A0A087X5Y0_POEFO Loading...

Aminomethyltransferase

The glycine cleavage system catalyzes the degradation of glycine.

AlphaFold DB , UniProt , Accession A0A087X5Y0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 415 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.8	Very low	25.3	Very low	234 Å²	234	143 Å²	143	100%	1.153	86%	0.859	S	S	*	*				0	159.9	0	-140.8	172.2	-164.8	0	0	107.4
2	W	19.6	Very low	25.4	Very low	254 Å²	254	146.9 Å²	146.9	96%	0.962	87%	0.871	S	S	*	*			trans	78.2	128.1	-153.4	-60.2	50.4	0	0	0	111.5
3	A	22	Very low	25.5	Very low	93 Å²	93	141.3 Å²	141.3	77%	0.769	86%	0.