119 WeakPolarHBondContact O-CB 3.39Å; T115-L119 PolarHBondContact O-N 2.89Å
116	T	82.8	Confident	73.7	Confident	90 Å²	90	96.9 Å²	96.9	55%	0.552	48%	0.477	S	S	*	.	H	α-helix	trans	-67.1	-41.4	177.3	-55.2	0	0	0	0	111.3	S112 I113 K114 L119 H120	S112-T116 WeakPolarHBondContact O-CB 3.48Å; S112-T116 PolarHBondContact O-N 3.28Å; S112-T116 PolarHBondContact O-OG1 2.72Å; I113-T116 PolarHBondContact O-N 3.47Å; K114-T116 VanDerWaalsContact C-N 3.3Å; K114-T116 PolarHBondContact O-N 2.78Å; T116-L119 PolarHBondContact O-N 3.04Å; T116-H120 PolarHBondContact O-N 3.21Å
117	R	80.8	Confident	75	Confident	147 Å²	147	94.2 Å²	94.2	56%	0.555	47%	0.472	S	S	*	.	H	α-helix	trans	-65.3	-45	175.9	-169.1	-170.9	72.2	147.4	4.9	111.2	I113 K114 L119 H120 I121	I113-R117 WeakPolarHBondContact O-CB 3.45Å; I113-R117 PolarHBondContact O-N 2.85Å; K114-R117 PolarHBondContact O-N 3.43Å; R117-L119 VanDerWaalsContact C-N 3.28Å; R117-L119 PolarHBondContact O-N 2.71Å; R117-H120 CarbonylContact O-C 3.55Å; R117-H120 WeakPolarHBondContact O-CB 3.33Å; R117-H120 PolarHBondContact O-N 3.41Å; R117-H120 VanDerWaalsContact O-N 3.12Å; R117-I121 HydrophobicContact CG-CD1 4.06Å; R117-I121 WeakPolarHBondContact O-CG1 3.48Å; R117-I121 PolarHBondContact O-N 3.3Å
118	D	85	Confident	76.5	Confident	53 Å²	53	85.8 Å²	85.8	28%	0.283	44%	0.441	S	S	.	.	H	α-helix	trans	-63.7	-37.6	178.9	-64.5	-12	0	0	0	110.8	K114 I121 K122	K114-D118 WeakPolarHBondContact O-CB 3.45Å; K114-D118 PolarHBondContact O-N 3.14Å; D118-I121 PolarHBondContact O-N 2.86Å; D118-K122 WeakPolarHBondContact O-CB 3.3Å; D118-K122 VanDerWaalsContact O-CG 3.31Å; D118-K122 WeakPolarHBondContact O-CG 3.24Å; D118-K122 PolarHBondContact O-N 3.32Å
119	L	83.6	Confident	78.3	Confident	58 Å²	58	84.3 Å²	84.3	30%	0.304	43%	0.434	S	S	.	.	H	α-helix	trans	-64.7	-43	172.1	-176.8	62.9	0	0	0	112.1	T115 T116 R117 T123 A140 C141	T115-L119 WeakPolarHBondContact O-CB 3.39Å; T115-L119 PolarHBondContact O-N 2.89Å; T116-L119 PolarHBondContact O-N 3.04Å; R117-L119 VanDerWaalsContact C-N 3.28Å; R117-L119 PolarHBondContact O-N 2.71Å; L119-T123 HydrophobicContact CD1-CG2 4.21Å; L119-T123 WeakPolarHBondContact O-CB 3.47Å; L119-T123 VanDerWaalsContact O-CG2 3.29Å; L119-T123 WeakPolarHBondContact O-CG2 3.36Å; L119-T123 PolarHBondContact O-N 3.5Å; L119-T123 PolarHBondContact O-OG1 3.48Å; L119-A140 HydrophobicContact CD1-CB 4.41Å; L119-A140 WeakPolarHBondContact CD1-O 3.37Å; L119-A140 HydrophobicContact CD2-CB 4.45Å; L119-A140 HydrophobicContact CG-CB 4.5Å; L119-C141 HydrophobicContact CD1-CB 3.82Å; L119-C141 HydrophobicContact CD2-CB 4.23Å
120	H	81.4	Confident	80	Confident	102 Å²	102	80.6 Å²	80.6	47%	0.472	42%	0.416	S	S	.	.	H	α-helix	trans	-60.3	-46.3	173.9	171.9	69.4	0	0	0	111.5	T116 R117 K122 T123 A124 H125	T116-H120 PolarHBondContact O-N 3.21Å; R117-H120 CarbonylContact O-C 3.55Å; R117-H120 WeakPolarHBondContact O-CB 3.33Å; R117-H120 PolarHBondContact O-N 3.41Å; R117-H120 VanDerWaalsContact O-N 3.12Å; H120-K122 PolarHBondContact O-N 2.91Å; H120-T123 PolarHBondContact O-N 2.96Å; H120-T123 PolarHBondContact O-OG1 2.95Å; H120-A124 VanDerWaalsContact O-CB 3.24Å; H120-A124 WeakPolarHBondContact O-CB 3.49Å; H120-A124 PolarHBondContact O-N 3.09Å; H120-H125 AromaticContact NE2-NE2 3.81Å
121	I	81.4	Confident	81.4	Confident	51 Å²	51	78.3 Å²	78.3	26%	0.262	40%	0.402	S	S	.	.	H	α-helix	trans	-59.8	-50.2	179.5	-67.8	164.6	0	0	0	110.7	R117 D118 T123 H125 E126	R117-I121 HydrophobicContact CG-CD1 4.06Å; R117-I121 WeakPolarHBondContact O-CG1 3.48Å; R117-I121 PolarHBondContact O-N 3.3Å; D118-I121 PolarHBondContact O-N 2.86Å; I121-T123 VanDerWaalsContact C-N 3.26Å; I121-T123 PolarHBondContact O-N 3Å; I121-H125 WeakPolarHBondContact O-CA 3.48Å; I121-H125 WeakPolarHBondContact O-CB 3.38Å; I121-H125 PolarHBondContact O-N 3.02Å; I121-E126 HydrophobicContact CG2-CG 4.42Å; I121-E126 PolarHBondContact O-N 2.82Å; I121-E126 VanDerWaalsContact O-N 3.08Å
122	K	85	Confident	82.8	Confident	94 Å²	94	71.5 Å²	71.5	41%	0.409	37%	0.373	S	S	.	.	H	α-helix	trans	-55.2	-43.1	177.3	-76.1	173	179.4	177.3	0	112.5	D118 H120 E126 G127 I128	D118-K122 WeakPolarHBondContact O-CB 3.3Å; D118-K122 VanDerWaalsContact O-CG 3.31Å; D118-K122 WeakPolarHBondContact O-CG 3.24Å; D118-K122 PolarHBondContact O-N 3.32Å; H120-K122 PolarHBondContact O-N 2.91Å; K122-E126 WeakPolarHBondContact CG-OE2 3.4Å; K122-E126 CarbonylContact O-C 3.58Å; K122-E126 WeakPolarHBondContact O-CB 3.39Å; K122-G127 PolarHBondContact O-N 3.23Å; K122-I128 HydrophobicContact CB-CB 4.29Å; K122-I128 HydrophobicContact CG-CD1 4.38Å; K122-I128 WeakPolarHBondContact O-CA 3.39Å; K122-I128 WeakPolarHBondContact O-CB 3.4Å; K122-I128 PolarHBondContact O-N 2.8Å
123	T	83.3	Confident	83.6	Confident	44 Å²	44	71.1 Å²	71.1	27%	0.27	38%	0.38	S	S	.	.	H	α-helix	trans	-84.8	-39.6	-172.6	52.3	0	0	0	0	113.8	L119 H120 I121 I128 A140	L119-T123 HydrophobicContact CD1-CG2 4.21Å; L119-T123 WeakPolarHBondContact O-CB 3.47Å; L119-T123 VanDerWaalsContact O-CG2 3.29Å; L119-T123 WeakPolarHBondContact O-CG2 3.36Å; L119-T123 PolarHBondContact O-N 3.5Å; L119-T123 PolarHBondContact O-OG1 3.48Å; H120-T123 PolarHBondContact O-N 2.96Å; H120-T123 PolarHBondContact O-OG1 2.95Å; I121-T123 VanDerWaalsContact C-N 3.26Å; I121-T123 PolarHBondContact O-N 3Å; T123-I128 WeakPolarHBondContact CA-O 3.44Å; T123-I128 WeakPolarHBondContact CG2-O 3.35Å; T123-A140 HydrophobicContact CG2-CB 3.77Å; T123-A140 WeakPolarHBondContact CG2-O 3.49Å
124	A	81.1	Confident	84.3	Confident	58 Å²	58	71.8 Å²	71.8	48%	0.479	38%	0.38	S	S	.	.	H	α-helix	trans	-93.1	-30.6	-173	0	0	0	0	0	113.2	H120	H120-A124 VanDerWaalsContact O-CB 3.24Å; H120-A124 WeakPolarHBondContact O-CB 3.49Å; H120-A124 PolarHBondContact O-N 3.09Å
125	H	80.9	Confident	85.1	Confident	138 Å²	138	67.7 Å²	67.7	64%	0.639	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	-41.3	-176.5	-61.8	-61.3	0	0	0	112.4	H120 I121	H120-H125 AromaticContact NE2-NE2 3.81Å; I121-H125 WeakPolarHBondContact O-CA 3.48Å; I121-H125 WeakPolarHBondContact O-CB 3.38Å; I121-H125 PolarHBondContact O-N 3.02Å
126	E	85.3	Confident	85.3	Confident	97 Å²	97	71.4 Å²	71.4	45%	0.453	38%	0.384	S	S	.	.	S	Bend	trans	-90.1	-4.5	-178.9	-55.3	173	176.5	0	0	112.8	I121 K122 I128	I121-E126 HydrophobicContact CG2-CG 4.42Å; I121-E126 PolarHBondContact O-N 2.82Å; I121-E126 VanDerWaalsContact O-N 3.08Å; K122-E126 WeakPolarHBondContact CG-OE2 3.4Å; K122-E126 CarbonylContact O-C 3.58Å; K122-E126 WeakPolarHBondContact O-CB 3.39Å; E126-I128 HydrophobicContact CB-CD1 3.95Å; E126-I128 HydrophobicContact CB-CG1 3.84Å; E126-I128 PolarHBondContact O-N 2.94Å; E126-I128 VanDerWaalsContact O-N 3.08Å; E126-I128 VanDerWaalsContact OE2-CD1 3.24Å; E126-I128 WeakPolarHBondContact OE2-CD1 3.3Å
127	G	79.5	Confident	85.6	Confident	39 Å²	39	73.6 Å²	73.6	40%	0.402	38%	0.382	S	S	.	.			trans	67	4.4	-178.9	0	0	0	0	0	114.8	K122 N129	K122-G127 PolarHBondContact O-N 3.23Å; G127-N129 PolarHBondContact O-N 2.78Å; G127-N129 VanDerWaalsContact O-N 3.1Å; G127-N129 PolarHBondContact O-ND2 3.34Å
128	I	83.9	Confident	86.1	Confident	14 Å²	14	70.9 Å²	70.9	7%	0.072	38%	0.378	C	S	.	.			trans	-70.6	109.9	-176.5	-55.9	177.4	0	0	0	108.8	K122 T123 E126	K122-I128 HydrophobicContact CB-CB 4.29Å; K122-I128 HydrophobicContact CG-CD1 4.38Å; K122-I128 WeakPolarHBondContact O-CA 3.39Å; K122-I128 WeakPolarHBondContact O-CB 3.4Å; K122-I128 PolarHBondContact O-N 2.8Å; T123-I128 WeakPolarHBondContact CA-O 3.44Å; T123-I128 WeakPolarHBondContact CG2-O 3.35Å; E126-I128 HydrophobicContact CB-CD1 3.95Å; E126-I128 HydrophobicContact CB-CG1 3.84Å; E126-I128 PolarHBondContact O-N 2.94Å; E126-I128 VanDerWaalsContact O-N 3.08Å; E126-I128 VanDerWaalsContact OE2-CD1 3.24Å; E126-I128 WeakPolarHBondContact OE2-CD1 3.3Å
129	N	88.9	Confident	86.3	Confident	43 Å²	43	70.1 Å²	70.1	23%	0.23	37%	0.373	C	S	.	.			trans	-129.3	163.4	172.1	64.9	66.5	0	0	0	109.8	G127 N138	G127-N129 PolarHBondContact O-N 2.78Å; G127-N129 VanDerWaalsContact O-N 3.1Å; G127-N129 PolarHBondContact O-ND2 3.34Å; N129-N138 HydrophobicContact CB-CB 4.25Å
130	Y	89.7	Confident	86.5	Confident	48 Å²	48	69.4 Å²	69.4	19%	0.188	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	104.2	176.6	-63.8	-88.9	0	0	0	107.9	I66 F139 K142	I66-Y130 HydrophobicContact CG2-CD1 4.32Å; Y130-F139 PolarHBondContact N-O 2.87Å; Y130-F139 WeakPolarHBondContact O-CD2 3.26Å; Y130-F139 PolarHBondContact O-N 2.79Å; Y130-K142 HydrophobicContact CD1-CB 4.07Å; Y130-K142 HydrophobicContact CD1-CG 4.43Å; Y130-K142 VanDerWaalsContact CD2-N 3.33Å; Y130-K142 HydrophobicContact CE1-CB 3.79Å; Y130-K142 HydrophobicContact CE1-CG 4.28Å; Y130-K142 HydrophobicContact CE2-CB 4.31Å; Y130-K142 VanDerWaalsContact CE2-N 3.35Å; Y130-K142 HydrophobicContact CG-CB 4.44Å
131	Q	90.1	Very high	86.8	Confident	55 Å²	55	65.6 Å²	65.6	26%	0.257	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	141.3	176.9	-175.7	169.7	-3	0	0	110.7	N138 L145	Q131-N138 WeakPolarHBondContact CB-OD1 3.39Å; Q131-N138 WeakPolarHBondContact CG-OD1 3.26Å; Q131-L145 WeakPolarHBondContact O-CD2 3.43Å
132	C	92.6	Very high	87.2	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.007	36%	0.362	C	S	.	.			trans	-77.1	125.6	170.6	-178.5	0	0	0	0	110.7	Q134 C135 R137 F139 L145 H153	C132-Q134 PolarHBondContact O-N 2.8Å; C132-C135 CarbonylContact C-O 3.6Å; C132-C135 WeakPolarHBondContact CB-O 3.31Å; C132-C135 CarbonylContact O-C 3.56Å; C132-C135 PolarHBondContact O-N 3.49Å; C132-C135 VanDerWaalsContact SG-SG 3.65Å; C132-R137 PolarHBondContact N-O 3.42Å; C132-F139 HydrophobicContact CB-CE2 4.3Å; C132-L145 HydrophobicContact CB-CD1 3.53Å; C132-H153 PolarHBondContact SG-NE2 3.46Å
133	G	90.3	Very high	87.4	Confident	59 Å²	59	65.8 Å²	65.8	61%	0.608	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-16.2	176.6	0	0	0	0	0	114.5
134	Q	89.6	Confident	87.7	Confident	124 Å²	124	67.2 Å²	67.2	58%	0.579	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	-7.5	-178.4	-60.5	-176.4	20.1	0	0	113.4	C132 H153	C132-Q134 PolarHBondContact O-N 2.8Å; Q134-H153 WeakPolarHBondContact CB-CE1 3.32Å; Q134-H153 WeakPolarHBondContact CB-ND1 3.36Å; Q134-H153 PolarHBondContact O-CE1 3.17Å; Q134-H153 PolarHBondContact OE1-ND1 2.96Å
135	C	90.9	Very high	88.3	Confident	36 Å²	36	64.5 Å²	64.5	24%	0.243	35%	0.352	C	S	.	.	S	Bend	trans	-158.6	153.9	171.6	67.7	0	0	0	0	110.9	C132 R137 H148 H153	C132-C135 CarbonylContact C-O 3.6Å; C132-C135 WeakPolarHBondContact CB-O 3.31Å; C132-C135 CarbonylContact O-C 3.56Å; C132-C135 PolarHBondContact O-N 3.49Å; C132-C135 VanDerWaalsContact SG-SG 3.65Å; C135-R137 PolarHBondContact O-N 2.89Å; C135-H148 PolarHBondContact SG-NE2 3.47Å; C135-H153 PolarHBondContact SG-NE2 3.47Å
136	N	86.2	Confident	88.9	Confident	148 Å²	148	60.8 Å²	60.8	79%	0.791	34%	0.336	S	S	*	.	S	Bend	trans	-77.1	38.7	-175.7	-61.8	-13.3	0	0	0	114.1
137	R	88	Confident	89.2	Confident	137 Å²	137	60.4 Å²	60.4	52%	0.517	33%	0.334	S	S	.	.			trans	-97	135.9	174.3	-75.9	-169.3	173.8	175.1	0.3	111.2	C132 C135 F139	C132-R137 PolarHBondContact N-O 3.42Å; C135-R137 PolarHBondContact O-N 2.89Å; R137-F139 HydrophobicContact CB-CE2 3.76Å; R137-F139 HydrophobicContact CB-CZ 3.92Å
138	N	91.4	Very high	89.8	Confident	89 Å²	89	59.1 Å²	59.1	48%	0.476	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	141.7	178.6	-62.2	-22	0	0	0	110.8	N129 Q131	N129-N138 HydrophobicContact CB-CB 4.25Å; Q131-N138 WeakPolarHBondContact CB-OD1 3.39Å; Q131-N138 WeakPolarHBondContact CG-OD1 3.26Å
139	F	89.7	Confident	90.1	Very high	38 Å²	38	58.8 Å²	58.8	17%	0.167	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	141.3	-179	-61.8	-88.1	0	0	0	110.6	Y130 C132 R137 C141 N144 L145 H148	Y130-F139 PolarHBondContact N-O 2.87Å; Y130-F139 WeakPolarHBondContact O-CD2 3.26Å; Y130-F139 PolarHBondContact O-N 2.79Å; C132-F139 HydrophobicContact CB-CE2 4.3Å; R137-F139 HydrophobicContact CB-CE2 3.76Å; R137-F139 HydrophobicContact CB-CZ 3.92Å; F139-C141 VanDerWaalsContact C-N 3.31Å; F139-C141 PolarHBondContact O-N 3.14Å; F139-N144 HydrophobicContact CB-CB 4.23Å; F139-N144 HydrophobicContact CD1-CB 4.01Å; F139-N144 HydrophobicContact CG-CB 4.48Å; F139-L145 HydrophobicContact CB-CB 4.05Å; F139-L145 HydrophobicContact CD2-CB 3.87Å; F139-L145 HydrophobicContact CD2-CD1 3.59Å; F139-L145 HydrophobicContact CD2-CG 4.33Å; F139-L145 HydrophobicContact CE2-CD1 3.82Å; F139-L145 HydrophobicContact CG-CB 4.06Å; F139-H148 HydrophobicContact CD1-CB 4.39Å; F139-H148 HydrophobicContact CE1-CB 3.54Å; F139-H148 AromaticContact CE1-CG 3.91Å; F139-H148 HydrophobicContact CE2-CB 3.84Å; F139-H148 AromaticContact CE2-CD2 3.65Å; F139-H148 AromaticContact CE2-CG 3.61Å; F139-H148 HydrophobicContact CZ-CB 3.24Å; F139-H148 AromaticContact CZ-CD2 3.63Å; F139-H148 AromaticContact CZ-CG 3.1Å; F139-H148 AromaticContact CZ-ND1 3.45Å; F139-H148 WeakPolarHBondContact CZ-ND1 3.41Å
140	A	87.8	Confident	90.3	Very high	42 Å²	42	59 Å²	59	35%	0.347	32%	0.315	S	S	.	.	S	Bend	trans	-62.3	-38.6	179.4	0	0	0	0	0	112.6	L119 T123	L119-A140 HydrophobicContact CD1-CB 4.41Å; L119-A140 WeakPolarHBondContact CD1-O 3.37Å; L119-A140 HydrophobicContact CD2-CB 4.45Å; L119-A140 HydrophobicContact CG-CB 4.5Å; T123-A140 HydrophobicContact CG2-CB 3.77Å; T123-A140 WeakPolarHBondContact CG2-O 3.49Å
141	C	87.5	Confident	90.4	Very high	22 Å²	22	57.3 Å²	57.3	15%	0.149	31%	0.31	C	S	.	.	S	Bend	trans	-133.3	155.2	-178.6	63.1	0	0	0	0	112.5	L119 F139 S143 N144 L145	L119-C141 HydrophobicContact CD1-CB 3.82Å; L119-C141 HydrophobicContact CD2-CB 4.23Å; F139-C141 VanDerWaalsContact C-N 3.31Å; F139-C141 PolarHBondContact O-N 3.14Å; C141-S143 VanDerWaalsContact C-N 3.29Å; C141-S143 PolarHBondContact O-N 2.9Å; C141-S143 PolarHBondContact SG-OG 2.95Å; C141-N144 PolarHBondContact O-N 3.41Å; C141-N144 VanDerWaalsContact O-N 3.1Å; C141-N144 PolarHBondContact SG-ND2 2.91Å; C141-N144 VanDerWaalsContact SG-ND2 3.43Å; C141-N144 PolarHBondContact SG-OD1 2.8Å; C141-L145 PolarHBondContact O-N 3.41Å
142	K	89.5	Confident	90.4	Very high	73 Å²	73	60.5 Å²	60.5	32%	0.317	32%	0.324	S	S	.	.	H	α-helix	trans	-55.9	-40.4	179.5	-170.3	175.7	-179.6	178.1	0	112.9	Y130 N144 L145 L146	Y130-K142 HydrophobicContact CD1-CB 4.07Å; Y130-K142 HydrophobicContact CD1-CG 4.43Å; Y130-K142 VanDerWaalsContact CD2-N 3.33Å; Y130-K142 HydrophobicContact CE1-CB 3.79Å; Y130-K142 HydrophobicContact CE1-CG 4.28Å; Y130-K142 HydrophobicContact CE2-CB 4.31Å; Y130-K142 VanDerWaalsContact CE2-N 3.35Å; Y130-K142 HydrophobicContact CG-CB 4.44Å; K142-N144 VanDerWaalsContact C-N 3.28Å; K142-N144 PolarHBondContact O-N 3.27Å; K142-L145 PolarHBondContact O-N 3.18Å; K142-L146 HydrophobicContact CG-CD1 4.28Å; K142-L146 HydrophobicContact CG-CG 4.47Å; K142-L146 WeakPolarHBondContact O-CG 3.45Å; K142-L146 PolarHBondContact O-N 3.42Å
143	S	89.2	Confident	90.4	Very high	77 Å²	77	63 Å²	63	54%	0.538	34%	0.335	S	S	.	.	H	α-helix	trans	-61.8	-36	179.3	57.4	0	0	0	0	112.6	C141 Q147	C141-S143 VanDerWaalsContact C-N 3.29Å; C141-S143 PolarHBondContact O-N 2.9Å; C141-S143 PolarHBondContact SG-OG 2.95Å; S143-Q147 WeakPolarHBondContact O-CB 3.32Å; S143-Q147 PolarHBondContact O-N 3.22Å
144	N	90.6	Very high	90.5	Very high	74 Å²	74	64.4 Å²	64.4	40%	0.396	33%	0.328	S	S	.	.	H	α-helix	trans	-73.9	-37.4	178.6	-69.9	0.8	0	0	0	111.4	F139 C141 K142 Q147 H148	F139-N144 HydrophobicContact CB-CB 4.23Å; F139-N144 HydrophobicContact CD1-CB 4.01Å; F139-N144 HydrophobicContact CG-CB 4.48Å; C141-N144 PolarHBondContact O-N 3.41Å; C141-N144 VanDerWaalsContact O-N 3.1Å; C141-N144 PolarHBondContact SG-ND2 2.91Å; C141-N144 VanDerWaalsContact SG-ND2 3.43Å; C141-N144 PolarHBondContact SG-OD1 2.8Å; K142-N144 VanDerWaalsContact C-N 3.28Å; K142-N144 PolarHBondContact O-N 3.27Å; N144-Q147 PolarHBondContact O-N 3.37Å; N144-H148 WeakPolarHBondContact O-CB 3.31Å; N144-H148 PolarHBondContact O-N 2.94Å
145	L	92.9	Very high	90.4	Very high	1 Å²	1	68.5 Å²	68.5	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-61	-48.9	171.9	171.6	61.1	0	0	0	111	I66 Q131 C132 F139 C141 K142 Q147 H148 I149	I66-L145 HydrophobicContact CG1-CD2 4.32Å; I66-L145 HydrophobicContact CG2-CD2 4.17Å; Q131-L145 WeakPolarHBondContact O-CD2 3.43Å; C132-L145 HydrophobicContact CB-CD1 3.53Å; F139-L145 HydrophobicContact CB-CB 4.05Å; F139-L145 HydrophobicContact CD2-CB 3.87Å; F139-L145 HydrophobicContact CD2-CD1 3.59Å; F139-L145 HydrophobicContact CD2-CG 4.33Å; F139-L145 HydrophobicContact CE2-CD1 3.82Å; F139-L145 HydrophobicContact CG-CB 4.06Å; C141-L145 PolarHBondContact O-N 3.41Å; K142-L145 PolarHBondContact O-N 3.18Å; L145-Q147 VanDerWaalsContact C-N 3.3Å; L145-Q147 PolarHBondContact O-N 2.9Å; L145-H148 WeakPolarHBondContact O-CA 3.48Å; L145-H148 WeakPolarHBondContact O-CB 3.4Å; L145-H148 PolarHBondContact O-N 3.01Å; L145-H148 VanDerWaalsContact O-N 3.08Å; L145-I149 HydrophobicContact CD1-CD1 3.87Å; L145-I149 HydrophobicContact CD1-CG1 4.03Å; L145-I149 HydrophobicContact CG-CD1 3.98Å; L145-I149 WeakPolarHBondContact O-CG1 3.09Å; L145-I149 PolarHBondContact O-N 3.24Å
146	L	92.4	Very high	90.4	Very high	59 Å²	59	70.2 Å²	70.2	31%	0.309	35%	0.345	S	S	.	.	H	α-helix	trans	-60.7	-41.1	179.1	-69.8	176.1	0	0	0	111.6	L64 I66 K142 I149 H150	L64-L146 HydrophobicContact CD1-CD2 3.6Å; I66-L146 HydrophobicContact CD1-CD2 4.35Å; K142-L146 HydrophobicContact CG-CD1 4.28Å; K142-L146 HydrophobicContact CG-CG 4.47Å; K142-L146 WeakPolarHBondContact O-CG 3.45Å; K142-L146 PolarHBondContact O-N 3.42Å; L146-I149 PolarHBondContact O-N 3.23Å; L146-H150 VanDerWaalsContact O-CB 3.23Å; L146-H150 WeakPolarHBondContact O-CB 3.29Å; L146-H150 PolarHBondContact O-N 3.22Å
147	Q	91.8	Very high	90.7	Very high	90 Å²	90	68.6 Å²	68.6	42%	0.421	33%	0.331	S	S	.	.	H	α-helix	trans	-63.5	-40.8	173.5	178.7	172.5	90.5	0	0	112.2	S143 N144 L145 H150 V151	S143-Q147 WeakPolarHBondContact O-CB 3.32Å; S143-Q147 PolarHBondContact O-N 3.22Å; N144-Q147 PolarHBondContact O-N 3.37Å; L145-Q147 VanDerWaalsContact C-N 3.3Å; L145-Q147 PolarHBondContact O-N 2.9Å; Q147-H150 PolarHBondContact O-N 2.86Å; Q147-V151 HydrophobicContact CG-CG2 4.27Å; Q147-V151 WeakPolarHBondContact O-CB 3.43Å; Q147-V151 VanDerWaalsContact O-CG2 3.28Å; Q147-V151 WeakPolarHBondContact O-CG2 3.49Å; Q147-V151 PolarHBondContact O-N 3.19Å
148	H	92	Very high	90.9	Very high	11 Å²	11	65.7 Å²	65.7	5%	0.051	32%	0.32	C	S	.	.	H	α-helix	trans	-60.5	-48.7	174.9	163.2	82.1	0	0	0	111.4	C135 F139 N144 L145 H150 V151 F152 H153	C135-H148 PolarHBondContact SG-NE2 3.47Å; F139-H148 HydrophobicContact CD1-CB 4.39Å; F139-H148 HydrophobicContact CE1-CB 3.54Å; F139-H148 AromaticContact CE1-CG 3.91Å; F139-H148 HydrophobicContact CE2-CB 3.84Å; F139-H148 AromaticContact CE2-CD2 3.65Å; F139-H148 AromaticContact CE2-CG 3.61Å; F139-H148 HydrophobicContact CZ-CB 3.24Å; F139-H148 AromaticContact CZ-CD2 3.63Å; F139-H148 AromaticContact CZ-CG 3.1Å; F139-H148 AromaticContact CZ-ND1 3.45Å; F139-H148 WeakPolarHBondContact CZ-ND1 3.41Å; N144-H148 WeakPolarHBondContact O-CB 3.31Å; N144-H148 PolarHBondContact O-N 2.94Å; L145-H148 WeakPolarHBondContact O-CA 3.48Å; L145-H148 WeakPolarHBondContact O-CB 3.4Å; L145-H148 PolarHBondContact O-N 3.01Å; L145-H148 VanDerWaalsContact O-N 3.08Å; H148-H150 VanDerWaalsContact C-N 3.35Å; H148-H150 PolarHBondContact O-N 3.3Å; H148-V151 PolarHBondContact O-N 3.11Å; H148-F152 AromaticContact CE1-CD2 3.94Å; H148-F152 AromaticContact ND1-CD2 3.29Å; H148-F152 VanDerWaalsContact ND1-CD2 3.29Å; H148-F152 WeakPolarHBondContact ND1-CD2 3.47Å; H148-F152 AromaticContact ND1-CE2 3.99Å; H148-F152 AromaticContact ND1-CG 3.84Å; H148-F152 VanDerWaalsContact O-CB 3.32Å; H148-F152 WeakPolarHBondContact O-CB 3.39Å; H148-F152 PolarHBondContact O-N 3.15Å; H148-H153 AromaticContact CD2-CD2 3.82Å; H148-H153 AromaticContact CD2-NE2 3.96Å; H148-H153 AromaticContact CE1-NE2 3.81Å; H148-H153 AromaticContact NE2-CD2 3.28Å; H148-H153 PolarHBondContact NE2-CD2 3.23Å; H148-H153 VanDerWaalsContact NE2-CD2 3.28Å; H148-H153 AromaticContact NE2-NE2 3.03Å; H148-H153 PolarHBondContact NE2-NE2 3.34Å
149	I	91.9	Very high	91	Very high	7 Å²	7	64.4 Å²	64.4	4%	0.036	32%	0.318	C	S	.	.	I	π-helix	trans	-59	-49.1	177.1	-65.1	170.2	0	0	0	110.2	L145 L146 V151 H153 N154	L145-I149 HydrophobicContact CD1-CD1 3.87Å; L145-I149 HydrophobicContact CD1-CG1 4.03Å; L145-I149 HydrophobicContact CG-CD1 3.98Å; L145-I149 WeakPolarHBondContact O-CG1 3.09Å; L145-I149 PolarHBondContact O-N 3.24Å; L146-I149 PolarHBondContact O-N 3.23Å; I149-V151 VanDerWaalsContact C-N 3.35Å; I149-V151 PolarHBondContact O-N 3.27Å; I149-H153 HydrophobicContact CG2-CB 4.26Å; I149-H153 WeakPolarHBondContact O-CA 3.32Å; I149-H153 WeakPolarHBondContact O-CB 3.39Å; I149-H153 PolarHBondContact O-N 2.97Å; I149-N154 PolarHBondContact O-N 3.45Å
150	H	93.2	Very high	91.3	Very high	48 Å²	48	62.7 Å²	62.7	22%	0.222	31%	0.311	C	S	.	.	I	π-helix	trans	-56.1	-46.7	179.4	-175.3	80.6	0	0	0	112.8	L146 Q147 H148 N154 I156 Y158	L146-H150 VanDerWaalsContact O-CB 3.23Å; L146-H150 WeakPolarHBondContact O-CB 3.29Å; L146-H150 PolarHBondContact O-N 3.22Å; Q147-H150 PolarHBondContact O-N 2.86Å; H148-H150 VanDerWaalsContact C-N 3.35Å; H148-H150 PolarHBondContact O-N 3.3Å; H150-N154 WeakPolarHBondContact O-CB 3.48Å; H150-I156 WeakPolarHBondContact CE1-CG2 3.12Å; H150-I156 WeakPolarHBondContact NE2-CG2 3.49Å; H150-I156 WeakPolarHBondContact O-CB 3.38Å; H150-I156 PolarHBondContact O-N 3.01Å; H150-Y158 AromaticContact NE2-CE2 3.88Å; H150-Y158 AromaticContact NE2-CZ 3.73Å; H150-Y158 PolarHBondContact NE2-OH 3.36Å
151	V	91.3	Very high	91.6	Very high	13 Å²	13	66.5 Å²	66.5	8%	0.079	33%	0.33	C	S	.	.	I	π-helix	trans	-83.8	-42.3	-173.5	173.4	0	0	0	0	112.8	Q147 H148 I149 R155 T168	Q147-V151 HydrophobicContact CG-CG2 4.27Å; Q147-V151 WeakPolarHBondContact O-CB 3.43Å; Q147-V151 VanDerWaalsContact O-CG2 3.28Å; Q147-V151 WeakPolarHBondContact O-CG2 3.49Å; Q147-V151 PolarHBondContact O-N 3.19Å; H148-V151 PolarHBondContact O-N 3.11Å; I149-V151 VanDerWaalsContact C-N 3.35Å; I149-V151 PolarHBondContact O-N 3.27Å; V151-R155 VanDerWaalsContact O-CA 3.3Å; V151-R155 WeakPolarHBondContact O-CA 3.39Å; V151-T168 HydrophobicContact CG1-CG2 3.67Å; V151-T168 HydrophobicContact CG2-CG2 4.45Å; V151-T168 VanDerWaalsContact CG2-O 3.24Å; V151-T168 WeakPolarHBondContact CG2-O 3.46Å
152	F	90.7	Very high	91.8	Very high	122 Å²	122	71.3 Å²	71.3	54%	0.535	35%	0.35	S	S	.	.	I	π-helix	trans	-93.9	-45.5	-171.9	-73.4	-82	0	0	0	112.7	H148	H148-F152 AromaticContact CE1-CD2 3.94Å; H148-F152 AromaticContact ND1-CD2 3.29Å; H148-F152 VanDerWaalsContact ND1-CD2 3.29Å; H148-F152 WeakPolarHBondContact ND1-CD2 3.47Å; H148-F152 AromaticContact ND1-CE2 3.99Å; H148-F152 AromaticContact ND1-CG 3.84Å; H148-F152 VanDerWaalsContact O-CB 3.32Å; H148-F152 WeakPolarHBondContact O-CB 3.39Å; H148-F152 PolarHBondContact O-N 3.15Å
153	H	91.7	Very high	91.9	Very high	53 Å²	53	70.4 Å²	70.4	25%	0.245	35%	0.352	C	S	.	.	I	π-helix	trans	-84	-48.4	-176.3	-71	-74.8	0	0	0	111.4	C132 Q134 C135 H148 I149 R155	C132-H153 PolarHBondContact SG-NE2 3.46Å; Q134-H153 WeakPolarHBondContact CB-CE1 3.32Å; Q134-H153 WeakPolarHBondContact CB-ND1 3.36Å; Q134-H153 PolarHBondContact O-CE1 3.17Å; Q134-H153 PolarHBondContact OE1-ND1 2.96Å; C135-H153 PolarHBondContact SG-NE2 3.47Å; H148-H153 AromaticContact CD2-CD2 3.82Å; H148-H153 AromaticContact CD2-NE2 3.96Å; H148-H153 AromaticContact CE1-NE2 3.81Å; H148-H153 AromaticContact NE2-CD2 3.28Å; H148-H153 PolarHBondContact NE2-CD2 3.23Å; H148-H153 VanDerWaalsContact NE2-CD2 3.28Å; H148-H153 AromaticContact NE2-NE2 3.03Å; H148-H153 PolarHBondContact NE2-NE2 3.34Å; I149-H153 HydrophobicContact CG2-CB 4.26Å; I149-H153 WeakPolarHBondContact O-CA 3.32Å; I149-H153 WeakPolarHBondContact O-CB 3.39Å; I149-H153 PolarHBondContact O-N 2.97Å; H153-R155 PolarHBondContact O-N 3.07Å
154	N	91.6	Very high	92.1	Very high	88 Å²	88	75.6 Å²	75.6	47%	0.471	36%	0.361	S	S	.	.	S	Bend	trans	-82.9	-6.2	178.4	-58.8	-10.2	0	0	0	112.3	I149 H150 I156	I149-N154 PolarHBondContact O-N 3.45Å; H150-N154 WeakPolarHBondContact O-CB 3.48Å; N154-I156 HydrophobicContact CB-CD1 3.69Å; N154-I156 HydrophobicContact CB-CG1 3.77Å; N154-I156 WeakPolarHBondContact O-CG1 3.45Å; N154-I156 PolarHBondContact O-N 3.25Å; N154-I156 VanDerWaalsContact O-N 3.07Å
155	R	88.8	Confident	92.2	Very high	211 Å²	211	78 Å²	78	80%	0.796	37%	0.368	S	S	*	.			trans	53.9	24.9	-178.1	-61.2	-172.1	172.6	-146.2	0.3	113.9	V151 H153 K157	V151-R155 VanDerWaalsContact O-CA 3.3Å; V151-R155 WeakPolarHBondContact O-CA 3.39Å; H153-R155 PolarHBondContact O-N 3.07Å; R155-K157 PolarHBondContact O-N 2.99Å
156	I	89.8	Confident	92.3	Very high	72 Å²	72	81.2 Å²	81.2	37%	0.369	39%	0.388	S	S	.	.			trans	-80.1	126.1	-176.5	-56.3	170.3	0	0	0	108.7	H150 N154	H150-I156 WeakPolarHBondContact CE1-CG2 3.12Å; H150-I156 WeakPolarHBondContact NE2-CG2 3.49Å; H150-I156 WeakPolarHBondContact O-CB 3.38Å; H150-I156 PolarHBondContact O-N 3.01Å; N154-I156 HydrophobicContact CB-CD1 3.69Å; N154-I156 HydrophobicContact CB-CG1 3.77Å; N154-I156 WeakPolarHBondContact O-CG1 3.45Å; N154-I156 PolarHBondContact O-N 3.25Å; N154-I156 VanDerWaalsContact O-N 3.07Å
157	K	92.1	Very high	92.3	Very high	114 Å²	114	79.9 Å²	79.9	50%	0.496	38%	0.38	S	S	.	.			trans	-127.9	152.2	174.9	-63.2	-176.3	-177.9	177.6	0	109.6	R155 F167	R155-K157 PolarHBondContact O-N 2.99Å; K157-F167 WeakPolarHBondContact CA-O 3.45Å
158	Y	93.7	Very high	92.4	Very high	75 Å²	75	78.7 Å²	78.7	29%	0.294	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	114.6	173.5	-59.3	-83.3	0	0	0	108.8	H150 T166 F167 K170	H150-Y158 AromaticContact NE2-CE2 3.88Å; H150-Y158 AromaticContact NE2-CZ 3.73Å; H150-Y158 PolarHBondContact NE2-OH 3.36Å; Y158-T166 CarbonylContact O-C 3.52Å; Y158-T166 WeakPolarHBondContact O-CA 3.08Å; Y158-F167 PolarHBondContact N-O 3.05Å; Y158-F167 PolarHBondContact O-N 3.37Å; Y158-K170 HydrophobicContact CD1-CB 4.1Å; Y158-K170 HydrophobicContact CD1-CG 4.44Å; Y158-K170 VanDerWaalsContact CD2-N 3.32Å; Y158-K170 HydrophobicContact CE1-CB 3.91Å; Y158-K170 HydrophobicContact CE1-CG 4.42Å; Y158-K170 HydrophobicContact CE2-CB 4.34Å; Y158-K170 HydrophobicContact CG-CB 4.39Å
159	S	93.8	Very high	92.4	Very high	63 Å²	63	79 Å²	79	44%	0.441	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	136.9	-179.5	-58.2	0	0	0	0	110.7	T166	S159-T166 WeakPolarHBondContact OG-CG2 3.24Å
160	C	95	Very high	92.5	Very high	2 Å²	2	84.9 Å²	84.9	1%	0.014	41%	0.407	C	S	.	.			trans	-74	123.9	167.8	-179.1	0	0	0	0	109.6	Q162 Y164 K165 F167 L173 H181	C160-Q162 PolarHBondContact O-N 3.43Å; C160-Q162 PolarHBondContact SG-N 3.21Å; C160-Q162 VanDerWaalsContact SG-N 3.45Å; C160-Y164 WeakPolarHBondContact O-CA 3.36Å; C160-Y164 PolarHBondContact O-N 3Å; C160-K165 PolarHBondContact N-O 2.88Å; C160-F167 HydrophobicContact CB-CE2 4.48Å; C160-L173 HydrophobicContact CB-CD1 3.65Å; C160-H181 VanDerWaalsContact SG-CD2 3.52Å; C160-H181 PolarHBondContact SG-NE2 3.37Å
161	V	93.3	Very high	92.4	Very high	122 Å²	122	85.9 Å²	85.9	74%	0.739	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-20.8	178.4	-62.6	0	0	0	0	113.5
162	Q	91.8	Very high	92.4	Very high	122 Å²	122	89.7 Å²	89.7	57%	0.57	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-28.4	-176.8	-62.2	-170.8	15.7	0	0	113.8	C160 H181	C160-Q162 PolarHBondContact O-N 3.43Å; C160-Q162 PolarHBondContact SG-N 3.21Å; C160-Q162 VanDerWaalsContact SG-N 3.45Å; Q162-H181 WeakPolarHBondContact CB-CE1 3.4Å; Q162-H181 PolarHBondContact OE1-ND1 3.32Å
163	C	93.4	Very high	92.6	Very high	55 Å²	55	85 Å²	85	37%	0.372	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.3	5.2	179.9	70.9	0	0	0	0	114.7	K165 H176 H181	C163-K165 PolarHBondContact O-N 3.18Å; C163-K165 VanDerWaalsContact SG-CB 3.56Å; C163-H176 VanDerWaalsContact SG-CE1 3.58Å; C163-H176 PolarHBondContact SG-NE2 3.19Å; C163-H181 PolarHBondContact SG-NE2 3.43Å
164	Y	92.5	Very high	92.6	Very high	186 Å²	186	86.1 Å²	86.1	73%	0.729	42%	0.424	S	S	*	.			trans	58.2	9.2	179.6	-54.1	-75	0	0	0	115.6	C160	C160-Y164 WeakPolarHBondContact O-CA 3.36Å; C160-Y164 PolarHBondContact O-N 3Å
165	K	92.9	Very high	92.6	Very high	125 Å²	125	87.8 Å²	87.8	54%	0.543	43%	0.427	S	S	.	.			trans	-66.7	135.7	175.2	-167.6	169.7	-177.1	177.2	0	110.4	C160 C163 F167	C160-K165 PolarHBondContact N-O 2.88Å; C163-K165 PolarHBondContact O-N 3.18Å; C163-K165 VanDerWaalsContact SG-CB 3.56Å; K165-F167 HydrophobicContact CB-CE2 4.07Å; K165-F167 HydrophobicContact CB-CZ 4.29Å; K165-F167 HydrophobicContact CD-CZ 3.92Å; K165-F167 HydrophobicContact CG-CE2 4.04Å; K165-F167 HydrophobicContact CG-CZ 3.88Å; K165-F167 WeakPolarHBondContact O-CE2 3.4Å
166	T	94.2	Very high	92.7	Very high	67 Å²	67	78.5 Å²	78.5	41%	0.411	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	145.7	-175.1	63	0	0	0	0	112.9	Y158 S159	Y158-T166 CarbonylContact O-C 3.52Å; Y158-T166 WeakPolarHBondContact O-CA 3.08Å; S159-T166 WeakPolarHBondContact OG-CG2 3.24Å
167	F	93.9	Very high	92.8	Very high	32 Å²	32	76.7 Å²	76.7	14%	0.14	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	149.4	-176.6	-60.5	-89.1	0	0	0	110.7	K157 Y158 C160 K165 T169 H172 L173 H176	K157-F167 WeakPolarHBondContact CA-O 3.45Å; Y158-F167 PolarHBondContact N-O 3.05Å; Y158-F167 PolarHBondContact O-N 3.37Å; C160-F167 HydrophobicContact CB-CE2 4.48Å; K165-F167 HydrophobicContact CB-CE2 4.07Å; K165-F167 HydrophobicContact CB-CZ 4.29Å; K165-F167 HydrophobicContact CD-CZ 3.92Å; K165-F167 HydrophobicContact CG-CE2 4.04Å; K165-F167 HydrophobicContact CG-CZ 3.88Å; K165-F167 WeakPolarHBondContact O-CE2 3.4Å; F167-T169 VanDerWaalsContact C-N 3.32Å; F167-H172 HydrophobicContact CB-CB 4.29Å; F167-H172 HydrophobicContact CD1-CB 3.89Å; F167-H172 HydrophobicContact CG-CB 4.41Å; F167-L173 HydrophobicContact CB-CB 4.18Å; F167-L173 HydrophobicContact CD2-CB 3.85Å; F167-L173 HydrophobicContact CD2-CD1 3.68Å; F167-L173 HydrophobicContact CD2-CG 4.37Å; F167-L173 HydrophobicContact CE2-CD1 3.83Å; F167-L173 HydrophobicContact CG-CB 4.11Å; F167-H176 HydrophobicContact CE1-CB 3.69Å; F167-H176 HydrophobicContact CE2-CB 3.93Å; F167-H176 AromaticContact CE2-CD2 3.39Å; F167-H176 WeakPolarHBondContact CE2-CD2 3.31Å; F167-H176 AromaticContact CE2-CG 3.68Å; F167-H176 HydrophobicContact CZ-CB 3.29Å; F167-H176 AromaticContact CZ-CD2 3.4Å; F167-H176 VanDerWaalsContact CZ-CD2 3.4Å; F167-H176 WeakPolarHBondContact CZ-CD2 3.36Å; F167-H176 AromaticContact CZ-CG 3.17Å; F167-H176 AromaticContact CZ-ND1 3.77Å
168	T	92.9	Very high	92.8	Very high	64 Å²	64	76.3 Å²	76.3	39%	0.393	38%	0.383	S	S	.	.	S	Bend	trans	-80.5	-15.3	177.8	55.1	0	0	0	0	113	V151	V151-T168 HydrophobicContact CG1-CG2 3.67Å; V151-T168 HydrophobicContact CG2-CG2 4.45Å; V151-T168 VanDerWaalsContact CG2-O 3.24Å; V151-T168 WeakPolarHBondContact CG2-O 3.46Å
169	T	92.4	Very high	92.6	Very high	17 Å²	17	73.9 Å²	73.9	10%	0.104	38%	0.377	C	S	.	.	S	Bend	trans	-139.6	145.6	-178.6	81.4	0	0	0	0	111	F167 S171 H172 L173	F167-T169 VanDerWaalsContact C-N 3.32Å; T169-S171 PolarHBondContact O-N 3.28Å; T169-H172 PolarHBondContact O-N 3.14Å; T169-H172 WeakPolarHBondContact OG1-CB 3.45Å; T169-H172 PolarHBondContact OG1-N 2.79Å; T169-H172 VanDerWaalsContact OG1-N 3.1Å; T169-H172 PolarHBondContact OG1-ND1 2.8Å; T169-L173 PolarHBondContact O-N 3.12Å; T169-L173 VanDerWaalsContact O-N 3.13Å
170	K	92.7	Very high	92.3	Very high	132 Å²	132	75 Å²	75	57%	0.574	38%	0.377	S	S	*	.	H	α-helix	trans	-60.1	-35.6	174.8	-168.3	173.5	-176.2	175.5	0	112	Y158 H172 L173 N174	Y158-K170 HydrophobicContact CD1-CB 4.1Å; Y158-K170 HydrophobicContact CD1-CG 4.44Å; Y158-K170 VanDerWaalsContact CD2-N 3.32Å; Y158-K170 HydrophobicContact CE1-CB 3.91Å; Y158-K170 HydrophobicContact CE1-CG 4.42Å; Y158-K170 HydrophobicContact CE2-CB 4.34Å; Y158-K170 HydrophobicContact CG-CB 4.39Å; K170-H172 PolarHBondContact O-N 3.48Å; K170-L173 PolarHBondContact O-N 3.17Å; K170-N174 WeakPolarHBondContact O-CB 3.41Å; K170-N174 VanDerWaalsContact O-CG 3.28Å; K170-N174 PolarHBondContact O-N 3.1Å
171	S	91.6	Very high	92.1	Very high	68 Å²	68	77.2 Å²	77.2	48%	0.476	39%	0.387	S	S	.	.	H	α-helix	trans	-62.1	-42	176.6	-174	0	0	0	0	112.1	T169 N174 K175	T169-S171 PolarHBondContact O-N 3.28Å; S171-N174 PolarHBondContact O-N 2.99Å; S171-K175 WeakPolarHBondContact O-CG 3.37Å; S171-K175 PolarHBondContact O-N 3.37Å
172	H	91.8	Very high	92.1	Very high	94 Å²	94	77.1 Å²	77.1	44%	0.435	38%	0.379	S	S	.	.	H	α-helix	trans	-69.1	-39.6	176.9	-67.4	156.5	0	0	0	112.4	F167 T169 K170 K175 H176	F167-H172 HydrophobicContact CB-CB 4.29Å; F167-H172 HydrophobicContact CD1-CB 3.89Å; F167-H172 HydrophobicContact CG-CB 4.41Å; T169-H172 PolarHBondContact O-N 3.14Å; T169-H172 WeakPolarHBondContact OG1-CB 3.45Å; T169-H172 PolarHBondContact OG1-N 2.79Å; T169-H172 VanDerWaalsContact OG1-N 3.1Å; T169-H172 PolarHBondContact OG1-ND1 2.8Å; K170-H172 PolarHBondContact O-N 3.48Å; H172-K175 PolarHBondContact O-N 3.42Å; H172-H176 WeakPolarHBondContact O-CB 3.32Å; H172-H176 PolarHBondContact O-N 3.02Å
173	L	94.1	Very high	91.9	Very high	22 Å²	22	79.1 Å²	79.1	12%	0.115	39%	0.386	C	S	.	.	H	α-helix	trans	-58	-49.1	171.4	171.6	61	0	0	0	110.8	C160 F167 T169 K170 K175 H176 V177	C160-L173 HydrophobicContact CB-CD1 3.65Å; F167-L173 HydrophobicContact CB-CB 4.18Å; F167-L173 HydrophobicContact CD2-CB 3.85Å; F167-L173 HydrophobicContact CD2-CD1 3.68Å; F167-L173 HydrophobicContact CD2-CG 4.37Å; F167-L173 HydrophobicContact CE2-CD1 3.83Å; F167-L173 HydrophobicContact CG-CB 4.11Å; T169-L173 PolarHBondContact O-N 3.12Å; T169-L173 VanDerWaalsContact O-N 3.13Å; K170-L173 PolarHBondContact O-N 3.17Å; L173-K175 VanDerWaalsContact C-N 3.34Å; L173-K175 PolarHBondContact O-N 2Å; L173-H176 CarbonylContact O-C 3.48Å; L173-H176 WeakPolarHBondContact O-CA 3.48Å; L173-H176 WeakPolarHBondContact O-CB 3.49Å; L173-H176 PolarHBondContact O-N 2.65Å; L173-H176 VanDerWaalsContact O-N 3.08Å; L173-V177 HydrophobicContact CD1-CG2 3.9Å; L173-V177 HydrophobicContact CG-CG2 4.38Å; L173-V177 WeakPolarHBondContact O-CG2 3.42Å; L173-V177 PolarHBondContact O-N 2.84Å
174	N	93	Very high	91.7	Very high	78 Å²	78	79.8 Å²	79.8	42%	0.417	39%	0.385	S	S	.	.	H	α-helix	trans	-61.5	-41.7	-179.9	-72.6	-7.6	0	0	0	112.1	K170 S171 H176 V177 K178	K170-N174 WeakPolarHBondContact O-CB 3.41Å; K170-N174 VanDerWaalsContact O-CG 3.28Å; K170-N174 PolarHBondContact O-N 3.1Å; S171-N174 PolarHBondContact O-N 2.99Å; N174-H176 VanDerWaalsContact C-N 3.3Å; N174-H176 PolarHBondContact O-N 3.48Å; N174-V177 PolarHBondContact O-N 3.3Å; N174-K178 WeakPolarHBondContact O-CB 3.47Å; N174-K178 VanDerWaalsContact O-CG 3.31Å; N174-K178 WeakPolarHBondContact O-CG 3.46Å; N174-K178 PolarHBondContact O-N 3.48Å
175	K	90	Very high	91.6	Very high	122 Å²	122	74.8 Å²	74.8	53%	0.53	37%	0.367	S	S	.	.	H	α-helix	trans	-61.9	-40.2	174	-74.6	176.9	-176.4	176.6	0	111.6	S171 H172 L173 S179	S171-K175 WeakPolarHBondContact O-CG 3.37Å; S171-K175 PolarHBondContact O-N 3.37Å; H172-K175 PolarHBondContact O-N 3.42Å; L173-K175 VanDerWaalsContact C-N 3.34Å; L173-K175 PolarHBondContact O-N 2Å; K175-S179 WeakPolarHBondContact O-CB 3.46Å; K175-S179 PolarHBondContact O-N 3.48Å; K175-S179 PolarHBondContact O-OG 3.11Å
176	H	91.5	Very high	91.4	Very high	17 Å²	17	72.7 Å²	72.7	8%	0.079	36%	0.356	C	S	.	.	H	α-helix	trans	-64.4	-47.6	176	160.9	69.6	0	0	0	112.1	C163 F167 H172 L173 N174 K178 S179 I180 H181	C163-H176 VanDerWaalsContact SG-CE1 3.58Å; C163-H176 PolarHBondContact SG-NE2 3.19Å; F167-H176 HydrophobicContact CE1-CB 3.69Å; F167-H176 HydrophobicContact CE2-CB 3.93Å; F167-H176 AromaticContact CE2-CD2 3.39Å; F167-H176 WeakPolarHBondContact CE2-CD2 3.31Å; F167-H176 AromaticContact CE2-CG 3.68Å; F167-H176 HydrophobicContact CZ-CB 3.29Å; F167-H176 AromaticContact CZ-CD2 3.4Å; F167-H176 VanDerWaalsContact CZ-CD2 3.4Å; F167-H176 WeakPolarHBondContact CZ-CD2 3.36Å; F167-H176 AromaticContact CZ-CG 3.17Å; F167-H176 AromaticContact CZ-ND1 3.77Å; H172-H176 WeakPolarHBondContact O-CB 3.32Å; H172-H176 PolarHBondContact O-N 3.02Å; L173-H176 CarbonylContact O-C 3.48Å; L173-H176 WeakPolarHBondContact O-CA 3.48Å; L173-H176 WeakPolarHBondContact O-CB 3.49Å; L173-H176 PolarHBondContact O-N 2.65Å; L173-H176 VanDerWaalsContact O-N 3.08Å; N174-H176 VanDerWaalsContact C-N 3.3Å; N174-H176 PolarHBondContact O-N 3.48Å; H176-K178 PolarHBondContact O-N 2.86Å; H176-S179 PolarHBondContact O-N 3.24Å; H176-S179 PolarHBondContact O-OG 3.45Å; H176-I180 WeakPolarHBondContact ND1-CG1 3.46Å; H176-I180 WeakPolarHBondContact O-CB 3.39Å; H176-I180 PolarHBondContact O-N 3.44Å; H176-H181 AromaticContact CE1-NE2 3.75Å; H176-H181 AromaticContact NE2-CD2 3.63Å; H176-H181 AromaticContact NE2-NE2 3.37Å; H176-H181 PolarHBondContact NE2-NE2 3.28Å
177	V	92.5	Very high	91.3	Very high	33 Å²	33	72.5 Å²	72.5	20%	0.2	36%	0.361	C	S	.	.	I	π-helix	trans	-58.9	-50	177.5	173.3	0	0	0	0	110.3	L173 N174 S179 H181 E182	L173-V177 HydrophobicContact CD1-CG2 3.9Å; L173-V177 HydrophobicContact CG-CG2 4.38Å; L173-V177 WeakPolarHBondContact O-CG2 3.42Å; L173-V177 PolarHBondContact O-N 2.84Å; N174-V177 PolarHBondContact O-N 3.3Å; V177-S179 PolarHBondContact O-N 3.45Å; V177-H181 HydrophobicContact CG1-CB 4.32Å; V177-H181 WeakPolarHBondContact O-CA 3.26Å; V177-H181 VanDerWaalsContact O-CB 3.31Å; V177-H181 WeakPolarHBondContact O-CB 3.28Å; V177-H181 PolarHBondContact O-N 3.09Å; V177-E182 HydrophobicContact CG1-CG 4.42Å; V177-E182 PolarHBondContact O-N 2.87Å
178	K	91.9	Very high	91.2	Very high	106 Å²	106	71.5 Å²	71.5	46%	0.461	36%	0.358	S	S	.	.	I	π-helix	trans	-56.4	-49.4	176.9	-72.7	-175.5	173.7	-165.8	0	112.3	N174 H176 E182 K183 L184	N174-K178 WeakPolarHBondContact O-CB 3.47Å; N174-K178 VanDerWaalsContact O-CG 3.31Å; N174-K178 WeakPolarHBondContact O-CG 3.46Å; N174-K178 PolarHBondContact O-N 3.48Å; H176-K178 PolarHBondContact O-N 2.86Å; K178-E182 WeakPolarHBondContact CG-OE2 3.42Å; K178-E182 CarbonylContact O-C 3.48Å; K178-E182 WeakPolarHBondContact O-CB 3.4Å; K178-K183 PolarHBondContact O-N 3.47Å; K178-L184 HydrophobicContact CB-CB 4.28Å; K178-L184 HydrophobicContact CB-CD2 4.14Å; K178-L184 HydrophobicContact CD-CD2 4.24Å; K178-L184 HydrophobicContact CG-CD2 4.5Å; K178-L184 WeakPolarHBondContact O-CB 3.39Å; K178-L184 PolarHBondContact O-N 3.39Å
179	S	88.8	Confident	91.2	Very high	25 Å²	25	75.1 Å²	75.1	18%	0.175	38%	0.375	C	S	.	.	I	π-helix	trans	-76.3	-36.9	-173.4	54.1	0	0	0	0	114.5	K175 H176 V177	K175-S179 WeakPolarHBondContact O-CB 3.46Å; K175-S179 PolarHBondContact O-N 3.48Å; K175-S179 PolarHBondContact O-OG 3.11Å; H176-S179 PolarHBondContact O-N 3.24Å; H176-S179 PolarHBondContact O-OG 3.45Å; V177-S179 PolarHBondContact O-N 3.45Å
180	I	88.8	Confident	91.1	Very high	86 Å²	86	80.1 Å²	80.1	44%	0.441	40%	0.397	S	S	.	.	I	π-helix	trans	-96.7	-47	-173.6	-58.2	-55.3	0	0	0	111.5	H176	H176-I180 WeakPolarHBondContact ND1-CG1 3.46Å; H176-I180 WeakPolarHBondContact O-CB 3.39Å; H176-I180 PolarHBondContact O-N 3.44Å
181	H	90.5	Very high	91.1	Very high	48 Å²	48	76.2 Å²	76.2	22%	0.222	39%	0.386	C	S	.	.	I	π-helix	trans	-91.9	-43.6	-169.8	-69.2	-63.4	0	0	0	112.2	C160 Q162 C163 H176 V177	C160-H181 VanDerWaalsContact SG-CD2 3.52Å; C160-H181 PolarHBondContact SG-NE2 3.37Å; Q162-H181 WeakPolarHBondContact CB-CE1 3.4Å; Q162-H181 PolarHBondContact OE1-ND1 3.32Å; C163-H181 PolarHBondContact SG-NE2 3.43Å; H176-H181 AromaticContact CE1-NE2 3.75Å; H176-H181 AromaticContact NE2-CD2 3.63Å; H176-H181 AromaticContact NE2-NE2 3.37Å; H176-H181 PolarHBondContact NE2-NE2 3.28Å; V177-H181 HydrophobicContact CG1-CB 4.32Å; V177-H181 WeakPolarHBondContact O-CA 3.26Å; V177-H181 VanDerWaalsContact O-CB 3.31Å; V177-H181 WeakPolarHBondContact O-CB 3.28Å; V177-H181 PolarHBondContact O-N 3.09Å
182	E	91.9	Very high	91.2	Very high	121 Å²	121	78.9 Å²	78.9	57%	0.565	41%	0.405	S	S	*	.	S	Bend	trans	-85.1	-2.4	172.7	-57.4	171.9	-174.7	0	0	112	V177 K178 L184	V177-E182 HydrophobicContact CG1-CG 4.42Å; V177-E182 PolarHBondContact O-N 2.87Å; K178-E182 WeakPolarHBondContact CG-OE2 3.42Å; K178-E182 CarbonylContact O-C 3.48Å; K178-E182 WeakPolarHBondContact O-CB 3.4Å; E182-L184 PolarHBondContact O-N 3.08Å
183	K	87.8	Confident	91.1	Very high	164 Å²	164	75.8 Å²	75.8	71%	0.713	40%	0.395	S	S	*	.			trans	48.7	29.2	-177.7	-61.1	-177.7	-179.7	179.4	0	113.4	K178 K185	K178-K183 PolarHBondContact O-N 3.47Å; K183-K185 PolarHBondContact O-N 2.86Å
184	L	89.7	Confident	91	Very high	69 Å²	69	78.7 Å²	78.7	36%	0.361	41%	0.408	S	S	.	.			trans	-64.5	124.4	-179.9	-175.5	70.9	0	0	0	109.5	K178 E182	K178-L184 HydrophobicContact CB-CB 4.28Å; K178-L184 HydrophobicContact CB-CD2 4.14Å; K178-L184 HydrophobicContact CD-CD2 4.24Å; K178-L184 HydrophobicContact CG-CD2 4.5Å; K178-L184 WeakPolarHBondContact O-CB 3.39Å; K178-L184 PolarHBondContact O-N 3.39Å; E182-L184 PolarHBondContact O-N 3.08Å
185	K	89.8	Confident	90.8	Very high	81 Å²	81	75.8 Å²	75.8	35%	0.352	39%	0.392	S	S	.	.			trans	-130	156.7	176.4	-65.7	179.9	-168.6	166.2	0	110.9	K183 E194 F195	K183-K185 PolarHBondContact O-N 2.86Å; K185-E194 HydrophobicContact CB-CB 4.32Å; K185-E194 HydrophobicContact CD-CB 3.9Å; K185-E194 HydrophobicContact CD-CG 4.31Å; K185-E194 WeakPolarHBondContact CD-OE2 3.19Å; K185-E194 IonicContact NZ-OE2 3.81Å; K185-E194 PolarHBondContact NZ-OE2 3Å; K185-F195 CarbonylContact C-O 3.59Å; K185-F195 WeakPolarHBondContact CA-O 3.33Å
186	Y	90.7	Very high	90.6	Very high	81 Å²	81	73 Å²	73	32%	0.318	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	104.4	175.4	-60.3	-84.4	0	0	0	106.6	F195 K198	Y186-F195 WeakPolarHBondContact CD2-O 3.39Å; Y186-F195 PolarHBondContact N-O 3.39Å; Y186-F195 WeakPolarHBondContact O-CD2 3.22Å; Y186-F195 PolarHBondContact O-N 3.01Å; Y186-K198 HydrophobicContact CD1-CB 3.99Å; Y186-K198 HydrophobicContact CD1-CG 4.41Å; Y186-K198 VanDerWaalsContact CD2-N 3.27Å; Y186-K198 HydrophobicContact CE1-CB 3.86Å; Y186-K198 HydrophobicContact CE1-CG 4.46Å; Y186-K198 HydrophobicContact CE2-CB 4.41Å; Y186-K198 HydrophobicContact CG-CB 4.33Å
187	A	91.3	Very high	90.3	Very high	62 Å²	62	73.9 Å²	73.9	51%	0.512	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	145.6	179.3	0	0	0	0	0	110.9	L201	A187-L201 WeakPolarHBondContact O-CD2 3.43Å
188	C	91.3	Very high	90.1	Very high	11 Å²	11	78.5 Å²	78.5	7%	0.074	41%	0.411	C	S	.	.			trans	-72.5	140.3	163	172.8	0	0	0	0	109.9	Q190 C191 A193 L201 M205 H209	C188-Q190 PolarHBondContact SG-N 3.45Å; C188-C191 WeakPolarHBondContact CB-O 3.09Å; C188-C191 PolarHBondContact SG-N 2.89Å; C188-C191 PolarHBondContact SG-SG 3.36Å; C188-A193 HydrophobicContact CB-CB 4.42Å; C188-A193 PolarHBondContact N-O 3.38Å; C188-L201 HydrophobicContact CB-CD1 4.03Å; C188-M205 HydrophobicContact CB-CE 3.58Å; C188-M205 WeakPolarHBondContact SG-CE 3.3Å; C188-H209 PolarHBondContact SG-NE2 3.06Å
189	D	92.9	Very high	89.9	Confident	140 Å²	140	79.2 Å²	79.2	75%	0.749	41%	0.414	S	S	*	.	S	Bend	trans	-85	-13.9	174.5	58.2	-16.7	0	0	0	113.4
190	Q	91.2	Very high	89.8	Confident	122 Å²	122	82 Å²	82	57%	0.57	42%	0.421	S	S	*	.	S	Bend	trans	-109.5	-7.4	-178.2	-64.8	-179.5	42.4	0	0	114.3	C188 H209	C188-Q190 PolarHBondContact SG-N 3.45Å; Q190-H209 WeakPolarHBondContact CB-CE1 3.48Å; Q190-H209 VanDerWaalsContact CB-ND1 3.32Å; Q190-H209 WeakPolarHBondContact CB-ND1 3.43Å; Q190-H209 PolarHBondContact OE1-ND1 3.23Å
191	C	92.6	Very high	89.9	Confident	50 Å²	50	79.3 Å²	79.3	34%	0.338	41%	0.408	S	S	.	.	S	Bend	trans	-156.8	172.7	174.8	76.4	0	0	0	0	111.4	C188 A193 H204	C188-C191 WeakPolarHBondContact CB-O 3.09Å; C188-C191 PolarHBondContact SG-N 2.89Å; C188-C191 PolarHBondContact SG-SG 3.36Å; C191-A193 PolarHBondContact O-N 2.89Å; C191-A193 VanDerWaalsContact O-N 3.16Å; C191-A193 WeakPolarHBondContact SG-CB 2.92Å; C191-H204 PolarHBondContact SG-NE2 2.75Å
192	S	92.2	Very high	89.9	Confident	125 Å²	125	80.6 Å²	80.6	87%	0.874	42%	0.415	S	S	*	.	S	Bend	trans	-76.6	7.5	-178.5	55.9	0	0	0	0	114.9
193	A	90.8	Very high	89.7	Confident	28 Å²	28	76.9 Å²	76.9	23%	0.231	40%	0.398	C	S	.	.			trans	-73.4	135.5	-176.8	0	0	0	0	0	112.3	C188 C191 F195	C188-A193 HydrophobicContact CB-CB 4.42Å; C188-A193 PolarHBondContact N-O 3.38Å; C191-A193 PolarHBondContact O-N 2.89Å; C191-A193 VanDerWaalsContact O-N 3.16Å; C191-A193 WeakPolarHBondContact SG-CB 2.92Å; A193-F195 HydrophobicContact CB-CE2 3.67Å; A193-F195 HydrophobicContact CB-CZ 3.81Å
194	E	91.3	Very high	89.8	Confident	83 Å²	83	70.4 Å²	70.4	39%	0.388	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	141.3	177.5	-62.2	-179.9	149.4	0	0	111.4	K15 K185	K15-E194 IonicContact NZ-OE2 2.82Å; K15-E194 PolarHBondContact NZ-OE2 3.3Å; K185-E194 HydrophobicContact CB-CB 4.32Å; K185-E194 HydrophobicContact CD-CB 3.9Å; K185-E194 HydrophobicContact CD-CG 4.31Å; K185-E194 WeakPolarHBondContact CD-OE2 3.19Å; K185-E194 IonicContact NZ-OE2 3.81Å; K185-E194 PolarHBondContact NZ-OE2 3Å
195	F	88.7	Confident	89.9	Confident	17 Å²	17	68.3 Å²	68.3	8%	0.075	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	147.4	-176.7	-58.2	-88.6	0	0	0	112	K185 Y186 A193 S197 L201 H204	K185-F195 CarbonylContact C-O 3.59Å; K185-F195 WeakPolarHBondContact CA-O 3.33Å; Y186-F195 WeakPolarHBondContact CD2-O 3.39Å; Y186-F195 PolarHBondContact N-O 3.39Å; Y186-F195 WeakPolarHBondContact O-CD2 3.22Å; Y186-F195 PolarHBondContact O-N 3.01Å; A193-F195 HydrophobicContact CB-CE2 3.67Å; A193-F195 HydrophobicContact CB-CZ 3.81Å; F195-S197 VanDerWaalsContact C-N 3.26Å; F195-S197 PolarHBondContact O-N 2.82Å; F195-L201 HydrophobicContact CB-CB 4.27Å; F195-L201 HydrophobicContact CD2-CB 3.88Å; F195-L201 HydrophobicContact CD2-CD1 3.81Å; F195-L201 HydrophobicContact CD2-CG 4.46Å; F195-L201 HydrophobicContact CE2-CD1 4.03Å; F195-L201 HydrophobicContact CG-CB 4.22Å; F195-H204 HydrophobicContact CE1-CB 3.81Å; F195-H204 HydrophobicContact CE2-CB 3.86Å; F195-H204 AromaticContact CE2-CD2 3.2Å; F195-H204 WeakPolarHBondContact CE2-CD2 3.3Å; F195-H204 AromaticContact CE2-CG 3.59Å; F195-H204 AromaticContact CE2-NE2 3.91Å; F195-H204 HydrophobicContact CZ-CB 3.34Å; F195-H204 AromaticContact CZ-CD2 3.3Å; F195-H204 WeakPolarHBondContact CZ-CD2 3.2Å; F195-H204 AromaticContact CZ-CG 3.18Å; F195-H204 AromaticContact CZ-ND1 3.76Å; F195-H204 AromaticContact CZ-NE2 3.97Å
196	T	86.8	Confident	89.9	Confident	64 Å²	64	67.1 Å²	67.1	39%	0.393	35%	0.354	S	S	.	.	S	Bend	trans	-80.9	-7.2	175.4	55.1	0	0	0	0	113.2
197	S	85.2	Confident	89.9	Confident	35 Å²	35	64.6 Å²	64.6	25%	0.245	35%	0.347	C	S	.	.	S	Bend	trans	-142	138.7	179.2	-173.6	0	0	0	0	111.2	F195 F199 Y200 L201	F195-S197 VanDerWaalsContact C-N 3.26Å; F195-S197 PolarHBondContact O-N 2.82Å; S197-F199 PolarHBondContact O-N 3.09Å; S197-F199 PolarHBondContact OG-N 3.37Å; S197-Y200 PolarHBondContact O-N 3.04Å; S197-Y200 VanDerWaalsContact O-N 3.1Å; S197-L201 PolarHBondContact O-N 3.05Å
198	K	88.6	Confident	89.9	Confident	130 Å²	130	66.9 Å²	66.9	57%	0.565	35%	0.349	S	S	*	.	H	α-helix	trans	-55	-34.6	172.2	-170.3	176.2	-178.2	178.7	0	112.5	Y186 Y200 L201 I202	Y186-K198 HydrophobicContact CD1-CB 3.99Å; Y186-K198 HydrophobicContact CD1-CG 4.41Å; Y186-K198 VanDerWaalsContact CD2-N 3.27Å; Y186-K198 HydrophobicContact CE1-CB 3.86Å; Y186-K198 HydrophobicContact CE1-CG 4.46Å; Y186-K198 HydrophobicContact CE2-CB 4.41Å; Y186-K198 HydrophobicContact CG-CB 4.33Å; K198-Y200 PolarHBondContact O-N 3.44Å; K198-L201 PolarHBondContact O-N 3.48Å; K198-I202 HydrophobicContact CG-CD1 4.08Å; K198-I202 WeakPolarHBondContact O-CG1 3.45Å; K198-I202 PolarHBondContact O-N 2.85Å
199	F	87.3	Confident	89.8	Confident	122 Å²	122	68.9 Å²	68.9	54%	0.535	36%	0.357	S	S	.	.	H	α-helix	trans	-60.3	-45.9	177.2	173.7	-97.5	0	0	0	111.7	S197 I202 E203	S197-F199 PolarHBondContact O-N 3.09Å; S197-F199 PolarHBondContact OG-N 3.37Å; F199-I202 PolarHBondContact O-N 3.29Å; F199-E203 HydrophobicContact CE1-CG 4.03Å; F199-E203 HydrophobicContact CE2-CG 4.12Å; F199-E203 HydrophobicContact CZ-CG 3.77Å; F199-E203 PolarHBondContact O-N 3.48Å
200	Y	87.1	Confident	89.8	Confident	84 Å²	84	69 Å²	69	33%	0.329	35%	0.353	S	S	.	.	H	α-helix	trans	-71.2	-33.5	-179.2	-65.1	-53.6	0	0	0	112.6	G11 S197 K198 E203 H204	G11-Y200 VanDerWaalsContact N-CE1 3.3Å; S197-Y200 PolarHBondContact O-N 3.04Å; S197-Y200 VanDerWaalsContact O-N 3.1Å; K198-Y200 PolarHBondContact O-N 3.44Å; Y200-E203 PolarHBondContact O-N 2.63Å; Y200-H204 WeakPolarHBondContact O-CB 3.22Å; Y200-H204 PolarHBondContact O-N 3.46Å
201	L	89.9	Confident	89.6	Confident	29 Å²	29	65.1 Å²	65.1	15%	0.152	35%	0.347	C	S	.	.	H	α-helix	trans	-59.8	-48	170.3	172.4	62.3	0	0	0	111.1	A187 C188 F195 S197 K198 E203 H204 M205	A187-L201 WeakPolarHBondContact O-CD2 3.43Å; C188-L201 HydrophobicContact CB-CD1 4.03Å; F195-L201 HydrophobicContact CB-CB 4.27Å; F195-L201 HydrophobicContact CD2-CB 3.88Å; F195-L201 HydrophobicContact CD2-CD1 3.81Å; F195-L201 HydrophobicContact CD2-CG 4.46Å; F195-L201 HydrophobicContact CE2-CD1 4.03Å; F195-L201 HydrophobicContact CG-CB 4.22Å; S197-L201 PolarHBondContact O-N 3.05Å; K198-L201 PolarHBondContact O-N 3.48Å; L201-E203 PolarHBondContact O-N 3.42Å; L201-H204 WeakPolarHBondContact O-CB 3.45Å; L201-H204 PolarHBondContact O-N 2.85Å; L201-M205 HydrophobicContact CD1-CE 3.9Å; L201-M205 HydrophobicContact CD1-CG 4.36Å; L201-M205 WeakPolarHBondContact O-CG 3.45Å; L201-M205 PolarHBondContact O-N 3.27Å
202	I	90.1	Very high	89.5	Confident	74 Å²	74	66.8 Å²	66.8	38%	0.379	35%	0.348	S	S	.	.	H	α-helix	trans	-62.9	-43.9	179.9	-68.8	167.7	0	0	0	111.2	K198 F199 H204 M205 K206	K198-I202 HydrophobicContact CG-CD1 4.08Å; K198-I202 WeakPolarHBondContact O-CG1 3.45Å; K198-I202 PolarHBondContact O-N 2.85Å; F199-I202 PolarHBondContact O-N 3.29Å; I202-H204 VanDerWaalsContact C-N 3.33Å; I202-M205 PolarHBondContact O-N 3.23Å; I202-K206 HydrophobicContact CG2-CD 4.44Å; I202-K206 WeakPolarHBondContact O-CG 3.05Å; I202-K206 PolarHBondContact O-N 3.14Å; I202-K206 VanDerWaalsContact O-N 3.07Å
203	E	87.9	Confident	89.4	Confident	44 Å²	44	67.3 Å²	67.3	21%	0.206	34%	0.335	C	S	.	.	H	α-helix	trans	-66.1	-36.9	176.6	-74.8	-61.2	115.7	0	0	111.9	F199 Y200 L201 K206 V207	F199-E203 HydrophobicContact CE1-CG 4.03Å; F199-E203 HydrophobicContact CE2-CG 4.12Å; F199-E203 HydrophobicContact CZ-CG 3.77Å; F199-E203 PolarHBondContact O-N 3.48Å; Y200-E203 PolarHBondContact O-N 2.63Å; L201-E203 PolarHBondContact O-N 3.42Å; E203-K206 PolarHBondContact O-N 3.08Å; E203-K206 WeakPolarHBondContact OE1-CD 3.34Å; E203-K206 IonicContact OE1-NZ 2.84Å; E203-K206 PolarHBondContact OE1-NZ 2.96Å; E203-V207 WeakPolarHBondContact O-CB 3.19Å; E203-V207 VanDerWaalsContact O-CG2 3.24Å; E203-V207 WeakPolarHBondContact O-CG2 3.24Å; E203-V207 PolarHBondContact O-N 2.8Å
204	H	89.5	Confident	89.4	Confident	27 Å²	27	67.7 Å²	67.7	13%	0.125	33%	0.33	C	S	.	.	H	α-helix	trans	-61.3	-43.6	172	163.6	65.7	0	0	0	112.1	C191 F195 Y200 L201 I202 K206 V207 I208 H209	C191-H204 PolarHBondContact SG-NE2 2.75Å; F195-H204 HydrophobicContact CE1-CB 3.81Å; F195-H204 HydrophobicContact CE2-CB 3.86Å; F195-H204 AromaticContact CE2-CD2 3.2Å; F195-H204 WeakPolarHBondContact CE2-CD2 3.3Å; F195-H204 AromaticContact CE2-CG 3.59Å; F195-H204 AromaticContact CE2-NE2 3.91Å; F195-H204 HydrophobicContact CZ-CB 3.34Å; F195-H204 AromaticContact CZ-CD2 3.3Å; F195-H204 WeakPolarHBondContact CZ-CD2 3.2Å; F195-H204 AromaticContact CZ-CG 3.18Å; F195-H204 AromaticContact CZ-ND1 3.76Å; F195-H204 AromaticContact CZ-NE2 3.97Å; Y200-H204 WeakPolarHBondContact O-CB 3.22Å; Y200-H204 PolarHBondContact O-N 3.46Å; L201-H204 WeakPolarHBondContact O-CB 3.45Å; L201-H204 PolarHBondContact O-N 2.85Å; I202-H204 VanDerWaalsContact C-N 3.33Å; H204-K206 PolarHBondContact O-N 3.35Å; H204-V207 PolarHBondContact O-N 3.16Å; H204-I208 VanDerWaalsContact ND1-CG1 3.31Å; H204-I208 WeakPolarHBondContact ND1-CG1 3.38Å; H204-I208 WeakPolarHBondContact O-CB 3.22Å; H204-I208 PolarHBondContact O-N 3.27Å; H204-H209 AromaticContact CE1-NE2 3.76Å; H204-H209 AromaticContact NE2-CD2 3.95Å; H204-H209 AromaticContact NE2-NE2 3.51Å
205	M	91.7	Very high	89.5	Confident	25 Å²	25	67.6 Å²	67.6	12%	0.123	34%	0.337	C	S	.	.	I	π-helix	trans	-58	-50.8	176.6	-73.5	-54.4	92.8	0	0	110.8	C188 L201 I202 V207 H209 E210	C188-M205 HydrophobicContact CB-CE 3.58Å; C188-M205 WeakPolarHBondContact SG-CE 3.3Å; L201-M205 HydrophobicContact CD1-CE 3.9Å; L201-M205 HydrophobicContact CD1-CG 4.36Å; L201-M205 WeakPolarHBondContact O-CG 3.45Å; L201-M205 PolarHBondContact O-N 3.27Å; I202-M205 PolarHBondContact O-N 3.23Å; M205-V207 VanDerWaalsContact C-N 3.33Å; M205-V207 PolarHBondContact O-N 2.74Å; M205-H209 WeakPolarHBondContact CE-CD2 3.49Å; M205-H209 WeakPolarHBondContact O-CA 3.42Å; M205-H209 WeakPolarHBondContact O-CB 3.46Å; M205-H209 PolarHBondContact O-N 3.01Å; M205-E210 PolarHBondContact O-N 3.48Å
206	K	91.1	Very high	89.7	Confident	56 Å²	56	67.3 Å²	67.3	24%	0.243	34%	0.337	C	S	.	.	I	π-helix	trans	-57	-47.4	178.5	-69.7	173.4	-170.9	165.1	0	112	I202 E203 H204 E210 G211 K212	I202-K206 HydrophobicContact CG2-CD 4.44Å; I202-K206 WeakPolarHBondContact O-CG 3.05Å; I202-K206 PolarHBondContact O-N 3.14Å; I202-K206 VanDerWaalsContact O-N 3.07Å; E203-K206 PolarHBondContact O-N 3.08Å; E203-K206 WeakPolarHBondContact OE1-CD 3.34Å; E203-K206 IonicContact OE1-NZ 2.84Å; E203-K206 PolarHBondContact OE1-NZ 2.96Å; H204-K206 PolarHBondContact O-N 3.35Å; K206-E210 WeakPolarHBondContact CG-OE2 3.33Å; K206-E210 CarbonylContact O-C 3.6Å; K206-E210 WeakPolarHBondContact O-CB 3.29Å; K206-G211 PolarHBondContact O-N 3.08Å; K206-K212 HydrophobicContact CB-CB 4.1Å; K206-K212 HydrophobicContact CB-CD 4.04Å; K206-K212 HydrophobicContact CD-CD 4.27Å; K206-K212 WeakPolarHBondContact O-CA 3.33Å; K206-K212 WeakPolarHBondContact O-CB 3.3Å; K206-K212 PolarHBondContact O-N 2.86Å
207	V	89.9	Confident	90.1	Very high	29 Å²	29	72.6 Å²	72.6	18%	0.176	35%	0.351	C	S	.	.	I	π-helix	trans	-78.1	-44	-171.1	173.8	0	0	0	0	112.2	E203 H204 M205 S224	E203-V207 WeakPolarHBondContact O-CB 3.19Å; E203-V207 VanDerWaalsContact O-CG2 3.24Å; E203-V207 WeakPolarHBondContact O-CG2 3.24Å; E203-V207 PolarHBondContact O-N 2.8Å; H204-V207 PolarHBondContact O-N 3.16Å; M205-V207 VanDerWaalsContact C-N 3.33Å; M205-V207 PolarHBondContact O-N 2.74Å; V207-S224 WeakPolarHBondContact CG2-O 3.45Å
208	I	91	Very high	90.4	Very high	109 Å²	109	75.2 Å²	75.2	56%	0.559	36%	0.359	S	S	*	.	I	π-helix	trans	-91.2	-40.1	-171	-60.2	-57.9	0	0	0	112	H204	H204-I208 VanDerWaalsContact ND1-CG1 3.31Å; H204-I208 WeakPolarHBondContact ND1-CG1 3.38Å; H204-I208 WeakPolarHBondContact O-CB 3.22Å; H204-I208 PolarHBondContact O-N 3.27Å
209	H	89.8	Confident	90.7	Very high	53 Å²	53	70.9 Å²	70.9	25%	0.245	35%	0.345	C	S	.	.	I	π-helix	trans	-99.2	-42.1	-172.9	-64.2	-80.4	0	0	0	112.5	C188 Q190 H204 M205 G211	C188-H209 PolarHBondContact SG-NE2 3.06Å; Q190-H209 WeakPolarHBondContact CB-CE1 3.48Å; Q190-H209 VanDerWaalsContact CB-ND1 3.32Å; Q190-H209 WeakPolarHBondContact CB-ND1 3.43Å; Q190-H209 PolarHBondContact OE1-ND1 3.23Å; H204-H209 AromaticContact CE1-NE2 3.76Å; H204-H209 AromaticContact NE2-CD2 3.95Å; H204-H209 AromaticContact NE2-NE2 3.51Å; M205-H209 WeakPolarHBondContact CE-CD2 3.49Å; M205-H209 WeakPolarHBondContact O-CA 3.42Å; M205-H209 WeakPolarHBondContact O-CB 3.46Å; M205-H209 PolarHBondContact O-N 3.01Å; H209-G211 VanDerWaalsContact C-N 3.3Å
210	E	92.2	Very high	91	Very high	142 Å²	142	72.8 Å²	72.8	66%	0.664	36%	0.361	S	S	*	.	S	Bend	trans	-84.4	-8.2	174.8	-53.7	169.9	-171	0	0	112.2	M205 K206 K212	M205-E210 PolarHBondContact O-N 3.48Å; K206-E210 WeakPolarHBondContact CG-OE2 3.33Å; K206-E210 CarbonylContact O-C 3.6Å; K206-E210 WeakPolarHBondContact O-CB 3.29Å; E210-K212 VanDerWaalsContact C-N 3.28Å; E210-K212 PolarHBondContact O-N 2.73Å
211	G	88	Confident	91.3	Very high	42 Å²	42	74.5 Å²	74.5	43%	0.433	37%	0.37	S	S	.	.			trans	69.4	20.5	177.8	0	0	0	0	0	114.5	K206 H209 K213	K206-G211 PolarHBondContact O-N 3.08Å; H209-G211 VanDerWaalsContact C-N 3.3Å; G211-K213 PolarHBondContact O-N 3.49Å
212	K	89.8	Confident	91.4	Very high	84 Å²	84	77.3 Å²	77.3	37%	0.365	39%	0.385	S	S	.	.			trans	-60.5	121.7	178.6	-171.3	179.2	-175.2	-176.5	0	110.7	K206 E210 Y214	K206-K212 HydrophobicContact CB-CB 4.1Å; K206-K212 HydrophobicContact CB-CD 4.04Å; K206-K212 HydrophobicContact CD-CD 4.27Å; K206-K212 WeakPolarHBondContact O-CA 3.33Å; K206-K212 WeakPolarHBondContact O-CB 3.3Å; K206-K212 PolarHBondContact O-N 2.86Å; E210-K212 VanDerWaalsContact C-N 3.28Å; E210-K212 PolarHBondContact O-N 2.73Å; K212-Y214 WeakPolarHBondContact CE-OH 3.49Å; K212-Y214 PolarHBondContact NZ-OH 3.33Å
213	K	90.1	Very high	91.5	Very high	137 Å²	137	75.8 Å²	75.8	60%	0.596	38%	0.376	S	S	*	.			trans	-119.6	156.8	175.2	-66.7	176	-172.8	177.8	0	110.6	G211 P215 N222	G211-K213 PolarHBondContact O-N 3.49Å; K213-P215 WeakPolarHBondContact O-CD 3.44Å; K213-N222 HydrophobicContact CB-CB 4.32Å; K213-N222 HydrophobicContact CD-CB 4.05Å
214	Y	91.1	Very high	91.5	Very high	35 Å²	35	76.6 Å²	76.6	14%	0.137	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	92.5	174.5	-60.8	-86.3	0	0	0	107.5	K212 F223 S224 S225 K226	K212-Y214 WeakPolarHBondContact CE-OH 3.49Å; K212-Y214 PolarHBondContact NZ-OH 3.33Å; Y214-F223 WeakPolarHBondContact CD2-O 3.29Å; Y214-F223 PolarHBondContact N-O 3.21Å; Y214-F223 PolarHBondContact O-N 2.95Å; Y214-S224 WeakPolarHBondContact CE2-O 3.34Å; Y214-S225 VanDerWaalsContact CD2-C 3.48Å; Y214-S225 VanDerWaalsContact CD2-CA 3.49Å; Y214-K226 HydrophobicContact CD1-CB 4.01Å; Y214-K226 HydrophobicContact CE1-CB 4.01Å
215	P	93.2	Very high	91.4	Very high	82 Å²	82	76 Å²	76	53%	0.532	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	144.5	-178.1	28.1	-33.7	0	0	0	111.1	K213 N222 L229	K213-P215 WeakPolarHBondContact O-CD 3.44Å; P215-N222 WeakPolarHBondContact CB-OD1 3.37Å; P215-L229 WeakPolarHBondContact O-CD2 3.26Å
216	C	94.2	Very high	91.3	Very high	11 Å²	11	81.3 Å²	81.3	7%	0.074	41%	0.408	C	S	.	.			trans	-75.9	136.5	164.2	-173	0	0	0	0	109.7	Q218 C219 K221 F223 L229 H232 H237	C216-Q218 VanDerWaalsContact C-N 3.28Å; C216-Q218 PolarHBondContact SG-N 3.01Å; C216-Q218 VanDerWaalsContact SG-N 3.4Å; C216-C219 WeakPolarHBondContact CB-O 3.19Å; C216-K221 PolarHBondContact N-O 3.12Å; C216-F223 HydrophobicContact CB-CE2 4.37Å; C216-L229 HydrophobicContact CB-CD1 3.8Å; C216-H232 PolarHBondContact SG-NE2 3.44Å; C216-H237 PolarHBondContact SG-NE2 2.82Å; C216-H237 VanDerWaalsContact SG-NE2 3.38Å
217	Y	93.8	Very high	91.1	Very high	175 Å²	175	80.5 Å²	80.5	69%	0.686	41%	0.409	S	S	*	.	S	Bend	trans	-82.9	-6.6	177.1	65.6	-88.3	0	0	0	113.1	V233	Y217-V233 HydrophobicContact CE1-CG1 4.49Å; Y217-V233 HydrophobicContact CE1-CG2 4.33Å
218	Q	92.8	Very high	91	Very high	90 Å²	90	80.9 Å²	80.9	42%	0.421	41%	0.41	S	S	.	.	S	Bend	trans	-114.3	-5.1	-178.7	-57.4	-167.4	29.3	0	0	113.5	C216 H237	C216-Q218 VanDerWaalsContact C-N 3.28Å; C216-Q218 PolarHBondContact SG-N 3.01Å; C216-Q218 VanDerWaalsContact SG-N 3.4Å; Q218-H237 WeakPolarHBondContact CB-CE1 3.26Å; Q218-H237 VanDerWaalsContact CB-ND1 3.34Å; Q218-H237 WeakPolarHBondContact CB-ND1 3.11Å; Q218-H237 PolarHBondContact O-CE1 3.4Å; Q218-H237 VanDerWaalsContact OE1-CB 3.23Å; Q218-H237 VanDerWaalsContact OE1-CG 3.27Å; Q218-H237 PolarHBondContact OE1-ND1 3.48Å; Q218-H237 VanDerWaalsContact OE1-ND1 3.08Å
219	C	94.5	Very high	91.1	Very high	39 Å²	39	76.8 Å²	76.8	26%	0.264	39%	0.389	S	S	.	.	S	Bend	trans	-159.7	168	173	70.9	0	0	0	0	111.3	C216 K221 H232 H237	C216-C219 WeakPolarHBondContact CB-O 3.19Å; C219-K221 PolarHBondContact O-N 2.99Å; C219-H232 PolarHBondContact SG-NE2 3.45Å; C219-H237 PolarHBondContact SG-NE2 2.82Å; C219-H237 VanDerWaalsContact SG-NE2 3.43Å
220	D	93.5	Very high	91.1	Very high	161 Å²	161	78.2 Å²	78.2	86%	0.861	40%	0.398	S	S	*	.	S	Bend	trans	-74.6	10.3	-175.1	-53.6	-43.5	0	0	0	114.7	N222	D220-N222 PolarHBondContact O-ND2 3.45Å
221	K	93.4	Very high	91	Very high	120 Å²	120	73.9 Å²	73.9	52%	0.522	38%	0.379	S	S	.	.			trans	-79.7	135.5	-178.1	-68.5	-173.7	179.1	179.6	0	111.6	C216 C219 F223	C216-K221 PolarHBondContact N-O 3.12Å; C219-K221 PolarHBondContact O-N 2.99Å; K221-F223 HydrophobicContact CB-CE2 3.78Å; K221-F223 HydrophobicContact CB-CZ 3.92Å; K221-F223 HydrophobicContact CD-CZ 4.49Å
222	N	92.5	Very high	91.2	Very high	89 Å²	89	72.6 Å²	72.6	48%	0.476	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	140.9	177.4	-72.8	-82.4	0	0	0	110.7	K213 P215 D220	K213-N222 HydrophobicContact CB-CB 4.32Å; K213-N222 HydrophobicContact CD-CB 4.05Å; P215-N222 WeakPolarHBondContact CB-OD1 3.37Å; D220-N222 PolarHBondContact O-ND2 3.45Å
223	F	90.8	Very high	91.3	Very high	41 Å²	41	69.2 Å²	69.2	18%	0.18	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	151.6	-177.9	-61.4	-88.9	0	0	0	111.7	Y214 C216 K221 S225 N228 L229 H232	Y214-F223 WeakPolarHBondContact CD2-O 3.29Å; Y214-F223 PolarHBondContact N-O 3.21Å; Y214-F223 PolarHBondContact O-N 2.95Å; C216-F223 HydrophobicContact CB-CE2 4.37Å; K221-F223 HydrophobicContact CB-CE2 3.78Å; K221-F223 HydrophobicContact CB-CZ 3.92Å; K221-F223 HydrophobicContact CD-CZ 4.49Å; F223-S225 VanDerWaalsContact C-N 3.33Å; F223-N228 HydrophobicContact CB-CB 4.35Å; F223-N228 HydrophobicContact CD1-CB 3.98Å; F223-N228 HydrophobicContact CG-CB 4.49Å; F223-L229 HydrophobicContact CB-CB 4.13Å; F223-L229 HydrophobicContact CD2-CB 3.9Å; F223-L229 HydrophobicContact CD2-CD1 3.72Å; F223-L229 HydrophobicContact CD2-CG 4.41Å; F223-L229 HydrophobicContact CE2-CD1 3.97Å; F223-L229 HydrophobicContact CG-CB 4.1Å; F223-H232 HydrophobicContact CE1-CB 3.68Å; F223-H232 AromaticContact CE1-CG 3.97Å; F223-H232 HydrophobicContact CE2-CB 3.91Å; F223-H232 AromaticContact CE2-CD2 3.35Å; F223-H232 WeakPolarHBondContact CE2-CD2 3.39Å; F223-H232 AromaticContact CE2-CG 3.59Å; F223-H232 AromaticContact CE2-NE2 3.97Å; F223-H232 HydrophobicContact CZ-CB 3.33Å; F223-H232 AromaticContact CZ-CD2 3.4Å; F223-H232 VanDerWaalsContact CZ-CD2 3.4Å; F223-H232 WeakPolarHBondContact CZ-CD2 3.42Å; F223-H232 AromaticContact CZ-CG 3.12Å; F223-H232 AromaticContact CZ-ND1 3.6Å; F223-H232 AromaticContact CZ-NE2 3.98Å
224	S	88.4	Confident	91.5	Very high	61 Å²	61	68.1 Å²	68.1	43%	0.427	34%	0.343	S	S	.	.	S	Bend	trans	-79.8	-13.1	174.7	50.4	0	0	0	0	113.5	V207 Y214	V207-S224 WeakPolarHBondContact CG2-O 3.45Å; Y214-S224 WeakPolarHBondContact CE2-O 3.34Å
225	S	88.6	Confident	91.6	Very high	16 Å²	16	67.3 Å²	67.3	11%	0.112	34%	0.342	C	S	.	.	S	Bend	trans	-145.1	148.9	178.5	78.3	0	0	0	0	111.8	Y214 F223 C227 N228 L229	Y214-S225 VanDerWaalsContact CD2-C 3.48Å; Y214-S225 VanDerWaalsContact CD2-CA 3.49Å; F223-S225 VanDerWaalsContact C-N 3.33Å; S225-C227 PolarHBondContact O-N 3Å; S225-N228 PolarHBondContact O-N 3.35Å; S225-N228 WeakPolarHBondContact OG-CB 3.49Å; S225-N228 PolarHBondContact OG-N 3.18Å; S225-N228 VanDerWaalsContact OG-N 3.15Å; S225-N228 PolarHBondContact OG-ND2 3.41Å; S225-L229 PolarHBondContact O-N 2.94Å; S225-L229 VanDerWaalsContact O-N 3.11Å
226	K	88.8	Confident	91.6	Very high	136 Å²	136	67.9 Å²	67.9	59%	0.591	34%	0.339	S	S	*	.	H	α-helix	trans	-60.7	-34.1	175.6	-174	170.7	-177.3	173.4	0	112.3	Y214 N230	Y214-K226 HydrophobicContact CD1-CB 4.01Å; Y214-K226 HydrophobicContact CE1-CB 4.01Å; K226-N230 WeakPolarHBondContact O-CB 3.43Å; K226-N230 PolarHBondContact O-N 3.47Å
227	C	86.3	Confident	91.5	Very high	39 Å²	39	69.9 Å²	69.9	26%	0.264	35%	0.348	S	S	.	.	H	α-helix	trans	-65	-45.8	176.1	166.3	0	0	0	0	112	C9 S225 L229 N230 I231	C9-C227 HydrophobicContact CB-CB 3.41Å; C9-C227 VanDerWaalsContact CB-CB 3.41Å; C9-C227 WeakPolarHBondContact CB-SG 3.24Å; C9-C227 WeakPolarHBondContact SG-CB 3.49Å; C9-C227 CovalentContact SG-SG 2Å; C9-C227 PolarHBondContact SG-SG 2.81Å; S225-C227 PolarHBondContact O-N 3Å; C227-L229 VanDerWaalsContact C-N 3.3Å; C227-L229 PolarHBondContact O-N 2.8Å; C227-N230 PolarHBondContact O-N 3.19Å; C227-N230 VanDerWaalsContact O-N 3.14Å; C227-I231 WeakPolarHBondContact O-CG1 3.46Å; C227-I231 PolarHBondContact O-N 3.47Å
228	N	89	Confident	91.4	Very high	37 Å²	37	66.7 Å²	66.7	20%	0.198	34%	0.339	C	S	.	.	H	α-helix	trans	-64.8	-37.7	179.2	-70.2	-13.4	0	0	0	111.3	F223 S225 I231 H232	F223-N228 HydrophobicContact CB-CB 4.35Å; F223-N228 HydrophobicContact CD1-CB 3.98Å; F223-N228 HydrophobicContact CG-CB 4.49Å; S225-N228 PolarHBondContact O-N 3.35Å; S225-N228 WeakPolarHBondContact OG-CB 3.49Å; S225-N228 PolarHBondContact OG-N 3.18Å; S225-N228 VanDerWaalsContact OG-N 3.15Å; S225-N228 PolarHBondContact OG-ND2 3.41Å; N228-I231 PolarHBondContact O-N 2.83Å; N228-H232 VanDerWaalsContact O-CB 3.3Å; N228-H232 WeakPolarHBondContact O-CB 3.31Å; N228-H232 PolarHBondContact O-N 2.8Å
229	L	91.6	Very high	91.3	Very high	23 Å²	23	64.5 Å²	64.5	12%	0.12	34%	0.341	C	S	.	.	H	α-helix	trans	-59.4	-49	170.2	171.8	61	0	0	0	111.7	P215 C216 F223 S225 C227 I231 H232 V233	P215-L229 WeakPolarHBondContact O-CD2 3.26Å; C216-L229 HydrophobicContact CB-CD1 3.8Å; F223-L229 HydrophobicContact CB-CB 4.13Å; F223-L229 HydrophobicContact CD2-CB 3.9Å; F223-L229 HydrophobicContact CD2-CD1 3.72Å; F223-L229 HydrophobicContact CD2-CG 4.41Å; F223-L229 HydrophobicContact CE2-CD1 3.97Å; F223-L229 HydrophobicContact CG-CB 4.1Å; S225-L229 PolarHBondContact O-N 2.94Å; S225-L229 VanDerWaalsContact O-N 3.11Å; C227-L229 VanDerWaalsContact C-N 3.3Å; C227-L229 PolarHBondContact O-N 2.8Å; L229-I231 VanDerWaalsContact C-N 3.34Å; L229-I231 PolarHBondContact O-N 3.45Å; L229-H232 WeakPolarHBondContact O-CB 3.29Å; L229-H232 PolarHBondContact O-N 2.87Å; L229-H232 VanDerWaalsContact O-N 3.14Å; L229-V233 HydrophobicContact CD1-CG2 3.94Å; L229-V233 HydrophobicContact CG-CG2 4.48Å; L229-V233 WeakPolarHBondContact O-CG2 3.42Å; L229-V233 PolarHBondContact O-N 3.49Å
230	N	91.4	Very high	91.1	Very high	83 Å²	83	66.1 Å²	66.1	44%	0.444	35%	0.346	S	S	.	.	H	α-helix	trans	-60.8	-42.7	179.5	-82	-14.5	0	0	0	112.4	K226 C227 H232 V233 K234	K226-N230 WeakPolarHBondContact O-CB 3.43Å; K226-N230 PolarHBondContact O-N 3.47Å; C227-N230 PolarHBondContact O-N 3.19Å; C227-N230 VanDerWaalsContact O-N 3.14Å; N230-H232 VanDerWaalsContact C-N 3.33Å; N230-V233 PolarHBondContact O-N 3.1Å; N230-K234 WeakPolarHBondContact O-CB 3.5Å; N230-K234 VanDerWaalsContact O-CG 3.31Å; N230-K234 WeakPolarHBondContact O-CG 3.47Å; N230-K234 PolarHBondContact O-N 3.31Å
231	I	90	Very high	91	Very high	51 Å²	51	62.9 Å²	62.9	26%	0.262	32%	0.322	S	S	.	.	H	α-helix	trans	-60.1	-47.7	174.1	-72.5	171.1	0	0	0	109.8	C227 N228 L229 V233 K234 V235 F253	C227-I231 WeakPolarHBondContact O-CG1 3.46Å; C227-I231 PolarHBondContact O-N 3.47Å; N228-I231 PolarHBondContact O-N 2.83Å; L229-I231 VanDerWaalsContact C-N 3.34Å; L229-I231 PolarHBondContact O-N 3.45Å; I231-V233 PolarHBondContact O-N 2.75Å; I231-K234 PolarHBondContact O-N 3.2Å; I231-V235 HydrophobicContact CG2-CG2 4.31Å; I231-V235 WeakPolarHBondContact O-CB 3.21Å; I231-V235 VanDerWaalsContact O-CG2 3.29Å; I231-V235 WeakPolarHBondContact O-CG2 3.29Å; I231-V235 PolarHBondContact O-N 3.16Å; I231-F253 HydrophobicContact CD1-CE1 4.45Å; I231-F253 HydrophobicContact CG2-CD1 4.41Å; I231-F253 HydrophobicContact CG2-CE1 3.37Å; I231-F253 HydrophobicContact CG2-CZ 3.79Å
232	H	91.8	Very high	90.9	Very high	15 Å²	15	61 Å²	61	7%	0.069	31%	0.314	C	S	.	.	H	α-helix	trans	-58.3	-47.3	178.3	161.9	71.8	0	0	0	111.9	C216 C219 F223 N228 L229 N230 K234 V235 I236 H237	C216-H232 PolarHBondContact SG-NE2 3.44Å; C219-H232 PolarHBondContact SG-NE2 3.45Å; F223-H232 HydrophobicContact CE1-CB 3.68Å; F223-H232 AromaticContact CE1-CG 3.97Å; F223-H232 HydrophobicContact CE2-CB 3.91Å; F223-H232 AromaticContact CE2-CD2 3.35Å; F223-H232 WeakPolarHBondContact CE2-CD2 3.39Å; F223-H232 AromaticContact CE2-CG 3.59Å; F223-H232 AromaticContact CE2-NE2 3.97Å; F223-H232 HydrophobicContact CZ-CB 3.33Å; F223-H232 AromaticContact CZ-CD2 3.4Å; F223-H232 VanDerWaalsContact CZ-CD2 3.4Å; F223-H232 WeakPolarHBondContact CZ-CD2 3.42Å; F223-H232 AromaticContact CZ-CG 3.12Å; F223-H232 AromaticContact CZ-ND1 3.6Å; F223-H232 AromaticContact CZ-NE2 3.98Å; N228-H232 VanDerWaalsContact O-CB 3.3Å; N228-H232 WeakPolarHBondContact O-CB 3.31Å; N228-H232 PolarHBondContact O-N 2.8Å; L229-H232 WeakPolarHBondContact O-CB 3.29Å; L229-H232 PolarHBondContact O-N 2.87Å; L229-H232 VanDerWaalsContact O-N 3.14Å; N230-H232 VanDerWaalsContact C-N 3.33Å; H232-K234 PolarHBondContact O-N 3.41Å; H232-V235 PolarHBondContact O-N 2.86Å; H232-I236 WeakPolarHBondContact ND1-CG1 3.26Å; H232-I236 VanDerWaalsContact O-CB 3.3Å; H232-I236 WeakPolarHBondContact O-CB 3.18Å; H232-I236 PolarHBondContact O-N 3.21Å; H232-H237 AromaticContact CE1-CD2 4Å; H232-H237 AromaticContact CE1-NE2 3.66Å; H232-H237 AromaticContact NE2-CD2 3.51Å; H232-H237 AromaticContact NE2-NE2 3.2Å; H232-H237 PolarHBondContact NE2-NE2 3.09Å
233	V	92.4	Very high	91	Very high	12 Å²	12	61.1 Å²	61.1	7%	0.073	31%	0.313	C	S	.	.	I	π-helix	trans	-59.9	-47	177.2	172.7	0	0	0	0	110.9	Y217 L229 N230 I231 V235 H237 Q238	Y217-V233 HydrophobicContact CE1-CG1 4.49Å; Y217-V233 HydrophobicContact CE1-CG2 4.33Å; L229-V233 HydrophobicContact CD1-CG2 3.94Å; L229-V233 HydrophobicContact CG-CG2 4.48Å; L229-V233 WeakPolarHBondContact O-CG2 3.42Å; L229-V233 PolarHBondContact O-N 3.49Å; N230-V233 PolarHBondContact O-N 3.1Å; I231-V233 PolarHBondContact O-N 2.75Å; V233-V235 PolarHBondContact O-N 3.5Å; V233-H237 HydrophobicContact CG1-CB 4.39Å; V233-H237 WeakPolarHBondContact O-CA 3.35Å; V233-H237 WeakPolarHBondContact O-CB 3.38Å; V233-H237 PolarHBondContact O-N 2.87Å; V233-Q238 HydrophobicContact CG1-CG 4.44Å; V233-Q238 PolarHBondContact O-N 3.01Å
234	K	92.7	Very high	91.3	Very high	114 Å²	114	59.2 Å²	59.2	50%	0.496	31%	0.305	S	S	.	.	I	π-helix	trans	-58.8	-47	177.3	-74.3	-177.5	175.9	-172.9	0	112.4	N230 I231 H232 Q238 G239 I240	N230-K234 WeakPolarHBondContact O-CB 3.5Å; N230-K234 VanDerWaalsContact O-CG 3.31Å; N230-K234 WeakPolarHBondContact O-CG 3.47Å; N230-K234 PolarHBondContact O-N 3.31Å; I231-K234 PolarHBondContact O-N 3.2Å; H232-K234 PolarHBondContact O-N 3.41Å; K234-Q238 CarbonylContact O-C 3.49Å; K234-Q238 WeakPolarHBondContact O-CB 3.46Å; K234-G239 PolarHBondContact O-N 2.91Å; K234-I240 HydrophobicContact CB-CB 4.45Å; K234-I240 HydrophobicContact CB-CD1 4.01Å; K234-I240 HydrophobicContact CD-CD1 4.48Å; K234-I240 HydrophobicContact CG-CD1 4Å; K234-I240 WeakPolarHBondContact O-CB 3.21Å; K234-I240 PolarHBondContact O-N 3.49Å
235	V	93	Very high	91.6	Very high	18 Å²	18	62.6 Å²	62.6	11%	0.109	32%	0.318	C	S	.	.	I	π-helix	trans	-79	-44.4	-172.9	173	0	0	0	0	111.8	I231 H232 V233 R241 A252	I231-V235 HydrophobicContact CG2-CG2 4.31Å; I231-V235 WeakPolarHBondContact O-CB 3.21Å; I231-V235 VanDerWaalsContact O-CG2 3.29Å; I231-V235 WeakPolarHBondContact O-CG2 3.29Å; I231-V235 PolarHBondContact O-N 3.16Å; H232-V235 PolarHBondContact O-N 2.86Å; V233-V235 PolarHBondContact O-N 3.5Å; V235-R241 VanDerWaalsContact CG1-NH1 3.28Å; V235-R241 PolarHBondContact O-NH1 2.81Å; V235-R241 PolarHBondContact O-NH2 3.17Å; V235-A252 HydrophobicContact CG1-CB 3.65Å; V235-A252 HydrophobicContact CG2-CB 4.24Å; V235-A252 WeakPolarHBondContact CG2-O 3.01Å
236	I	93.7	Very high	91.8	Very high	94 Å²	94	66.1 Å²	66.1	48%	0.482	34%	0.339	S	S	.	.	I	π-helix	trans	-91.5	-44	-170.9	-58.4	-57.9	0	0	0	111.4	H232	H232-I236 WeakPolarHBondContact ND1-CG1 3.26Å; H232-I236 VanDerWaalsContact O-CB 3.3Å; H232-I236 WeakPolarHBondContact O-CB 3.18Å; H232-I236 PolarHBondContact O-N 3.21Å
237	H	92.1	Very high	92.2	Very high	53 Å²	53	62.1 Å²	62.1	25%	0.245	33%	0.327	C	S	.	.	I	π-helix	trans	-94	-38.1	-171.4	-69.2	-66.9	0	0	0	113	C216 Q218 C219 H232 V233	C216-H237 PolarHBondContact SG-NE2 2.82Å; C216-H237 VanDerWaalsContact SG-NE2 3.38Å; Q218-H237 WeakPolarHBondContact CB-CE1 3.26Å; Q218-H237 VanDerWaalsContact CB-ND1 3.34Å; Q218-H237 WeakPolarHBondContact CB-ND1 3.11Å; Q218-H237 PolarHBondContact O-CE1 3.4Å; Q218-H237 VanDerWaalsContact OE1-CB 3.23Å; Q218-H237 VanDerWaalsContact OE1-CG 3.27Å; Q218-H237 PolarHBondContact OE1-ND1 3.48Å; Q218-H237 VanDerWaalsContact OE1-ND1 3.08Å; C219-H237 PolarHBondContact SG-NE2 2.82Å; C219-H237 VanDerWaalsContact SG-NE2 3.43Å; H232-H237 AromaticContact CE1-CD2 4Å; H232-H237 AromaticContact CE1-NE2 3.66Å; H232-H237 AromaticContact NE2-CD2 3.51Å; H232-H237 AromaticContact NE2-NE2 3.2Å; H232-H237 PolarHBondContact NE2-NE2 3.09Å; V233-H237 HydrophobicContact CG1-CB 4.39Å; V233-H237 WeakPolarHBondContact O-CA 3.35Å; V233-H237 WeakPolarHBondContact O-CB 3.38Å; V233-H237 PolarHBondContact O-N 2.87Å
238	Q	92.7	Very high	92.6	Very high	108 Å²	108	65.9 Å²	65.9	51%	0.505	35%	0.345	S	S	.	.	S	Bend	trans	-91.9	-5.5	177.3	-60.4	176.8	-20	0	0	112.9	V233 K234 I240	V233-Q238 HydrophobicContact CG1-CG 4.44Å; V233-Q238 PolarHBondContact O-N 3.01Å; K234-Q238 CarbonylContact O-C 3.49Å; K234-Q238 WeakPolarHBondContact O-CB 3.46Å; Q238-I240 HydrophobicContact CB-CD1 4.04Å; Q238-I240 HydrophobicContact CB-CG1 3.91Å; Q238-I240 PolarHBondContact O-N 3.05Å; Q238-I240 VanDerWaalsContact O-N 3.14Å; Q238-I240 VanDerWaalsContact OE1-CD1 3.26Å
239	G	90.4	Very high	92.8	Very high	44 Å²	44	70.1 Å²	70.1	45%	0.454	36%	0.362	S	S	.	.			trans	63.6	18.3	179.9	0	0	0	0	0	114.6	K234 R241	K234-G239 PolarHBondContact O-N 2.91Å; G239-R241 WeakPolarHBondContact O-CG 3.38Å; G239-R241 PolarHBondContact O-N 2.82Å
240	I	90.5	Very high	92.9	Very high	74 Å²	74	75 Å²	75	38%	0.379	38%	0.384	S	S	.	.			trans	-66.1	127.7	-177.9	-61.1	173.9	0	0	0	109.3	K234 Q238	K234-I240 HydrophobicContact CB-CB 4.45Å; K234-I240 HydrophobicContact CB-CD1 4.01Å; K234-I240 HydrophobicContact CD-CD1 4.48Å; K234-I240 HydrophobicContact CG-CD1 4Å; K234-I240 WeakPolarHBondContact O-CB 3.21Å; K234-I240 PolarHBondContact O-N 3.49Å; Q238-I240 HydrophobicContact CB-CD1 4.04Å; Q238-I240 HydrophobicContact CB-CG1 3.91Å; Q238-I240 PolarHBondContact O-N 3.05Å; Q238-I240 VanDerWaalsContact O-N 3.14Å; Q238-I240 VanDerWaalsContact OE1-CD1 3.26Å
241	R	91	Very high	93	Very high	93 Å²	93	73 Å²	73	35%	0.351	37%	0.371	S	S	.	.			trans	-133.8	148.5	-178.9	-64.3	-75.3	177.6	-86.8	-2.7	110	V235 G239 Q250 F251	V235-R241 VanDerWaalsContact CG1-NH1 3.28Å; V235-R241 PolarHBondContact O-NH1 2.81Å; V235-R241 PolarHBondContact O-NH2 3.17Å; G239-R241 WeakPolarHBondContact O-CG 3.38Å; G239-R241 PolarHBondContact O-N 2.82Å; R241-Q250 HydrophobicContact CB-CB 4.21Å; R241-Q250 HydrophobicContact CG-CB 4.37Å; R241-F251 CarbonylContact C-O 3.59Å; R241-F251 WeakPolarHBondContact CA-O 3.11Å
242	F	91.8	Very high	93	Very high	80 Å²	80	71.9 Å²	71.9	35%	0.351	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	122.6	168.1	-63	-86	0	0	0	108.3	Q250 F251 K254 L257	F242-Q250 CarbonylContact O-C 3.59Å; F242-F251 HydrophobicContact CB-CB 4.47Å; F242-F251 PolarHBondContact N-O 2.85Å; F242-F251 PolarHBondContact O-N 3.2Å; F242-K254 HydrophobicContact CD1-CB 3.92Å; F242-K254 HydrophobicContact CD1-CG 4.28Å; F242-K254 HydrophobicContact CD2-CB 4.44Å; F242-K254 VanDerWaalsContact CD2-N 3.26Å; F242-K254 HydrophobicContact CE1-CB 3.74Å; F242-K254 HydrophobicContact CE1-CG 4.28Å; F242-K254 HydrophobicContact CE2-CB 4.28Å; F242-K254 HydrophobicContact CG-CB 4.26Å; F242-K254 HydrophobicContact CZ-CB 3.92Å; F242-L257 HydrophobicContact CB-CB 4.05Å; F242-L257 HydrophobicContact CB-CD2 3.82Å
243	I	94.2	Very high	92.9	Very high	92 Å²	92	75.8 Å²	75.8	47%	0.472	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	132.8	-172.8	-52.7	177.9	0	0	0	109.1	N245 Q250	I243-N245 PolarHBondContact O-N 3.43Å; I243-Q250 HydrophobicContact CG1-CG 4.34Å
244	C	96.1	Very high	92.7	Very high	0 Å²	0	81.3 Å²	81.3	0%	0	41%	0.41	C	S	.	.			trans	-74.3	117.8	167.5	-175.6	0	0	0	0	109.5	V246 N248 K249 F251 L257 H265	C244-V246 PolarHBondContact O-N 2.86Å; C244-N248 WeakPolarHBondContact O-CA 3.4Å; C244-N248 PolarHBondContact O-N 3.03Å; C244-K249 PolarHBondContact N-O 3.05Å; C244-F251 HydrophobicContact CB-CE2 4.33Å; C244-L257 HydrophobicContact CB-CD1 3.6Å; C244-H265 VanDerWaalsContact SG-CD2 3.52Å; C244-H265 PolarHBondContact SG-NE2 3.49Å
245	N	94.6	Very high	92.6	Very high	133 Å²	133	78.2 Å²	78.2	71%	0.711	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-12.6	178.6	58.4	-18.5	0	0	0	114.3	I243	I243-N245 PolarHBondContact O-N 3.43Å
246	V	94.6	Very high	92.6	Very high	89 Å²	89	80 Å²	80	54%	0.539	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-42.4	180	-176.6	0	0	0	0	112.2	C244 H265	C244-V246 PolarHBondContact O-N 2.86Å; V246-H265 VanDerWaalsContact CG1-CE1 3.48Å; V246-H265 WeakPolarHBondContact CG1-CE1 3.42Å; V246-H265 WeakPolarHBondContact CG1-ND1 3.23Å
247	C	95.8	Very high	92.7	Very high	52 Å²	52	76.8 Å²	76.8	35%	0.351	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.2	8.2	-177.6	69.5	0	0	0	0	114.9	K249 H260 H265	C247-K249 PolarHBondContact O-N 2.9Å; C247-H260 PolarHBondContact SG-NE2 3.29Å; C247-H265 PolarHBondContact SG-NE2 2.88Å; C247-H265 VanDerWaalsContact SG-NE2 3.43Å
248	N	94.3	Very high	92.8	Very high	119 Å²	119	77.8 Å²	77.8	64%	0.636	41%	0.41	S	S	*	.			trans	56.8	11.5	-179.9	-65.5	-37.2	0	0	0	115.8	C244	C244-N248 WeakPolarHBondContact O-CA 3.4Å; C244-N248 PolarHBondContact O-N 3.03Å
249	K	94.4	Very high	92.8	Very high	126 Å²	126	77.9 Å²	77.9	55%	0.548	41%	0.406	S	S	.	.			trans	-64.5	138.4	172.4	-80.2	179.2	-176.4	-89.9	0	110.9	C244 C247 F251	C244-K249 PolarHBondContact N-O 3.05Å; C247-K249 PolarHBondContact O-N 2.9Å; K249-F251 HydrophobicContact CB-CE2 3.8Å; K249-F251 HydrophobicContact CB-CZ 3.94Å; K249-F251 WeakPolarHBondContact O-CE2 3.18Å
250	Q	94.1	Very high	93.1	Very high	125 Å²	125	76.7 Å²	76.7	58%	0.584	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.8	141.8	-176.1	-56.6	-175.6	10.3	0	0	111.7	R241 F242 I243	R241-Q250 HydrophobicContact CB-CB 4.21Å; R241-Q250 HydrophobicContact CG-CB 4.37Å; F242-Q250 CarbonylContact O-C 3.59Å; I243-Q250 HydrophobicContact CG1-CG 4.34Å
251	F	92.4	Very high	93.3	Very high	40 Å²	40	75.7 Å²	75.7	18%	0.175	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	145	-178	-59.5	-86.4	0	0	0	111	R241 F242 C244 K249 F253 N256 L257 H260	R241-F251 CarbonylContact C-O 3.59Å; R241-F251 WeakPolarHBondContact CA-O 3.11Å; F242-F251 HydrophobicContact CB-CB 4.47Å; F242-F251 PolarHBondContact N-O 2.85Å; F242-F251 PolarHBondContact O-N 3.2Å; C244-F251 HydrophobicContact CB-CE2 4.33Å; K249-F251 HydrophobicContact CB-CE2 3.8Å; K249-F251 HydrophobicContact CB-CZ 3.94Å; K249-F251 WeakPolarHBondContact O-CE2 3.18Å; F251-F253 VanDerWaalsContact C-N 3.3Å; F251-F253 PolarHBondContact O-N 3.1Å; F251-N256 HydrophobicContact CB-CB 4.22Å; F251-N256 HydrophobicContact CD1-CB 3.96Å; F251-N256 HydrophobicContact CG-CB 4.38Å; F251-L257 HydrophobicContact CB-CB 4.29Å; F251-L257 HydrophobicContact CD2-CB 3.91Å; F251-L257 HydrophobicContact CD2-CD1 3.78Å; F251-L257 HydrophobicContact CD2-CG 4.46Å; F251-L257 HydrophobicContact CE2-CD1 3.94Å; F251-L257 HydrophobicContact CG-CB 4.23Å; F251-H260 HydrophobicContact CE1-CB 3.76Å; F251-H260 HydrophobicContact CE2-CB 3.94Å; F251-H260 AromaticContact CE2-CD2 3.46Å; F251-H260 VanDerWaalsContact CE2-CD2 3.46Å; F251-H260 WeakPolarHBondContact CE2-CD2 3.39Å; F251-H260 AromaticContact CE2-CG 3.66Å; F251-H260 HydrophobicContact CZ-CB 3.37Å; F251-H260 AromaticContact CZ-CD2 3.47Å; F251-H260 VanDerWaalsContact CZ-CD2 3.47Å; F251-H260 WeakPolarHBondContact CZ-CD2 3.29Å; F251-H260 AromaticContact CZ-CG 3.16Å; F251-H260 AromaticContact CZ-ND1 3.62Å
252	A	89.9	Confident	93.5	Very high	29 Å²	29	76 Å²	76	24%	0.24	39%	0.386	C	S	.	.	S	Bend	trans	-71.8	-24.8	175.2	0	0	0	0	0	113.3	V235	V235-A252 HydrophobicContact CG1-CB 3.65Å; V235-A252 HydrophobicContact CG2-CB 4.24Å; V235-A252 WeakPolarHBondContact CG2-O 3.01Å
253	F	89.7	Confident	93.6	Very high	97 Å²	97	73.2 Å²	73.2	43%	0.425	38%	0.375	S	S	.	.	S	Bend	trans	-132.6	140.7	-172.6	-62.1	-82.7	0	0	0	111.4	I231 F251 G255 N256 L257	I231-F253 HydrophobicContact CD1-CE1 4.45Å; I231-F253 HydrophobicContact CG2-CD1 4.41Å; I231-F253 HydrophobicContact CG2-CE1 3.37Å; I231-F253 HydrophobicContact CG2-CZ 3.79Å; F251-F253 VanDerWaalsContact C-N 3.3Å; F251-F253 PolarHBondContact O-N 3.1Å; F253-G255 VanDerWaalsContact C-N 3.33Å; F253-G255 PolarHBondContact O-N 2.84Å; F253-N256 HydrophobicContact CB-CB 4.38Å; F253-N256 WeakPolarHBondContact O-CB 3.04Å; F253-N256 PolarHBondContact O-N 3.33Å; F253-L257 PolarHBondContact O-N 2.85Å
254	K	89.7	Confident	93.7	Very high	128 Å²	128	74.1 Å²	74.1	56%	0.557	38%	0.379	S	S	*	.	H	α-helix	trans	-56.7	-44.5	176.2	-171.1	175.9	178.9	177	0	112.3	F242 N256 L257 D258	F242-K254 HydrophobicContact CD1-CB 3.92Å; F242-K254 HydrophobicContact CD1-CG 4.28Å; F242-K254 HydrophobicContact CD2-CB 4.44Å; F242-K254 VanDerWaalsContact CD2-N 3.26Å; F242-K254 HydrophobicContact CE1-CB 3.74Å; F242-K254 HydrophobicContact CE1-CG 4.28Å; F242-K254 HydrophobicContact CE2-CB 4.28Å; F242-K254 HydrophobicContact CG-CB 4.26Å; F242-K254 HydrophobicContact CZ-CB 3.92Å; K254-N256 PolarHBondContact O-N 2.92Å; K254-N256 VanDerWaalsContact O-N 3.17Å; K254-L257 WeakPolarHBondContact O-CA 3.48Å; K254-L257 WeakPolarHBondContact O-CB 3.46Å; K254-L257 PolarHBondContact O-N 2.8Å; K254-D258 PolarHBondContact O-N 3.47Å
255	G	90.6	Very high	93.6	Very high	49 Å²	49	77 Å²	77	51%	0.505	39%	0.393	S	S	.	.	H	α-helix	trans	-60.5	-28.7	177.9	0	0	0	0	0	113.8	F253 R259	F253-G255 VanDerWaalsContact C-N 3.33Å; F253-G255 PolarHBondContact O-N 2.84Å; G255-R259 VanDerWaalsContact O-CB 3.3Å; G255-R259 WeakPolarHBondContact O-CB 3.49Å; G255-R259 PolarHBondContact O-N 3.39Å
256	N	93.1	Very high	93.6	Very high	56 Å²	56	75.6 Å²	75.6	30%	0.299	38%	0.382	S	S	.	.	H	α-helix	trans	-74.4	-38.9	173.9	-72.9	-10.9	0	0	0	111.8	F251 F253 K254 R259 H260	F251-N256 HydrophobicContact CB-CB 4.22Å; F251-N256 HydrophobicContact CD1-CB 3.96Å; F251-N256 HydrophobicContact CG-CB 4.38Å; F253-N256 HydrophobicContact CB-CB 4.38Å; F253-N256 WeakPolarHBondContact O-CB 3.04Å; F253-N256 PolarHBondContact O-N 3.33Å; K254-N256 PolarHBondContact O-N 2.92Å; K254-N256 VanDerWaalsContact O-N 3.17Å; N256-R259 PolarHBondContact OD1-NH2 3.09Å; N256-R259 VanDerWaalsContact OD1-NH2 3.12Å; N256-H260 VanDerWaalsContact O-CB 3.26Å; N256-H260 WeakPolarHBondContact O-CB 3.42Å; N256-H260 PolarHBondContact O-N 2.92Å
257	L	94.5	Very high	93.5	Very high	26 Å²	26	73.8 Å²	73.8	14%	0.136	38%	0.382	C	S	.	.	H	α-helix	trans	-61.8	-49.2	172.1	170.8	62.5	0	0	0	110.7	F242 C244 F251 F253 K254 R259 H260 H261	F242-L257 HydrophobicContact CB-CB 4.05Å; F242-L257 HydrophobicContact CB-CD2 3.82Å; C244-L257 HydrophobicContact CB-CD1 3.6Å; F251-L257 HydrophobicContact CB-CB 4.29Å; F251-L257 HydrophobicContact CD2-CB 3.91Å; F251-L257 HydrophobicContact CD2-CD1 3.78Å; F251-L257 HydrophobicContact CD2-CG 4.46Å; F251-L257 HydrophobicContact CE2-CD1 3.94Å; F251-L257 HydrophobicContact CG-CB 4.23Å; F253-L257 PolarHBondContact O-N 2.85Å; K254-L257 WeakPolarHBondContact O-CA 3.48Å; K254-L257 WeakPolarHBondContact O-CB 3.46Å; K254-L257 PolarHBondContact O-N 2.8Å; L257-R259 VanDerWaalsContact C-N 3.31Å; L257-R259 PolarHBondContact O-N 3.26Å; L257-H260 WeakPolarHBondContact O-CB 3.44Å; L257-H260 PolarHBondContact O-N 3.27Å; L257-H260 VanDerWaalsContact O-N 3.09Å; L257-H261 WeakPolarHBondContact O-CB 3.36Å; L257-H261 PolarHBondContact O-N 3.07Å
258	D	93.8	Very high	93.4	Very high	74 Å²	74	75.3 Å²	75.3	40%	0.396	39%	0.385	S	S	.	.	H	α-helix	trans	-59.5	-44	-180	-64.1	-18.6	0	0	0	110.9	K254 H261 K262	K254-D258 PolarHBondContact O-N 3.47Å; D258-H261 PolarHBondContact O-N 3.4Å; D258-K262 WeakPolarHBondContact O-CB 3.47Å; D258-K262 WeakPolarHBondContact O-CG 3.46Å; D258-K262 PolarHBondContact O-N 3.31Å
259	R	94.1	Very high	93.3	Very high	110 Å²	110	75.7 Å²	75.7	42%	0.415	38%	0.378	S	S	.	.	H	α-helix	trans	-63.1	-43.5	174.6	177.7	176.6	61.7	-170.5	-0.7	111.9	G255 N256 L257 H261 N263	G255-R259 VanDerWaalsContact O-CB 3.3Å; G255-R259 WeakPolarHBondContact O-CB 3.49Å; G255-R259 PolarHBondContact O-N 3.39Å; N256-R259 PolarHBondContact OD1-NH2 3.09Å; N256-R259 VanDerWaalsContact OD1-NH2 3.12Å; L257-R259 VanDerWaalsContact C-N 3.31Å; L257-R259 PolarHBondContact O-N 3.26Å; R259-H261 VanDerWaalsContact C-N 3.34Å; R259-N263 WeakPolarHBondContact CG-ND2 3.32Å; R259-N263 WeakPolarHBondContact O-CB 3.5Å; R259-N263 PolarHBondContact O-N 3.38Å; R259-N263 PolarHBondContact O-ND2 3.44Å
260	H	95.1	Very high	93.4	Very high	19 Å²	19	74.3 Å²	74.3	9%	0.088	37%	0.37	C	S	.	.	H	α-helix	trans	-60	-46.9	177	161.3	73.1	0	0	0	111	C247 F251 N256 L257 N263 I264 H265	C247-H260 PolarHBondContact SG-NE2 3.29Å; F251-H260 HydrophobicContact CE1-CB 3.76Å; F251-H260 HydrophobicContact CE2-CB 3.94Å; F251-H260 AromaticContact CE2-CD2 3.46Å; F251-H260 VanDerWaalsContact CE2-CD2 3.46Å; F251-H260 WeakPolarHBondContact CE2-CD2 3.39Å; F251-H260 AromaticContact CE2-CG 3.66Å; F251-H260 HydrophobicContact CZ-CB 3.37Å; F251-H260 AromaticContact CZ-CD2 3.47Å; F251-H260 VanDerWaalsContact CZ-CD2 3.47Å; F251-H260 WeakPolarHBondContact CZ-CD2 3.29Å; F251-H260 AromaticContact CZ-CG 3.16Å; F251-H260 AromaticContact CZ-ND1 3.62Å; N256-H260 VanDerWaalsContact O-CB 3.26Å; N256-H260 WeakPolarHBondContact O-CB 3.42Å; N256-H260 PolarHBondContact O-N 2.92Å; L257-H260 WeakPolarHBondContact O-CB 3.44Å; L257-H260 PolarHBondContact O-N 3.27Å; L257-H260 VanDerWaalsContact O-N 3.09Å; H260-N263 PolarHBondContact O-N 3.49Å; H260-I264 WeakPolarHBondContact ND1-CG1 3.45Å; H260-I264 WeakPolarHBondContact O-CB 3.26Å; H260-I264 WeakPolarHBondContact O-CG1 3.06Å; H260-I264 PolarHBondContact O-N 2.89Å; H260-H265 AromaticContact CE1-NE2 3.96Å; H260-H265 AromaticContact NE2-CD2 3.94Å; H260-H265 AromaticContact NE2-NE2 3.37Å; H260-H265 PolarHBondContact NE2-NE2 3.27Å
261	H	95.1	Very high	93.4	Very high	53 Å²	53	71.2 Å²	71.2	25%	0.245	37%	0.365	C	S	.	.	I	π-helix	trans	-60.1	-49.9	-179.7	-161.4	104.1	0	0	0	111.1	L257 D258 R259 N263 H265 E266	L257-H261 WeakPolarHBondContact O-CB 3.36Å; L257-H261 PolarHBondContact O-N 3.07Å; D258-H261 PolarHBondContact O-N 3.4Å; R259-H261 VanDerWaalsContact C-N 3.34Å; H261-N263 PolarHBondContact O-N 3.19Å; H261-H265 AromaticContact ND1-CD2 3.94Å; H261-H265 WeakPolarHBondContact O-CA 3.14Å; H261-H265 WeakPolarHBondContact O-CB 3.46Å; H261-H265 PolarHBondContact O-N 3.41Å; H261-E266 IonicContact CD2-OE1 3.36Å; H261-E266 PolarHBondContact CD2-OE1 3.27Å; H261-E266 IonicContact NE2-OE1 3.95Å; H261-E266 PolarHBondContact O-N 3.34Å; H261-E266 VanDerWaalsContact O-N 3.1Å
262	K	95.1	Very high	93.6	Very high	100 Å²	100	69.9 Å²	69.9	44%	0.435	36%	0.361	S	S	.	.	I	π-helix	trans	-56.5	-47	176	-74.2	178.9	178.2	-176.7	0	112.8	D258 E266 G267 I268	D258-K262 WeakPolarHBondContact O-CB 3.47Å; D258-K262 WeakPolarHBondContact O-CG 3.46Å; D258-K262 PolarHBondContact O-N 3.31Å; K262-E266 CarbonylContact O-C 3.49Å; K262-E266 WeakPolarHBondContact O-CB 3.24Å; K262-G267 PolarHBondContact O-N 2.85Å; K262-I268 HydrophobicContact CB-CB 4.32Å; K262-I268 HydrophobicContact CG-CD1 4.49Å; K262-I268 PolarHBondContact O-N 2.88Å
263	N	95.3	Very high	93.8	Very high	21 Å²	21	75.1 Å²	75.1	11%	0.112	39%	0.385	C	S	.	.	I	π-helix	trans	-76.6	-36.9	-173.3	-69.2	-18.4	0	0	0	113.5	R259 H260 H261 I268 T280	R259-N263 WeakPolarHBondContact CG-ND2 3.32Å; R259-N263 WeakPolarHBondContact O-CB 3.5Å; R259-N263 PolarHBondContact O-N 3.38Å; R259-N263 PolarHBondContact O-ND2 3.44Å; H260-N263 PolarHBondContact O-N 3.49Å; H261-N263 PolarHBondContact O-N 3.19Å; N263-I268 PolarHBondContact OD1-O 3.07Å; N263-T280 HydrophobicContact CB-CG2 4.47Å; N263-T280 VanDerWaalsContact ND2-CB 3.26Å; N263-T280 WeakPolarHBondContact ND2-CB 3.26Å; N263-T280 PolarHBondContact ND2-O 3.37Å; N263-T280 PolarHBondContact OD1-O 3.18Å
264	I	95.3	Very high	94	Very high	110 Å²	110	77.4 Å²	77.4	56%	0.564	39%	0.391	S	S	*	.	I	π-helix	trans	-100.5	-37.7	-170.1	-57.2	-57.7	0	0	0	112.1	H260	H260-I264 WeakPolarHBondContact ND1-CG1 3.45Å; H260-I264 WeakPolarHBondContact O-CB 3.26Å; H260-I264 WeakPolarHBondContact O-CG1 3.06Å; H260-I264 PolarHBondContact O-N 2.89Å
265	H	94.6	Very high	94.3	Very high	62 Å²	62	73.2 Å²	73.2	29%	0.287	38%	0.377	S	S	.	.	I	π-helix	trans	-99.8	-37.4	-175.3	-61	-51.2	0	0	0	112.4	C244 V246 C247 H260 H261	C244-H265 VanDerWaalsContact SG-CD2 3.52Å; C244-H265 PolarHBondContact SG-NE2 3.49Å; V246-H265 VanDerWaalsContact CG1-CE1 3.48Å; V246-H265 WeakPolarHBondContact CG1-CE1 3.42Å; V246-H265 WeakPolarHBondContact CG1-ND1 3.23Å; C247-H265 PolarHBondContact SG-NE2 2.88Å; C247-H265 VanDerWaalsContact SG-NE2 3.43Å; H260-H265 AromaticContact CE1-NE2 3.96Å; H260-H265 AromaticContact NE2-CD2 3.94Å; H260-H265 AromaticContact NE2-NE2 3.37Å; H260-H265 PolarHBondContact NE2-NE2 3.27Å; H261-H265 AromaticContact ND1-CD2 3.94Å; H261-H265 WeakPolarHBondContact O-CA 3.14Å; H261-H265 WeakPolarHBondContact O-CB 3.46Å; H261-H265 PolarHBondContact O-N 3.41Å
266	E	94.9	Very high	94.5	Very high	102 Å²	102	78.7 Å²	78.7	48%	0.477	40%	0.395	S	S	.	.	S	Bend	trans	-94	-11.6	176.9	-57.6	171.2	-169.7	0	0	112.8	H261 K262 I268	H261-E266 IonicContact CD2-OE1 3.36Å; H261-E266 PolarHBondContact CD2-OE1 3.27Å; H261-E266 IonicContact NE2-OE1 3.95Å; H261-E266 PolarHBondContact O-N 3.34Å; H261-E266 VanDerWaalsContact O-N 3.1Å; K262-E266 CarbonylContact O-C 3.49Å; K262-E266 WeakPolarHBondContact O-CB 3.24Å; E266-I268 HydrophobicContact CB-CD1 4.05Å; E266-I268 HydrophobicContact CB-CG1 3.83Å; E266-I268 PolarHBondContact O-N 3.42Å; E266-I268 WeakPolarHBondContact OE2-CD1 3.39Å
267	G	92.2	Very high	94.5	Very high	52 Å²	52	83.6 Å²	83.6	54%	0.536	41%	0.409	S	S	.	.			trans	65.7	15	-178.1	0	0	0	0	0	114.7	K262 R269	K262-G267 PolarHBondContact O-N 2.85Å; G267-R269 PolarHBondContact O-N 3.49Å
268	I	93.1	Very high	94.6	Very high	83 Å²	83	88.9 Å²	88.9	43%	0.426	43%	0.431	S	S	.	.			trans	-71.5	120.1	-179.4	-60.3	-178.3	0	0	0	109.1	K262 N263 E266	K262-I268 HydrophobicContact CB-CB 4.32Å; K262-I268 HydrophobicContact CG-CD1 4.49Å; K262-I268 PolarHBondContact O-N 2.88Å; N263-I268 PolarHBondContact OD1-O 3.07Å; E266-I268 HydrophobicContact CB-CD1 4.05Å; E266-I268 HydrophobicContact CB-CG1 3.83Å; E266-I268 PolarHBondContact O-N 3.42Å; E266-I268 WeakPolarHBondContact OE2-CD1 3.39Å
269	R	93.4	Very high	94.6	Very high	128 Å²	128	87 Å²	87	48%	0.483	42%	0.419	S	S	.	.			trans	-134.3	152.4	176.7	-54.5	-166.1	81.3	153.1	1.9	110.9	G267 A271 K278 F279	G267-R269 PolarHBondContact O-N 3.49Å; R269-A271 PolarHBondContact O-N 2.9Å; R269-K278 HydrophobicContact CB-CB 3.99Å; R269-F279 WeakPolarHBondContact CA-O 3.47Å; R269-F279 WeakPolarHBondContact CB-O 3.38Å
270	Y	95.2	Very high	94.6	Very high	97 Å²	97	84.3 Å²	84.3	38%	0.38	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	106	175.9	-62.6	-85.5	0	0	0	109.1	K278 F279 K282	Y270-K278 CarbonylContact O-C 3.49Å; Y270-K278 WeakPolarHBondContact O-CA 3.35Å; Y270-F279 PolarHBondContact N-O 3.36Å; Y270-F279 PolarHBondContact O-N 3.19Å; Y270-K282 HydrophobicContact CD1-CB 4.05Å; Y270-K282 HydrophobicContact CD1-CG 4.39Å; Y270-K282 HydrophobicContact CE1-CB 3.87Å; Y270-K282 HydrophobicContact CE1-CG 4.37Å; Y270-K282 HydrophobicContact CE2-CB 4.47Å; Y270-K282 HydrophobicContact CG-CB 4.44Å
271	A	95.5	Very high	94.5	Very high	59 Å²	59	84.4 Å²	84.4	49%	0.488	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	141.7	179.2	0	0	0	0	0	111.5	R269 K278	R269-A271 PolarHBondContact O-N 2.9Å; A271-K278 HydrophobicContact CB-CG 4.22Å
272	C	96.1	Very high	94.4	Very high	12 Å²	12	86.5 Å²	86.5	8%	0.081	43%	0.425	C	S	.	.			trans	-72.9	140.5	164.1	-170.8	0	0	0	0	109.5	R274 R277 L285 H288 H293	C272-R274 PolarHBondContact SG-N 3.4Å; C272-R274 VanDerWaalsContact SG-N 3.41Å; C272-R277 PolarHBondContact N-O 2.87Å; C272-L285 HydrophobicContact CB-CD1 3.83Å; C272-H288 PolarHBondContact SG-NE2 2.87Å; C272-H293 VanDerWaalsContact SG-CD2 3.55Å; C272-H293 PolarHBondContact SG-NE2 3.18Å
273	N	94.3	Very high	94.2	Very high	140 Å²	140	89 Å²	89	75%	0.749	43%	0.433	S	S	*	.	S	Bend	trans	-89.9	-2.3	175.9	64.8	-21.2	0	0	0	113
274	R	93.4	Very high	94.1	Very high	145 Å²	145	91 Å²	91	55%	0.547	44%	0.443	S	S	.	.	S	Bend	trans	-114.8	-7.4	-179.9	-60.9	-178.5	-169.8	179.1	7.3	113.4	C272	C272-R274 PolarHBondContact SG-N 3.4Å; C272-R274 VanDerWaalsContact SG-N 3.41Å
275	C	95	Very high	94.1	Very high	39 Å²	39	86.8 Å²	86.8	26%	0.264	42%	0.422	S	S	.	.	S	Bend	trans	-158.8	171.2	172.5	70	0	0	0	0	111	R277 H288 H293	C275-R277 PolarHBondContact O-N 3.05Å; C275-R277 VanDerWaalsContact O-N 3.09Å; C275-H288 PolarHBondContact SG-NE2 2.85Å; C275-H293 PolarHBondContact SG-NE2 3.22Å
276	D	94.7	Very high	94	Very high	164 Å²	164	87.2 Å²	87.2	88%	0.877	43%	0.426	S	S	*	.	S	Bend	trans	-77.7	7.1	-174	-57.1	-44.3	0	0	0	114.9
277	R	94.7	Very high	93.9	Very high	159 Å²	159	83.9 Å²	83.9	60%	0.6	42%	0.419	S	S	*	.			trans	-75.2	138.2	-177.7	-69.3	-167.1	172.9	-163.9	0.1	112.1	C272 C275 F279	C272-R277 PolarHBondContact N-O 2.87Å; C275-R277 PolarHBondContact O-N 3.05Å; C275-R277 VanDerWaalsContact O-N 3.09Å; R277-F279 HydrophobicContact CB-CE2 3.75Å; R277-F279 HydrophobicContact CB-CZ 3.84Å
278	K	95.3	Very high	93.9	Very high	138 Å²	138	82 Å²	82	60%	0.6	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.4	139.8	177.9	-61.8	-179.1	-176.8	177.7	0	111.1	R269 Y270 A271	R269-K278 HydrophobicContact CB-CB 3.99Å; Y270-K278 CarbonylContact O-C 3.49Å; Y270-K278 WeakPolarHBondContact O-CA 3.35Å; A271-K278 HydrophobicContact CB-CG 4.22Å
279	F	95.1	Very high	94	Very high	35 Å²	35	79.5 Å²	79.5	15%	0.154	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	152.3	-171.8	-61.5	-87.3	0	0	0	112.3	R269 Y270 R277 D284 L285 H288	R269-F279 WeakPolarHBondContact CA-O 3.47Å; R269-F279 WeakPolarHBondContact CB-O 3.38Å; Y270-F279 PolarHBondContact N-O 3.36Å; Y270-F279 PolarHBondContact O-N 3.19Å; R277-F279 HydrophobicContact CB-CE2 3.75Å; R277-F279 HydrophobicContact CB-CZ 3.84Å; F279-D284 HydrophobicContact CB-CB 4.04Å; F279-D284 HydrophobicContact CD1-CB 3.74Å; F279-D284 HydrophobicContact CG-CB 4.2Å; F279-L285 HydrophobicContact CB-CB 4.21Å; F279-L285 HydrophobicContact CD2-CB 3.91Å; F279-L285 HydrophobicContact CD2-CD1 3.73Å; F279-L285 HydrophobicContact CD2-CG 4.44Å; F279-L285 HydrophobicContact CE2-CD1 3.94Å; F279-L285 HydrophobicContact CG-CB 4.18Å; F279-H288 HydrophobicContact CE1-CB 3.72Å; F279-H288 HydrophobicContact CE2-CB 3.88Å; F279-H288 AromaticContact CE2-CD2 3.42Å; F279-H288 VanDerWaalsContact CE2-CD2 3.42Å; F279-H288 WeakPolarHBondContact CE2-CD2 3.17Å; F279-H288 AromaticContact CE2-CG 3.63Å; F279-H288 HydrophobicContact CZ-CB 3.3Å; F279-H288 AromaticContact CZ-CD2 3.49Å; F279-H288 VanDerWaalsContact CZ-CD2 3.49Å; F279-H288 WeakPolarHBondContact CZ-CD2 3.35Å; F279-H288 AromaticContact CZ-CG 3.18Å; F279-H288 AromaticContact CZ-ND1 3.72Å
280	T	92.7	Very high	94	Very high	52 Å²	52	77.6 Å²	77.6	32%	0.319	38%	0.379	S	S	.	.	S	Bend	trans	-81.8	-17.6	178.4	41.7	0	0	0	0	113.9	N263 D284	N263-T280 HydrophobicContact CB-CG2 4.47Å; N263-T280 VanDerWaalsContact ND2-CB 3.26Å; N263-T280 WeakPolarHBondContact ND2-CB 3.26Å; N263-T280 PolarHBondContact ND2-O 3.37Å; N263-T280 PolarHBondContact OD1-O 3.18Å; T280-D284 PolarHBondContact OG1-OD2 3.1Å
281	T	92.9	Very high	93.8	Very high	22 Å²	22	74.4 Å²	74.4	14%	0.135	37%	0.369	C	S	.	.	S	Bend	trans	-137	154.6	175.8	77.7	0	0	0	0	110.9	Y283 D284 L285	T281-Y283 PolarHBondContact O-N 3.4Å; T281-Y283 PolarHBondContact OG1-N 2.81Å; T281-D284 WeakPolarHBondContact CB-OD2 3.37Å; T281-D284 PolarHBondContact N-OD2 3.27Å; T281-D284 PolarHBondContact O-N 3.47Å; T281-D284 PolarHBondContact OG1-N 3.48Å; T281-D284 VanDerWaalsContact OG1-N 3.08Å; T281-D284 PolarHBondContact OG1-OD1 2.87Å; T281-D284 PolarHBondContact OG1-OD2 2.7Å; T281-L285 PolarHBondContact O-N 3.08Å
282	K	93.5	Very high	93.6	Very high	97 Å²	97	76.3 Å²	76.3	42%	0.422	37%	0.37	S	S	.	.	H	α-helix	trans	-63.4	-33.2	173.1	-168.6	179.6	-178.1	-174.4	0	112.2	I3 Y270 L285 I286	I3-K282 HydrophobicContact CD1-CD 3.67Å; I3-K282 HydrophobicContact CD1-CG 3.82Å; Y270-K282 HydrophobicContact CD1-CB 4.05Å; Y270-K282 HydrophobicContact CD1-CG 4.39Å; Y270-K282 HydrophobicContact CE1-CB 3.87Å; Y270-K282 HydrophobicContact CE1-CG 4.37Å; Y270-K282 HydrophobicContact CE2-CB 4.47Å; Y270-K282 HydrophobicContact CG-CB 4.44Å; K282-L285 PolarHBondContact O-N 3.38Å; K282-I286 HydrophobicContact CG-CD1 4.11Å; K282-I286 PolarHBondContact O-N 2.74Å; K282-I286 VanDerWaalsContact O-N 3.07Å
283	Y	91.5	Very high	93.4	Very high	153 Å²	153	78.2 Å²	78.2	60%	0.6	38%	0.377	S	S	*	.	H	α-helix	trans	-62.8	-46.1	177.4	-179.3	-95.1	0	0	0	111.2	I5 T281 L285 I286 G287	I5-Y283 HydrophobicContact CD1-CD2 4.17Å; I5-Y283 HydrophobicContact CD1-CE2 4.04Å; T281-Y283 PolarHBondContact O-N 3.4Å; T281-Y283 PolarHBondContact OG1-N 2.81Å; Y283-L285 VanDerWaalsContact C-N 3.32Å; Y283-L285 PolarHBondContact O-N 2.82Å; Y283-I286 PolarHBondContact O-N 3.03Å; Y283-G287 PolarHBondContact O-N 3.22Å
284	D	92.5	Very high	93.4	Very high	61 Å²	61	77.2 Å²	77.2	33%	0.326	37%	0.368	S	S	.	.	H	α-helix	trans	-62.6	-40	178.2	-55.6	-36.8	0	0	0	111.6	F279 T280 T281 I286 G287 H288	F279-D284 HydrophobicContact CB-CB 4.04Å; F279-D284 HydrophobicContact CD1-CB 3.74Å; F279-D284 HydrophobicContact CG-CB 4.2Å; T280-D284 PolarHBondContact OG1-OD2 3.1Å; T281-D284 WeakPolarHBondContact CB-OD2 3.37Å; T281-D284 PolarHBondContact N-OD2 3.27Å; T281-D284 PolarHBondContact O-N 3.47Å; T281-D284 PolarHBondContact OG1-N 3.48Å; T281-D284 VanDerWaalsContact OG1-N 3.08Å; T281-D284 PolarHBondContact OG1-OD1 2.87Å; T281-D284 PolarHBondContact OG1-OD2 2.7Å; D284-I286 PolarHBondContact O-N 3.4Å; D284-G287 PolarHBondContact O-N 2.79Å; D284-H288 VanDerWaalsContact O-CB 3.29Å; D284-H288 WeakPolarHBondContact O-CB 3.02Å; D284-H288 PolarHBondContact O-N 3.36Å
285	L	95.3	Very high	93.1	Very high	23 Å²	23	72.6 Å²	72.6	12%	0.12	37%	0.366	C	S	.	.	H	α-helix	trans	-60.2	-45	174.9	171.1	62.2	0	0	0	111.6	C272 F279 T281 K282 Y283 H288 I289	C272-L285 HydrophobicContact CB-CD1 3.83Å; F279-L285 HydrophobicContact CB-CB 4.21Å; F279-L285 HydrophobicContact CD2-CB 3.91Å; F279-L285 HydrophobicContact CD2-CD1 3.73Å; F279-L285 HydrophobicContact CD2-CG 4.44Å; F279-L285 HydrophobicContact CE2-CD1 3.94Å; F279-L285 HydrophobicContact CG-CB 4.18Å; T281-L285 PolarHBondContact O-N 3.08Å; K282-L285 PolarHBondContact O-N 3.38Å; Y283-L285 VanDerWaalsContact C-N 3.32Å; Y283-L285 PolarHBondContact O-N 2.82Å; L285-H288 WeakPolarHBondContact O-CB 3.39Å; L285-H288 PolarHBondContact O-N 2.98Å; L285-I289 HydrophobicContact CD1-CD1 3.88Å; L285-I289 HydrophobicContact CD1-CG1 4.14Å; L285-I289 HydrophobicContact CG-CD1 3.97Å; L285-I289 WeakPolarHBondContact O-CG1 3.39Å; L285-I289 PolarHBondContact O-N 3.09Å
286	I	93	Very high	92.9	Very high	70 Å²	70	72.5 Å²	72.5	36%	0.359	36%	0.364	S	S	.	.	H	α-helix	trans	-70.8	-41.1	-179	-77	160.1	0	0	0	111.6	I3 K282 Y283 D284 H288 I289 K290	I3-I286 HydrophobicContact CD1-CD1 3.01Å; I3-I286 HydrophobicContact CD1-CG1 4.46Å; I3-I286 HydrophobicContact CG1-CD1 4.02Å; K282-I286 HydrophobicContact CG-CD1 4.11Å; K282-I286 PolarHBondContact O-N 2.74Å; K282-I286 VanDerWaalsContact O-N 3.07Å; Y283-I286 PolarHBondContact O-N 3.03Å; D284-I286 PolarHBondContact O-N 3.4Å; I286-H288 PolarHBondContact O-N 2.88Å; I286-I289 PolarHBondContact O-N 3.23Å; I286-K290 VanDerWaalsContact O-CB 3.26Å; I286-K290 WeakPolarHBondContact O-CB 3.33Å; I286-K290 PolarHBondContact O-N 3.49Å
287	G	91.9	Very high	92.6	Very high	32 Å²	32	68.9 Å²	68.9	33%	0.33	34%	0.342	S	S	.	.	H	α-helix	trans	-57	-42.4	171.4	0	0	0	0	0	111.2	Y283 D284 K290 V291	Y283-G287 PolarHBondContact O-N 3.22Å; D284-G287 PolarHBondContact O-N 2.79Å; G287-K290 PolarHBondContact O-N 3.25Å; G287-V291 VanDerWaalsContact O-CG2 3.26Å; G287-V291 WeakPolarHBondContact O-CG2 3.48Å; G287-V291 PolarHBondContact O-N 3.41Å; G287-V291 VanDerWaalsContact O-N 3.07Å
288	H	93.3	Very high	92.3	Very high	14 Å²	14	64.2 Å²	64.2	7%	0.065	33%	0.325	C	S	.	.	H	α-helix	trans	-61.4	-50.2	174.5	161.1	69.2	0	0	0	112.9	C272 C275 F279 D284 L285 I286 K290 V291 I292 H293	C272-H288 PolarHBondContact SG-NE2 2.87Å; C275-H288 PolarHBondContact SG-NE2 2.85Å; F279-H288 HydrophobicContact CE1-CB 3.72Å; F279-H288 HydrophobicContact CE2-CB 3.88Å; F279-H288 AromaticContact CE2-CD2 3.42Å; F279-H288 VanDerWaalsContact CE2-CD2 3.42Å; F279-H288 WeakPolarHBondContact CE2-CD2 3.17Å; F279-H288 AromaticContact CE2-CG 3.63Å; F279-H288 HydrophobicContact CZ-CB 3.3Å; F279-H288 AromaticContact CZ-CD2 3.49Å; F279-H288 VanDerWaalsContact CZ-CD2 3.49Å; F279-H288 WeakPolarHBondContact CZ-CD2 3.35Å; F279-H288 AromaticContact CZ-CG 3.18Å; F279-H288 AromaticContact CZ-ND1 3.72Å; D284-H288 VanDerWaalsContact O-CB 3.29Å; D284-H288 WeakPolarHBondContact O-CB 3.02Å; D284-H288 PolarHBondContact O-N 3.36Å; L285-H288 WeakPolarHBondContact O-CB 3.39Å; L285-H288 PolarHBondContact O-N 2.98Å; I286-H288 PolarHBondContact O-N 2.88Å; H288-K290 VanDerWaalsContact C-N 3.3Å; H288-K290 PolarHBondContact O-N 2.95Å; H288-V291 PolarHBondContact O-N 2.76Å; H288-I292 WeakPolarHBondContact ND1-CG1 3.32Å; H288-I292 VanDerWaalsContact O-CB 3.32Å; H288-I292 WeakPolarHBondContact O-CB 3.39Å; H288-I292 WeakPolarHBondContact O-CG1 3.33Å; H288-I292 PolarHBondContact O-N 3.32Å; H288-H293 AromaticContact CE1-NE2 3.73Å; H288-H293 AromaticContact NE2-CD2 3.64Å; H288-H293 AromaticContact NE2-NE2 3.26Å; H288-H293 PolarHBondContact NE2-NE2 3.37Å
289	I	94.2	Very high	92.1	Very high	30 Å²	30	64.7 Å²	64.7	15%	0.154	32%	0.323	C	S	.	.	I	π-helix	trans	-58.5	-47	179.1	-69.5	166.2	0	0	0	110.1	L285 I286 V291 H293 E294	L285-I289 HydrophobicContact CD1-CD1 3.88Å; L285-I289 HydrophobicContact CD1-CG1 4.14Å; L285-I289 HydrophobicContact CG-CD1 3.97Å; L285-I289 WeakPolarHBondContact O-CG1 3.39Å; L285-I289 PolarHBondContact O-N 3.09Å; I286-I289 PolarHBondContact O-N 3.23Å; I289-V291 VanDerWaalsContact C-N 3.33Å; I289-V291 PolarHBondContact O-N 3.3Å; I289-H293 HydrophobicContact CG2-CB 4.36Å; I289-H293 CarbonylContact O-C 3.49Å; I289-H293 WeakPolarHBondContact O-CA 3.34Å; I289-H293 WeakPolarHBondContact O-CB 3.48Å; I289-H293 PolarHBondContact O-N 3.1Å; I289-E294 HydrophobicContact CG2-CG 4.3Å; I289-E294 PolarHBondContact O-N 3.41Å
290	K	93.1	Very high	92.1	Very high	88 Å²	88	63.4 Å²	63.4	38%	0.383	32%	0.318	S	S	.	.	I	π-helix	trans	-58.2	-44.5	-178.6	-172.5	171.9	-169.5	-169.5	0	112.3	I286 G287 H288 E294 G295 T296	I286-K290 VanDerWaalsContact O-CB 3.26Å; I286-K290 WeakPolarHBondContact O-CB 3.33Å; I286-K290 PolarHBondContact O-N 3.49Å; G287-K290 PolarHBondContact O-N 3.25Å; H288-K290 VanDerWaalsContact C-N 3.3Å; H288-K290 PolarHBondContact O-N 2.95Å; K290-E294 WeakPolarHBondContact CA-OE2 3.36Å; K290-E294 WeakPolarHBondContact O-CB 3.47Å; K290-G295 PolarHBondContact O-N 3.49Å; K290-T296 HydrophobicContact CD-CG2 4.2Å; K290-T296 WeakPolarHBondContact CE-OG1 3.44Å; K290-T296 HydrophobicContact CG-CG2 3.98Å; K290-T296 WeakPolarHBondContact CG-OG1 3.33Å; K290-T296 WeakPolarHBondContact O-CB 3.45Å; K290-T296 PolarHBondContact O-N 3.43Å; K290-T296 PolarHBondContact O-OG1 3.34Å; K290-T296 VanDerWaalsContact O-OG1 3.05Å
291	V	91.6	Very high	92	Very high	29 Å²	29	68.6 Å²	68.6	18%	0.176	34%	0.344	C	S	.	.	I	π-helix	trans	-80.4	-47	-177.2	175.6	0	0	0	0	112.1	G287 H288 I289 T308	G287-V291 VanDerWaalsContact O-CG2 3.26Å; G287-V291 WeakPolarHBondContact O-CG2 3.48Å; G287-V291 PolarHBondContact O-N 3.41Å; G287-V291 VanDerWaalsContact O-N 3.07Å; H288-V291 PolarHBondContact O-N 2.76Å; I289-V291 VanDerWaalsContact C-N 3.33Å; I289-V291 PolarHBondContact O-N 3.3Å; V291-T308 HydrophobicContact CG1-CG2 3.71Å; V291-T308 WeakPolarHBondContact CG2-O 3.42Å
292	I	92.5	Very high	91.9	Very high	99 Å²	99	73.8 Å²	73.8	51%	0.508	37%	0.367	S	S	.	.	I	π-helix	trans	-90	-35.4	-168.2	-59	-60.5	0	0	0	112.4	H288	H288-I292 WeakPolarHBondContact ND1-CG1 3.32Å; H288-I292 VanDerWaalsContact O-CB 3.32Å; H288-I292 WeakPolarHBondContact O-CB 3.39Å; H288-I292 WeakPolarHBondContact O-CG1 3.33Å; H288-I292 PolarHBondContact O-N 3.32Å
293	H	91.9	Very high	91.9	Very high	52 Å²	52	71 Å²	71	24%	0.241	36%	0.359	C	S	.	.	I	π-helix	trans	-106.8	-25.8	-173	-63.8	-56.4	0	0	0	113.7	C272 C275 H288 I289	C272-H293 VanDerWaalsContact SG-CD2 3.55Å; C272-H293 PolarHBondContact SG-NE2 3.18Å; C275-H293 PolarHBondContact SG-NE2 3.22Å; H288-H293 AromaticContact CE1-NE2 3.73Å; H288-H293 AromaticContact NE2-CD2 3.64Å; H288-H293 AromaticContact NE2-NE2 3.26Å; H288-H293 PolarHBondContact NE2-NE2 3.37Å; I289-H293 HydrophobicContact CG2-CB 4.36Å; I289-H293 CarbonylContact O-C 3.49Å; I289-H293 WeakPolarHBondContact O-CA 3.34Å; I289-H293 WeakPolarHBondContact O-CB 3.48Å; I289-H293 PolarHBondContact O-N 3.1Å
294	E	92.8	Very high	91.7	Very high	119 Å²	119	71.9 Å²	71.9	56%	0.556	37%	0.374	S	S	*	.	S	Bend	trans	-101.6	-5.8	174.8	-60.3	172.3	172.5	0	0	112	I289 K290 T296	I289-E294 HydrophobicContact CG2-CG 4.3Å; I289-E294 PolarHBondContact O-N 3.41Å; K290-E294 WeakPolarHBondContact CA-OE2 3.36Å; K290-E294 WeakPolarHBondContact O-CB 3.47Å; E294-T296 VanDerWaalsContact C-N 3.27Å; E294-T296 PolarHBondContact O-N 3.27Å
295	G	88	Confident	91.6	Very high	49 Å²	49	76.7 Å²	76.7	51%	0.505	39%	0.388	S	S	.	.			trans	67.7	24.9	177	0	0	0	0	0	113.8	K290 E297	K290-G295 PolarHBondContact O-N 3.49Å; G295-E297 PolarHBondContact O-N 2.69Å
296	T	89.5	Confident	91.4	Very high	36 Å²	36	80.7 Å²	80.7	22%	0.221	40%	0.404	C	S	.	.			trans	-66.7	119.8	174.7	-59.6	0	0	0	0	109.6	K290 E294 Y298	K290-T296 HydrophobicContact CD-CG2 4.2Å; K290-T296 WeakPolarHBondContact CE-OG1 3.44Å; K290-T296 HydrophobicContact CG-CG2 3.98Å; K290-T296 WeakPolarHBondContact CG-OG1 3.33Å; K290-T296 WeakPolarHBondContact O-CB 3.45Å; K290-T296 PolarHBondContact O-N 3.43Å; K290-T296 PolarHBondContact O-OG1 3.34Å; K290-T296 VanDerWaalsContact O-OG1 3.05Å; E294-T296 VanDerWaalsContact C-N 3.27Å; E294-T296 PolarHBondContact O-N 3.27Å; T296-Y298 HydrophobicContact CG2-CE2 4.37Å
297	E	89.1	Confident	91.3	Very high	89 Å²	89	79.1 Å²	79.1	42%	0.416	40%	0.395	S	S	.	.			trans	-119.6	145.3	174.4	-61.2	175.2	154.8	0	0	109.7	G295 R299 K306	G295-E297 PolarHBondContact O-N 2.69Å; E297-R299 IonicContact OE2-CZ 3.27Å; E297-R299 IonicContact OE2-NE 3.93Å; E297-R299 IonicContact OE2-NH2 2.75Å; E297-R299 PolarHBondContact OE2-NH2 3.36Å; E297-K306 IonicContact OE1-NZ 3.64Å; E297-K306 PolarHBondContact OE1-NZ 3.15Å; E297-K306 VanDerWaalsContact OE2-CD 3.26Å; E297-K306 WeakPolarHBondContact OE2-CD 3.29Å; E297-K306 WeakPolarHBondContact OE2-CE 3.4Å; E297-K306 IonicContact OE2-NZ 2.7Å; E297-K306 PolarHBondContact OE2-NZ 3.29Å
298	Y	89.3	Confident	91.1	Very high	61 Å²	61	81.6 Å²	81.6	24%	0.239	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	112.5	170.9	-63.2	-84.9	0	0	0	108.4	T296 K306 F307 K310	T296-Y298 HydrophobicContact CG2-CE2 4.37Å; Y298-K306 CarbonylContact O-C 3.49Å; Y298-F307 PolarHBondContact N-O 3.03Å; Y298-F307 PolarHBondContact O-N 3.34Å; Y298-K310 HydrophobicContact CD1-CB 3.93Å; Y298-K310 HydrophobicContact CD1-CG 4.3Å; Y298-K310 HydrophobicContact CE1-CB 3.71Å; Y298-K310 HydrophobicContact CE1-CD 4.44Å; Y298-K310 HydrophobicContact CE1-CG 4.26Å; Y298-K310 HydrophobicContact CG-CB 4.46Å
299	R	91.3	Very high	90.9	Very high	147 Å²	147	82.6 Å²	82.6	56%	0.555	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	146.4	-177.7	-60.6	-170.5	176.4	-165.4	4.4	110.8	E297 K306 L313	E297-R299 IonicContact OE2-CZ 3.27Å; E297-R299 IonicContact OE2-NE 3.93Å; E297-R299 IonicContact OE2-NH2 2.75Å; E297-R299 PolarHBondContact OE2-NH2 3.36Å; R299-K306 HydrophobicContact CG-CG 4.33Å; R299-L313 VanDerWaalsContact O-CD2 3.28Å; R299-L313 WeakPolarHBondContact O-CD2 3.39Å
300	C	93.6	Very high	90.7	Very high	8 Å²	8	86 Å²	86	5%	0.054	43%	0.426	C	S	.	.			trans	-85.8	133.1	165.6	179.9	0	0	0	0	109	Q302 C303 R305 F307 L313 H316 L317 H321	C300-Q302 VanDerWaalsContact C-N 3.3Å; C300-Q302 PolarHBondContact SG-N 3.27Å; C300-C303 CarbonylContact C-O 3.58Å; C300-C303 WeakPolarHBondContact CB-O 3.5Å; C300-R305 PolarHBondContact N-O 3.31Å; C300-F307 HydrophobicContact CB-CE2 4.43Å; C300-L313 HydrophobicContact CB-CD1 3.78Å; C300-H316 PolarHBondContact SG-NE2 3.39Å; C300-H316 VanDerWaalsContact SG-NE2 3.42Å; C300-L317 VanDerWaalsContact SG-CD2 3.59Å; C300-H321 VanDerWaalsContact SG-CD2 3.59Å; C300-H321 PolarHBondContact SG-NE2 2.96Å
301	D	91.3	Very high	90.5	Very high	161 Å²	161	85 Å²	85	86%	0.861	43%	0.434	S	S	*	.	S	Bend	trans	-84	-13	-179.9	-52.1	-35.2	0	0	0	112.2
302	Q	90.4	Very high	90.5	Very high	131 Å²	131	87 Å²	87	61%	0.612	44%	0.444	S	S	*	.	S	Bend	trans	-100.3	-7.5	179.6	-60.2	-174.2	29.1	0	0	113	C300 H321	C300-Q302 VanDerWaalsContact C-N 3.3Å; C300-Q302 PolarHBondContact SG-N 3.27Å; Q302-H321 WeakPolarHBondContact CB-CE1 3.35Å; Q302-H321 WeakPolarHBondContact CB-ND1 3.4Å; Q302-H321 VanDerWaalsContact OE1-CB 3.23Å; Q302-H321 VanDerWaalsContact OE1-CG 3.23Å; Q302-H321 PolarHBondContact OE1-ND1 3.46Å
303	C	93	Very high	90.5	Very high	39 Å²	39	83.1 Å²	83.1	26%	0.264	42%	0.424	S	S	.	.	S	Bend	trans	-158.9	157.3	170.7	68.4	0	0	0	0	110.9	C300 R305 H316 H321	C300-C303 CarbonylContact C-O 3.58Å; C300-C303 WeakPolarHBondContact CB-O 3.5Å; C303-R305 PolarHBondContact O-N 3.2Å; C303-H316 VanDerWaalsContact SG-CE1 3.52Å; C303-H316 PolarHBondContact SG-NE2 2.84Å; C303-H321 PolarHBondContact SG-NE2 3.38Å; C303-H321 VanDerWaalsContact SG-NE2 3.37Å
304	N	88.6	Confident	90.5	Very high	172 Å²	172	84.2 Å²	84.2	92%	0.92	43%	0.432	S	S	*	.	S	Bend	trans	-73.3	24.3	-176.4	-72.7	-17.8	0	0	0	115.5
305	R	90.1	Very high	90.4	Very high	162 Å²	162	81.9 Å²	81.9	61%	0.611	42%	0.421	S	S	*	.			trans	-82.6	142	176.9	-73	-164.4	169.9	-161.5	-2.5	112	C300 C303 F307	C300-R305 PolarHBondContact N-O 3.31Å; C303-R305 PolarHBondContact O-N 3.2Å; R305-F307 HydrophobicContact CB-CE2 3.8Å; R305-F307 HydrophobicContact CB-CZ 3.92Å
306	K	91.5	Very high	90.6	Very high	106 Å²	106	80.1 Å²	80.1	46%	0.461	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	145.3	179.8	-57.9	174.7	166	-156.9	0	110.2	E297 Y298 R299	E297-K306 IonicContact OE1-NZ 3.64Å; E297-K306 PolarHBondContact OE1-NZ 3.15Å; E297-K306 VanDerWaalsContact OE2-CD 3.26Å; E297-K306 WeakPolarHBondContact OE2-CD 3.29Å; E297-K306 WeakPolarHBondContact OE2-CE 3.4Å; E297-K306 IonicContact OE2-NZ 2.7Å; E297-K306 PolarHBondContact OE2-NZ 3.29Å; Y298-K306 CarbonylContact O-C 3.49Å; R299-K306 HydrophobicContact CG-CG 4.33Å
307	F	90.1	Very high	90.7	Very high	37 Å²	37	80.6 Å²	80.6	16%	0.162	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	150	-177.4	-59.3	-87.7	0	0	0	111.2	Y298 C300 R305 N312 L313 H316	Y298-F307 PolarHBondContact N-O 3.03Å; Y298-F307 PolarHBondContact O-N 3.34Å; C300-F307 HydrophobicContact CB-CE2 4.43Å; R305-F307 HydrophobicContact CB-CE2 3.8Å; R305-F307 HydrophobicContact CB-CZ 3.92Å; F307-N312 HydrophobicContact CB-CB 4.25Å; F307-N312 HydrophobicContact CD1-CB 3.87Å; F307-N312 HydrophobicContact CG-CB 4.38Å; F307-L313 HydrophobicContact CB-CB 4.24Å; F307-L313 HydrophobicContact CD2-CB 3.93Å; F307-L313 HydrophobicContact CD2-CD1 3.71Å; F307-L313 HydrophobicContact CD2-CG 4.43Å; F307-L313 HydrophobicContact CE2-CD1 3.88Å; F307-L313 HydrophobicContact CG-CB 4.18Å; F307-H316 HydrophobicContact CE1-CB 3.72Å; F307-H316 HydrophobicContact CE2-CB 3.86Å; F307-H316 AromaticContact CE2-CD2 3.8Å; F307-H316 AromaticContact CE2-CG 3.67Å; F307-H316 HydrophobicContact CZ-CB 3.27Å; F307-H316 AromaticContact CZ-CD2 3.81Å; F307-H316 AromaticContact CZ-CG 3.2Å; F307-H316 AromaticContact CZ-ND1 3.53Å
308	T	88	Confident	90.8	Very high	85 Å²	85	82.1 Å²	82.1	52%	0.521	40%	0.402	S	S	.	.	S	Bend	trans	-85.5	-7.8	177.5	52.3	0	0	0	0	113.2	V291	V291-T308 HydrophobicContact CG1-CG2 3.71Å; V291-T308 WeakPolarHBondContact CG2-O 3.42Å
309	S	89.3	Confident	90.8	Very high	35 Å²	35	80.4 Å²	80.4	25%	0.245	40%	0.399	C	S	.	.	S	Bend	trans	-146.1	149.7	177	83.2	0	0	0	0	111.5	A311 N312 L313	S309-A311 PolarHBondContact O-N 3.28Å; S309-N312 PolarHBondContact O-N 3.08Å; S309-N312 WeakPolarHBondContact OG-CB 3.4Å; S309-N312 PolarHBondContact OG-N 2.88Å; S309-N312 VanDerWaalsContact OG-N 3.1Å; S309-N312 PolarHBondContact OG-OD1 2.95Å; S309-L313 PolarHBondContact O-N 3.2Å; S309-L313 VanDerWaalsContact O-N 3.14Å
310	K	89.4	Confident	90.7	Very high	102 Å²	102	77.6 Å²	77.6	44%	0.443	40%	0.398	S	S	.	.	H	α-helix	trans	-62.5	-32.8	174.6	-165.7	169.7	-174.9	172	0	111.9	Y298 L313 N314	Y298-K310 HydrophobicContact CD1-CB 3.93Å; Y298-K310 HydrophobicContact CD1-CG 4.3Å; Y298-K310 HydrophobicContact CE1-CB 3.71Å; Y298-K310 HydrophobicContact CE1-CD 4.44Å; Y298-K310 HydrophobicContact CE1-CG 4.26Å; Y298-K310 HydrophobicContact CG-CB 4.46Å; K310-L313 PolarHBondContact O-N 2.88Å; K310-N314 WeakPolarHBondContact O-CB 3.24Å; K310-N314 VanDerWaalsContact O-CG 3.28Å; K310-N314 PolarHBondContact O-N 3.25Å; K310-N314 PolarHBondContact O-ND2 3.38Å
311	A	88.9	Confident	90.6	Very high	66 Å²	66	79.7 Å²	79.7	55%	0.545	41%	0.407	S	S	.	.	H	α-helix	trans	-62.5	-45.2	176.8	0	0	0	0	0	111.5	S309 N314 E315	S309-A311 PolarHBondContact O-N 3.28Å; A311-N314 PolarHBondContact O-N 3.44Å; A311-E315 WeakPolarHBondContact O-CB 3.4Å; A311-E315 PolarHBondContact O-N 3.47Å
312	N	90.9	Very high	90.5	Very high	70 Å²	70	76.4 Å²	76.4	37%	0.374	39%	0.393	S	S	.	.	H	α-helix	trans	-67.6	-38.6	178.6	-65.8	5.4	0	0	0	111.5	F307 S309 E315 H316	F307-N312 HydrophobicContact CB-CB 4.25Å; F307-N312 HydrophobicContact CD1-CB 3.87Å; F307-N312 HydrophobicContact CG-CB 4.38Å; S309-N312 PolarHBondContact O-N 3.08Å; S309-N312 WeakPolarHBondContact OG-CB 3.4Å; S309-N312 PolarHBondContact OG-N 2.88Å; S309-N312 VanDerWaalsContact OG-N 3.1Å; S309-N312 PolarHBondContact OG-OD1 2.95Å; N312-E315 PolarHBondContact O-N 3.1Å; N312-H316 WeakPolarHBondContact O-CB 3.44Å; N312-H316 PolarHBondContact O-N 2.9Å
313	L	93.4	Very high	90.2	Very high	19 Å²	19	72.2 Å²	72.2	10%	0.099	39%	0.385	C	S	.	.	H	α-helix	trans	-60.4	-47.4	172	172.9	62.4	0	0	0	111.1	R299 C300 F307 S309 K310 E315 H316 L317	R299-L313 VanDerWaalsContact O-CD2 3.28Å; R299-L313 WeakPolarHBondContact O-CD2 3.39Å; C300-L313 HydrophobicContact CB-CD1 3.78Å; F307-L313 HydrophobicContact CB-CB 4.24Å; F307-L313 HydrophobicContact CD2-CB 3.93Å; F307-L313 HydrophobicContact CD2-CD1 3.71Å; F307-L313 HydrophobicContact CD2-CG 4.43Å; F307-L313 HydrophobicContact CE2-CD1 3.88Å; F307-L313 HydrophobicContact CG-CB 4.18Å; S309-L313 PolarHBondContact O-N 3.2Å; S309-L313 VanDerWaalsContact O-N 3.14Å; K310-L313 PolarHBondContact O-N 2.88Å; L313-E315 VanDerWaalsContact C-N 3.31Å; L313-E315 PolarHBondContact O-N 3.2Å; L313-H316 WeakPolarHBondContact O-CB 3.47Å; L313-H316 PolarHBondContact O-N 3.35Å; L313-L317 HydrophobicContact CD1-CD1 4.18Å; L313-L317 HydrophobicContact CD1-CG 4.03Å; L313-L317 HydrophobicContact CG-CD1 4.02Å; L313-L317 HydrophobicContact CG-CG 4.32Å; L313-L317 VanDerWaalsContact O-CG 3.32Å; L313-L317 WeakPolarHBondContact O-CG 3.28Å; L313-L317 PolarHBondContact O-N 2.93Å
314	N	91.7	Very high	89.8	Confident	74 Å²	74	73.7 Å²	73.7	40%	0.396	39%	0.393	S	S	.	.	H	α-helix	trans	-63.5	-37.6	179.4	-75.1	-17.7	0	0	0	112.4	K310 A311 R318	K310-N314 WeakPolarHBondContact O-CB 3.24Å; K310-N314 VanDerWaalsContact O-CG 3.28Å; K310-N314 PolarHBondContact O-N 3.25Å; K310-N314 PolarHBondContact O-ND2 3.38Å; A311-N314 PolarHBondContact O-N 3.44Å; N314-R318 VanDerWaalsContact O-CB 3.26Å; N314-R318 WeakPolarHBondContact O-CB 3.48Å; N314-R318 PolarHBondContact O-N 3Å
315	E	90.7	Very high	89.9	Confident	70 Å²	70	72.7 Å²	72.7	33%	0.327	38%	0.376	S	S	.	.	H	α-helix	trans	-64.8	-43	173.2	-177.3	174.3	-160.9	0	0	111.6	A311 N312 L313 R318 S319 Q337	A311-E315 WeakPolarHBondContact O-CB 3.4Å; A311-E315 PolarHBondContact O-N 3.47Å; N312-E315 PolarHBondContact O-N 3.1Å; L313-E315 VanDerWaalsContact C-N 3.31Å; L313-E315 PolarHBondContact O-N 3.2Å; E315-R318 PolarHBondContact O-N 3.35Å; E315-S319 VanDerWaalsContact O-CB 3.31Å; E315-S319 WeakPolarHBondContact O-CB 3.4Å; E315-S319 PolarHBondContact O-N 3.41Å; E315-S319 PolarHBondContact O-OG 3.48Å; E315-Q337 VanDerWaalsContact OE1-CG 3.24Å; E315-Q337 WeakPolarHBondContact OE1-CG 3.32Å; E315-Q337 PolarHBondContact OE1-NE2 2.92Å
316	H	91.9	Very high	89.9	Confident	12 Å²	12	67 Å²	67	6%	0.056	36%	0.356	C	S	.	.	H	α-helix	trans	-59.2	-50.3	172.8	166	82.3	0	0	0	111.9	C300 C303 F307 N312 L313 R318 S319 V320 H321	C300-H316 PolarHBondContact SG-NE2 3.39Å; C300-H316 VanDerWaalsContact SG-NE2 3.42Å; C303-H316 VanDerWaalsContact SG-CE1 3.52Å; C303-H316 PolarHBondContact SG-NE2 2.84Å; F307-H316 HydrophobicContact CE1-CB 3.72Å; F307-H316 HydrophobicContact CE2-CB 3.86Å; F307-H316 AromaticContact CE2-CD2 3.8Å; F307-H316 AromaticContact CE2-CG 3.67Å; F307-H316 HydrophobicContact CZ-CB 3.27Å; F307-H316 AromaticContact CZ-CD2 3.81Å; F307-H316 AromaticContact CZ-CG 3.2Å; F307-H316 AromaticContact CZ-ND1 3.53Å; N312-H316 WeakPolarHBondContact O-CB 3.44Å; N312-H316 PolarHBondContact O-N 2.9Å; L313-H316 WeakPolarHBondContact O-CB 3.47Å; L313-H316 PolarHBondContact O-N 3.35Å; H316-R318 PolarHBondContact O-N 3.13Å; H316-S319 WeakPolarHBondContact CA-OG 3.38Å; H316-S319 PolarHBondContact O-N 3.31Å; H316-S319 PolarHBondContact O-OG 2.86Å; H316-V320 WeakPolarHBondContact O-CB 3.44Å; H316-V320 PolarHBondContact O-N 3.4Å; H316-H321 AromaticContact CD2-CD2 3.83Å; H316-H321 AromaticContact CE1-NE2 3.71Å; H316-H321 AromaticContact NE2-CD2 3.24Å; H316-H321 PolarHBondContact NE2-CD2 3.08Å; H316-H321 AromaticContact NE2-NE2 3.01Å; H316-H321 PolarHBondContact NE2-NE2 3.38Å
317	L	92.2	Very high	89.9	Confident	47 Å²	47	64.3 Å²	64.3	25%	0.246	35%	0.354	C	S	.	.	I	π-helix	trans	-56.5	-43.6	177.1	-71	172.3	0	0	0	110.9	C300 L313 H321 T322	C300-L317 VanDerWaalsContact SG-CD2 3.59Å; L313-L317 HydrophobicContact CD1-CD1 4.18Å; L313-L317 HydrophobicContact CD1-CG 4.03Å; L313-L317 HydrophobicContact CG-CD1 4.02Å; L313-L317 HydrophobicContact CG-CG 4.32Å; L313-L317 VanDerWaalsContact O-CG 3.32Å; L313-L317 WeakPolarHBondContact O-CG 3.28Å; L313-L317 PolarHBondContact O-N 2.93Å; L317-H321 WeakPolarHBondContact O-CB 3.36Å; L317-H321 PolarHBondContact O-N 2.96Å; L317-H321 VanDerWaalsContact O-N 3.09Å; L317-T322 PolarHBondContact O-N 2.9Å; L317-T322 PolarHBondContact O-OG1 2.96Å
318	R	90.8	Very high	90.1	Very high	120 Å²	120	63 Å²	63	45%	0.453	35%	0.349	S	S	.	.	I	π-helix	trans	-64.7	-42.5	179.7	-170.1	-179	-58.1	141.5	-0.1	112.8	N314 E315 H316 T322 G323 V324	N314-R318 VanDerWaalsContact O-CB 3.26Å; N314-R318 WeakPolarHBondContact O-CB 3.48Å; N314-R318 PolarHBondContact O-N 3Å; E315-R318 PolarHBondContact O-N 3.35Å; H316-R318 PolarHBondContact O-N 3.13Å; R318-T322 VanDerWaalsContact CA-OG1 3.26Å; R318-T322 WeakPolarHBondContact CA-OG1 3.31Å; R318-T322 PolarHBondContact O-OG1 3.38Å; R318-G323 PolarHBondContact O-N 2.95Å; R318-V324 HydrophobicContact CG-CB 3.61Å; R318-V324 HydrophobicContact CG-CG1 4Å; R318-V324 HydrophobicContact CG-CG2 4.19Å; R318-V324 PolarHBondContact O-N 2.79Å
319	S	89.5	Confident	90.4	Very high	26 Å²	26	68.1 Å²	68.1	18%	0.182	37%	0.367	C	S	.	.	I	π-helix	trans	-81.1	-40.4	-173.2	49.7	0	0	0	0	113.8	E315 H316	E315-S319 VanDerWaalsContact O-CB 3.31Å; E315-S319 WeakPolarHBondContact O-CB 3.4Å; E315-S319 PolarHBondContact O-N 3.41Å; E315-S319 PolarHBondContact O-OG 3.48Å; H316-S319 WeakPolarHBondContact CA-OG 3.38Å; H316-S319 PolarHBondContact O-N 3.31Å; H316-S319 PolarHBondContact O-OG 2.86Å
320	V	89.6	Confident	90.5	Very high	88 Å²	88	72.3 Å²	72.3	53%	0.533	38%	0.383	S	S	.	.	I	π-helix	trans	-98.6	-41.2	-170.6	-179.7	0	0	0	0	111.6	H316	H316-V320 WeakPolarHBondContact O-CB 3.44Å; H316-V320 PolarHBondContact O-N 3.4Å
321	H	90.7	Very high	90.7	Very high	51 Å²	51	69.4 Å²	69.4	24%	0.236	38%	0.375	C	S	.	.	I	π-helix	trans	-101.7	-42.5	-167.9	-69.2	-66.7	0	0	0	113.4	C300 Q302 C303 H316 L317	C300-H321 VanDerWaalsContact SG-CD2 3.59Å; C300-H321 PolarHBondContact SG-NE2 2.96Å; Q302-H321 WeakPolarHBondContact CB-CE1 3.35Å; Q302-H321 WeakPolarHBondContact CB-ND1 3.4Å; Q302-H321 VanDerWaalsContact OE1-CB 3.23Å; Q302-H321 VanDerWaalsContact OE1-CG 3.23Å; Q302-H321 PolarHBondContact OE1-ND1 3.46Å; C303-H321 PolarHBondContact SG-NE2 3.38Å; C303-H321 VanDerWaalsContact SG-NE2 3.37Å; H316-H321 AromaticContact CD2-CD2 3.83Å; H316-H321 AromaticContact CE1-NE2 3.71Å; H316-H321 AromaticContact NE2-CD2 3.24Å; H316-H321 PolarHBondContact NE2-CD2 3.08Å; H316-H321 AromaticContact NE2-NE2 3.01Å; H316-H321 PolarHBondContact NE2-NE2 3.38Å; L317-H321 WeakPolarHBondContact O-CB 3.36Å; L317-H321 PolarHBondContact O-N 2.96Å; L317-H321 VanDerWaalsContact O-N 3.09Å
322	T	89.3	Confident	90.9	Very high	92 Å²	92	74.1 Å²	74.1	56%	0.564	39%	0.391	S	S	*	.	S	Bend	trans	-89.1	-13.4	176.2	65.3	0	0	0	0	113.2	L317 R318 V324	L317-T322 PolarHBondContact O-N 2.9Å; L317-T322 PolarHBondContact O-OG1 2.96Å; R318-T322 VanDerWaalsContact CA-OG1 3.26Å; R318-T322 WeakPolarHBondContact CA-OG1 3.31Å; R318-T322 PolarHBondContact O-OG1 3.38Å; T322-V324 PolarHBondContact O-N 2.99Å; T322-V324 WeakPolarHBondContact OG1-CG2 3.42Å
323	G	83.7	Confident	91	Very high	44 Å²	44	78.2 Å²	78.2	45%	0.454	40%	0.401	S	S	.	.			trans	66.6	18.4	177.3	0	0	0	0	0	114.5	R318 R325	R318-G323 PolarHBondContact O-N 2.95Å; G323-R325 WeakPolarHBondContact O-CG 3.38Å; G323-R325 PolarHBondContact O-N 3.24Å
324	V	86.5	Confident	90.9	Very high	70 Å²	70	84 Å²	84	42%	0.424	43%	0.426	S	S	.	.			trans	-67.5	122.2	179.3	172.7	0	0	0	0	109.1	R318 T322	R318-V324 HydrophobicContact CG-CB 3.61Å; R318-V324 HydrophobicContact CG-CG1 4Å; R318-V324 HydrophobicContact CG-CG2 4.19Å; R318-V324 PolarHBondContact O-N 2.79Å; T322-V324 PolarHBondContact O-N 2.99Å; T322-V324 WeakPolarHBondContact OG1-CG2 3.42Å
325	R	88.7	Confident	90.9	Very high	150 Å²	150	82.8 Å²	82.8	57%	0.566	42%	0.416	S	S	*	.			trans	-120.3	147.8	178.3	-55.3	-152.4	-178.9	169.8	3.6	111.5	G323 K334 Y335	G323-R325 WeakPolarHBondContact O-CG 3.38Å; G323-R325 PolarHBondContact O-N 3.24Å; R325-K334 HydrophobicContact CB-CB 3.98Å; R325-Y335 CarbonylContact C-O 3.53Å; R325-Y335 WeakPolarHBondContact CA-O 3.2Å; R325-Y335 WeakPolarHBondContact CB-O 3.27Å
326	F	90.1	Very high	90.8	Very high	42 Å²	42	83.7 Å²	83.7	18%	0.184	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	108.3	174.4	-59.1	-79.9	0	0	0	109	K334 Y335 I336 Q337 R338 L341	F326-K334 WeakPolarHBondContact O-CA 3.49Å; F326-Y335 PolarHBondContact N-O 3.44Å; F326-Y335 PolarHBondContact O-N 2.9Å; F326-I336 WeakPolarHBondContact CD2-O 3.36Å; F326-I336 WeakPolarHBondContact CE2-O 3.46Å; F326-Q337 VanDerWaalsContact CD2-C 3.47Å; F326-R338 HydrophobicContact CE1-CB 4.4Å; F326-R338 HydrophobicContact CE2-CB 4.41Å; F326-R338 HydrophobicContact CZ-CB 4.33Å; F326-L341 HydrophobicContact CB-CB 4.21Å; F326-L341 HydrophobicContact CB-CD2 3.82Å
327	A	92.7	Very high	90.6	Very high	51 Å²	51	87.1 Å²	87.1	42%	0.421	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	144.9	176.9	0	0	0	0	0	111.3	K334 L341	A327-K334 HydrophobicContact CB-CG 4.11Å; A327-L341 WeakPolarHBondContact O-CD2 3.43Å
328	C	94.4	Very high	90.5	Very high	10 Å²	10	91.2 Å²	91.2	7%	0.068	45%	0.45	C	S	.	.			trans	-74.7	140.4	161.5	-169.8	0	0	0	0	109	Q330 C331 R333 L341 H344 H349	C328-Q330 PolarHBondContact SG-N 3.48Å; C328-C331 CarbonylContact C-O 3.56Å; C328-C331 WeakPolarHBondContact CB-O 3.4Å; C328-R333 PolarHBondContact N-O 3.46Å; C328-L341 HydrophobicContact CB-CD1 3.76Å; C328-H344 PolarHBondContact SG-NE2 2.93Å; C328-H344 VanDerWaalsContact SG-NE2 3.43Å; C328-H349 PolarHBondContact SG-NE2 3.23Å
329	E	93.4	Very high	90.5	Very high	191 Å²	191	88.9 Å²	88.9	89%	0.893	45%	0.452	S	S	*	.	S	Bend	trans	-86.1	-15.2	176.8	-67.4	174.9	-167.5	0	0	111.8
330	Q	91.1	Very high	90.6	Very high	124 Å²	124	88.3 Å²	88.3	58%	0.579	45%	0.45	S	S	*	.	S	Bend	trans	-103.7	-5.1	-177.5	-59.5	-177.2	38.4	0	0	113.1	C328 H349	C328-Q330 PolarHBondContact SG-N 3.48Å; Q330-H349 VanDerWaalsContact CB-CE1 3.45Å; Q330-H349 WeakPolarHBondContact CB-CE1 3.07Å; Q330-H349 VanDerWaalsContact OE1-CB 3.29Å; Q330-H349 VanDerWaalsContact OE1-CG 3.31Å; Q330-H349 PolarHBondContact OE1-ND1 3Å
331	C	93.8	Very high	90.8	Very high	41 Å²	41	84.2 Å²	84.2	28%	0.277	43%	0.425	S	S	.	.	S	Bend	trans	-160.9	170.4	172.1	70.9	0	0	0	0	111.5	C328 R333 H344	C328-C331 CarbonylContact C-O 3.56Å; C328-C331 WeakPolarHBondContact CB-O 3.4Å; C331-R333 PolarHBondContact O-N 3.19Å; C331-H344 PolarHBondContact SG-NE2 3.01Å
332	D	93.3	Very high	91	Very high	164 Å²	164	85.9 Å²	85.9	88%	0.877	44%	0.436	S	S	*	.	S	Bend	trans	-75.7	7.3	-175.2	-62.1	-44.3	0	0	0	115.3
333	R	92.7	Very high	91.1	Very high	156 Å²	156	89.7 Å²	89.7	59%	0.589	44%	0.44	S	S	*	.			trans	-76.3	135.9	-177	-66.2	-168	178.9	-157.2	1.2	111.7	C328 C331 Y335	C328-R333 PolarHBondContact N-O 3.46Å; C331-R333 PolarHBondContact O-N 3.19Å; R333-Y335 HydrophobicContact CB-CE2 3.72Å; R333-Y335 WeakPolarHBondContact CD-OH 3.4Å
334	K	93.2	Very high	91.6	Very high	141 Å²	141	88.1 Å²	88.1	61%	0.613	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	136.7	177.9	-61.8	-179.4	-176.4	176.7	0	110.7	R325 F326 A327	R325-K334 HydrophobicContact CB-CB 3.98Å; F326-K334 WeakPolarHBondContact O-CA 3.49Å; A327-K334 HydrophobicContact CB-CG 4.11Å
335	Y	91.3	Very high	91.9	Very high	48 Å²	48	86.4 Å²	86.4	19%	0.188	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	147.7	-174.6	-66.4	-90.9	0	0	0	111.8	R325 F326 R333 L341 H344	R325-Y335 CarbonylContact C-O 3.53Å; R325-Y335 WeakPolarHBondContact CA-O 3.2Å; R325-Y335 WeakPolarHBondContact CB-O 3.27Å; F326-Y335 PolarHBondContact N-O 3.44Å; F326-Y335 PolarHBondContact O-N 2.9Å; R333-Y335 HydrophobicContact CB-CE2 3.72Å; R333-Y335 WeakPolarHBondContact CD-OH 3.4Å; Y335-L341 HydrophobicContact CD2-CB 3.98Å; Y335-L341 HydrophobicContact CD2-CD1 3.87Å; Y335-L341 HydrophobicContact CE2-CD1 4.21Å; Y335-L341 HydrophobicContact CG-CB 4.18Å; Y335-H344 HydrophobicContact CE1-CB 4.01Å; Y335-H344 HydrophobicContact CE2-CB 3.76Å; Y335-H344 AromaticContact CE2-CD2 3.52Å; Y335-H344 AromaticContact CE2-CG 3.65Å; Y335-H344 AromaticContact CZ-CD2 3.89Å; Y335-H344 AromaticContact CZ-CG 3.5Å; Y335-H344 VanDerWaalsContact CZ-CG 3.5Å; Y335-H344 VanDerWaalsContact OH-CB 3.23Å; Y335-H344 WeakPolarHBondContact OH-CB 3.23Å; Y335-H344 PolarHBondContact OH-ND1 3.45Å
336	I	88.1	Confident	92.1	Very high	89 Å²	89	83.8 Å²	83.8	46%	0.456	40%	0.402	S	S	.	.	S	Bend	trans	-71.7	-37	177.3	-66	172.8	0	0	0	111.2	F326	F326-I336 WeakPolarHBondContact CD2-O 3.36Å; F326-I336 WeakPolarHBondContact CE2-O 3.46Å
337	Q	88.6	Confident	92.1	Very high	85 Å²	85	86.7 Å²	86.7	40%	0.397	42%	0.417	S	S	.	.	S	Bend	trans	-119.4	148	-178	-61.9	-175.9	-26.4	0	0	111.6	E315 F326 S339 G340 L341	E315-Q337 VanDerWaalsContact OE1-CG 3.24Å; E315-Q337 WeakPolarHBondContact OE1-CG 3.32Å; E315-Q337 PolarHBondContact OE1-NE2 2.92Å; F326-Q337 VanDerWaalsContact CD2-C 3.47Å; Q337-S339 VanDerWaalsContact C-N 3.28Å; Q337-S339 WeakPolarHBondContact CB-OG 3.3Å; Q337-S339 PolarHBondContact O-N 3.35Å; Q337-S339 PolarHBondContact OE1-OG 2.82Å; Q337-G340 PolarHBondContact O-N 3.35Å; Q337-G340 VanDerWaalsContact O-N 3.13Å; Q337-L341 PolarHBondContact O-N 2.97Å
338	R	89	Confident	92.1	Very high	133 Å²	133	88.6 Å²	88.6	50%	0.502	42%	0.423	S	S	.	.	H	α-helix	trans	-60.4	-38.1	175.3	-163.2	85.8	-162	178.9	9	111.9	F326 G340 L341 N342	F326-R338 HydrophobicContact CE1-CB 4.4Å; F326-R338 HydrophobicContact CE2-CB 4.41Å; F326-R338 HydrophobicContact CZ-CB 4.33Å; R338-G340 VanDerWaalsContact C-N 3.29Å; R338-G340 PolarHBondContact O-N 2.94Å; R338-L341 PolarHBondContact O-N 3.38Å; R338-N342 VanDerWaalsContact O-CG 3.3Å; R338-N342 PolarHBondContact O-N 2.84Å; R338-N342 PolarHBondContact O-OD1 2.78Å
339	S	90.6	Very high	91.9	Very high	71 Å²	71	90.8 Å²	90.8	50%	0.497	43%	0.432	S	S	.	.	H	α-helix	trans	-58.1	-41.7	174.9	50.4	0	0	0	0	112.1	Q337 N342 R343	Q337-S339 VanDerWaalsContact C-N 3.28Å; Q337-S339 WeakPolarHBondContact CB-OG 3.3Å; Q337-S339 PolarHBondContact O-N 3.35Å; Q337-S339 PolarHBondContact OE1-OG 2.82Å; S339-N342 PolarHBondContact O-N 3.4Å; S339-R343 WeakPolarHBondContact O-CB 3.49Å; S339-R343 PolarHBondContact O-N 2.85Å
340	G	92.4	Very high	91.6	Very high	13 Å²	13	88 Å²	88	13%	0.134	42%	0.419	C	S	.	.	H	α-helix	trans	-62.2	-45.5	175.4	0	0	0	0	0	112.5	Q337 R338 R343 H344	Q337-G340 PolarHBondContact O-N 3.35Å; Q337-G340 VanDerWaalsContact O-N 3.13Å; R338-G340 VanDerWaalsContact C-N 3.29Å; R338-G340 PolarHBondContact O-N 2.94Å; G340-R343 PolarHBondContact O-N 2.92Å; G340-H344 WeakPolarHBondContact O-CB 3.23Å; G340-H344 PolarHBondContact O-N 3.35Å
341	L	94.1	Very high	90.6	Very high	2 Å²	2	84.6 Å²	84.6	1%	0.01	42%	0.417	C	S	.	.	H	α-helix	trans	-61.5	-49.3	174.5	173.2	62.2	0	0	0	111.6	F326 A327 C328 Y335 Q337 R338 R343 H344 I345	F326-L341 HydrophobicContact CB-CB 4.21Å; F326-L341 HydrophobicContact CB-CD2 3.82Å; A327-L341 WeakPolarHBondContact O-CD2 3.43Å; C328-L341 HydrophobicContact CB-CD1 3.76Å; Y335-L341 HydrophobicContact CD2-CB 3.98Å; Y335-L341 HydrophobicContact CD2-CD1 3.87Å; Y335-L341 HydrophobicContact CE2-CD1 4.21Å; Y335-L341 HydrophobicContact CG-CB 4.18Å; Q337-L341 PolarHBondContact O-N 2.97Å; R338-L341 PolarHBondContact O-N 3.38Å; L341-R343 VanDerWaalsContact C-N 3.3Å; L341-R343 PolarHBondContact O-N 3.15Å; L341-H344 WeakPolarHBondContact O-CA 3.46Å; L341-H344 WeakPolarHBondContact O-CB 3.47Å; L341-H344 PolarHBondContact O-N 3.37Å; L341-I345 HydrophobicContact CD1-CD1 3.84Å; L341-I345 HydrophobicContact CD1-CG1 4Å; L341-I345 HydrophobicContact CD2-CD1 4.43Å; L341-I345 HydrophobicContact CG-CD1 3.82Å; L341-I345 HydrophobicContact CG-CG1 4.39Å; L341-I345 WeakPolarHBondContact O-CG1 3.38Å; L341-I345 PolarHBondContact O-N 3.3Å
342	N	93.2	Very high	89.2	Confident	86 Å²	86	84.2 Å²	84.2	46%	0.46	42%	0.418	S	S	.	.	H	α-helix	trans	-61.1	-40.9	-179.1	-70	-1.1	0	0	0	111.5	R338 S339 H344 I345 K346	R338-N342 VanDerWaalsContact O-CG 3.3Å; R338-N342 PolarHBondContact O-N 2.84Å; R338-N342 PolarHBondContact O-OD1 2.78Å; S339-N342 PolarHBondContact O-N 3.4Å; N342-H344 VanDerWaalsContact C-N 3.33Å; N342-I345 PolarHBondContact O-N 2.82Å; N342-K346 VanDerWaalsContact O-CB 3.31Å; N342-K346 WeakPolarHBondContact O-CB 3.37Å; N342-K346 PolarHBondContact O-N 3.4Å
343	R	93.2	Very high	87.2	Confident	173 Å²	173	85.3 Å²	85.3	65%	0.653	42%	0.417	S	S	*	.	H	α-helix	trans	-61.9	-42.4	173.6	-179.9	174.9	62.3	173.6	-0.2	111.4	S339 G340 L341 K346 M347	S339-R343 WeakPolarHBondContact O-CB 3.49Å; S339-R343 PolarHBondContact O-N 2.85Å; G340-R343 PolarHBondContact O-N 2.92Å; L341-R343 VanDerWaalsContact C-N 3.3Å; L341-R343 PolarHBondContact O-N 3.15Å; R343-K346 PolarHBondContact O-N 3.07Å; R343-M347 HydrophobicContact CG-CE 4.42Å; R343-M347 HydrophobicContact CG-CG 4.41Å; R343-M347 WeakPolarHBondContact O-CB 3.39Å; R343-M347 VanDerWaalsContact O-CG 3.32Å; R343-M347 WeakPolarHBondContact O-CG 3.4Å; R343-M347 PolarHBondContact O-N 3.49Å
344	H	92.9	Very high	85.4	Confident	10 Å²	10	85 Å²	85	5%	0.046	42%	0.42	C	S	.	.	H	α-helix	trans	-62.1	-49.1	176.8	159.5	63.6	0	0	0	112.3	C328 C331 Y335 G340 L341 N342 K346 M347 V348 H349	C328-H344 PolarHBondContact SG-NE2 2.93Å; C328-H344 VanDerWaalsContact SG-NE2 3.43Å; C331-H344 PolarHBondContact SG-NE2 3.01Å; Y335-H344 HydrophobicContact CE1-CB 4.01Å; Y335-H344 HydrophobicContact CE2-CB 3.76Å; Y335-H344 AromaticContact CE2-CD2 3.52Å; Y335-H344 AromaticContact CE2-CG 3.65Å; Y335-H344 AromaticContact CZ-CD2 3.89Å; Y335-H344 AromaticContact CZ-CG 3.5Å; Y335-H344 VanDerWaalsContact CZ-CG 3.5Å; Y335-H344 VanDerWaalsContact OH-CB 3.23Å; Y335-H344 WeakPolarHBondContact OH-CB 3.23Å; Y335-H344 PolarHBondContact OH-ND1 3.45Å; G340-H344 WeakPolarHBondContact O-CB 3.23Å; G340-H344 PolarHBondContact O-N 3.35Å; L341-H344 WeakPolarHBondContact O-CA 3.46Å; L341-H344 WeakPolarHBondContact O-CB 3.47Å; L341-H344 PolarHBondContact O-N 3.37Å; N342-H344 VanDerWaalsContact C-N 3.33Å; H344-K346 VanDerWaalsContact C-N 3.28Å; H344-K346 PolarHBondContact O-N 3.47Å; H344-M347 PolarHBondContact O-N 3.22Å; H344-V348 WeakPolarHBondContact ND1-CG2 3.31Å; H344-V348 WeakPolarHBondContact O-CB 3.39Å; H344-V348 PolarHBondContact O-N 3.3Å; H344-H349 AromaticContact CE1-CD2 3.9Å; H344-H349 AromaticContact CE1-NE2 3.57Å; H344-H349 AromaticContact NE2-CD2 3.6Å; H344-H349 AromaticContact NE2-NE2 3.29Å; H344-H349 PolarHBondContact NE2-NE2 3.44Å
345	I	93.4	Very high	83.3	Confident	35 Å²	35	82.6 Å²	82.6	18%	0.179	42%	0.422	C	S	.	.	I	π-helix	trans	-55.6	-49.4	176.8	-67	168.9	0	0	0	109.7	L341 N342 M347 H349 E350	L341-I345 HydrophobicContact CD1-CD1 3.84Å; L341-I345 HydrophobicContact CD1-CG1 4Å; L341-I345 HydrophobicContact CD2-CD1 4.43Å; L341-I345 HydrophobicContact CG-CD1 3.82Å; L341-I345 HydrophobicContact CG-CG1 4.39Å; L341-I345 WeakPolarHBondContact O-CG1 3.38Å; L341-I345 PolarHBondContact O-N 3.3Å; N342-I345 PolarHBondContact O-N 2.82Å; I345-M347 VanDerWaalsContact C-N 3.33Å; I345-M347 PolarHBondContact O-N 2.77Å; I345-H349 HydrophobicContact CG2-CB 4.41Å; I345-H349 WeakPolarHBondContact O-CA 3.44Å; I345-H349 WeakPolarHBondContact O-CB 3.36Å; I345-H349 PolarHBondContact O-N 3.45Å; I345-E350 HydrophobicContact CG2-CG 4.13Å; I345-E350 PolarHBondContact O-N 2.99Å
346	K	92.6	Very high	80.9	Confident	95 Å²	95	86.9 Å²	86.9	41%	0.413	46%	0.457	S	S	.	.	I	π-helix	trans	-59.5	-41.3	-179.2	-170.9	172.7	-176.7	-174.4	0	113.4	N342 R343 H344 G351 A352	N342-K346 VanDerWaalsContact O-CB 3.31Å; N342-K346 WeakPolarHBondContact O-CB 3.37Å; N342-K346 PolarHBondContact O-N 3.4Å; R343-K346 PolarHBondContact O-N 3.07Å; H344-K346 VanDerWaalsContact C-N 3.28Å; H344-K346 PolarHBondContact O-N 3.47Å; K346-G351 PolarHBondContact O-N 3.06Å; K346-A352 HydrophobicContact CD-CB 4.25Å; K346-A352 HydrophobicContact CG-CB 3.58Å; K346-A352 WeakPolarHBondContact O-CB 3.28Å; K346-A352 PolarHBondContact O-N 3.04Å
347	M	90.6	Very high	78.9	Confident	103 Å²	103	92 Å²	92	51%	0.507	49%	0.492	S	S	.	.	I	π-helix	trans	-85.4	-31.2	-175.9	-64.9	-140.2	-62.6	0	0	114.4	R343 H344 I345 F354	R343-M347 HydrophobicContact CG-CE 4.42Å; R343-M347 HydrophobicContact CG-CG 4.41Å; R343-M347 WeakPolarHBondContact O-CB 3.39Å; R343-M347 VanDerWaalsContact O-CG 3.32Å; R343-M347 WeakPolarHBondContact O-CG 3.4Å; R343-M347 PolarHBondContact O-N 3.49Å; H344-M347 PolarHBondContact O-N 3.22Å; I345-M347 VanDerWaalsContact C-N 3.33Å; I345-M347 PolarHBondContact O-N 2.77Å; M347-F354 HydrophobicContact CG-CE2 4.01Å; M347-F354 HydrophobicContact SD-CD2 3.94Å; M347-F354 HydrophobicContact SD-CE2 3.8Å
348	V	91.6	Very high	78.4	Confident	90 Å²	90	92.4 Å²	92.4	55%	0.545	50%	0.497	S	S	.	.	I	π-helix	trans	-103.9	-34.7	-171.9	-178.5	0	0	0	0	112.1	H344	H344-V348 WeakPolarHBondContact ND1-CG2 3.31Å; H344-V348 WeakPolarHBondContact O-CB 3.39Å; H344-V348 PolarHBondContact O-N 3.3Å
349	H	90.2	Very high	77.9	Confident	56 Å²	56	90.2 Å²	90.2	26%	0.259	50%	0.497	S	S	.	.	I	π-helix	trans	-107.5	-34.5	-171.7	-66	-63.5	0	0	0	112.9	C328 Q330 H344 I345	C328-H349 PolarHBondContact SG-NE2 3.23Å; Q330-H349 VanDerWaalsContact CB-CE1 3.45Å; Q330-H349 WeakPolarHBondContact CB-CE1 3.07Å; Q330-H349 VanDerWaalsContact OE1-CB 3.29Å; Q330-H349 VanDerWaalsContact OE1-CG 3.31Å; Q330-H349 PolarHBondContact OE1-ND1 3Å; H344-H349 AromaticContact CE1-CD2 3.9Å; H344-H349 AromaticContact CE1-NE2 3.57Å; H344-H349 AromaticContact NE2-CD2 3.6Å; H344-H349 AromaticContact NE2-NE2 3.29Å; H344-H349 PolarHBondContact NE2-NE2 3.44Å; I345-H349 HydrophobicContact CG2-CB 4.41Å; I345-H349 WeakPolarHBondContact O-CA 3.44Å; I345-H349 WeakPolarHBondContact O-CB 3.36Å; I345-H349 PolarHBondContact O-N 3.45Å
350	E	88	Confident	77.2	Confident	132 Å²	132	91.3 Å²	91.3	62%	0.617	50%	0.497	S	S	*	.	S	Bend	trans	-93.7	-6.8	178.3	-61.6	174.8	172.7	0	0	113.1	I345 A352	I345-E350 HydrophobicContact CG2-CG 4.13Å; I345-E350 PolarHBondContact O-N 2.99Å; E350-A352 VanDerWaalsContact C-N 3.28Å; E350-A352 PolarHBondContact O-N 3.36Å
351	G	70.5	Confident	76.3	Confident	53 Å²	53	95.9 Å²	95.9	55%	0.546	52%	0.518	S	S	.	.			trans	62.7	29.6	176.7	0	0	0	0	0	114.2	K346 E353	K346-G351 PolarHBondContact O-N 3.06Å; G351-E353 PolarHBondContact O-N 3.46Å
352	A	63.3	Low	75.1	Confident	34 Å²	34	101.8 Å²	101.8	28%	0.281	55%	0.55	S	S	.	.			trans	-69.3	98.6	178.3	0	0	0	0	0	110.6	K346 E350 F354	K346-A352 HydrophobicContact CD-CB 4.25Å; K346-A352 HydrophobicContact CG-CB 3.58Å; K346-A352 WeakPolarHBondContact O-CB 3.28Å; K346-A352 PolarHBondContact O-N 3.04Å; E350-A352 VanDerWaalsContact C-N 3.28Å; E350-A352 PolarHBondContact O-N 3.36Å; A352-F354 PolarHBondContact O-N 2.89Å
353	E	51.9	Low	73.9	Confident	186 Å²	186	102.8 Å²	102.8	87%	0.869	56%	0.556	S	S	*	*			trans	-63.7	115.6	167.3	-73.7	-175	160.9	0	0	109.2	G351 S355	G351-E353 PolarHBondContact O-N 3.46Å; E353-S355 PolarHBondContact O-N 3.39Å
354	F	55.3	Low	72.6	Confident	149 Å²	149	97.8 Å²	97.8	65%	0.654	55%	0.549	S	S	*	.			trans	-79.4	98.5	161.4	-73.3	-89.4	0	0	0	106.9	M347 A352 C356	M347-F354 HydrophobicContact CG-CE2 4.01Å; M347-F354 HydrophobicContact SD-CD2 3.94Å; M347-F354 HydrophobicContact SD-CE2 3.8Å; A352-F354 PolarHBondContact O-N 2.89Å; F354-C356 PolarHBondContact O-N 3.34Å
355	S	48.1	Very low	71	Confident	92 Å²	92	104.5 Å²	104.5	64%	0.643	59%	0.587	S	S	*	*			trans	-65.9	124.5	164.9	61.8	0	0	0	0	108.3	E353 V357	E353-S355 PolarHBondContact O-N 3.39Å; S355-V357 PolarHBondContact O-N 3.5Å
356	C	42.4	Very low	69.1	Low	137 Å²	137	110.3 Å²	110.3	93%	0.926	62%	0.621	S	S	*	*			trans	-66.4	116.8	164.3	-153	0	0	0	0	106.8	F354	F354-C356 PolarHBondContact O-N 3.34Å
357	V	45.1	Very low	67	Low	197 Å²	197	111.7 Å²	111.7	100%	1.194	64%	0.64	S	S	*	*			trans	-87	0	177.7	-178.3	0	0	0	0	109.6	S355	S355-V357 PolarHBondContact O-N 3.5Å

Retrieved 357 of 357 residues in 55 ms (Link to these results)

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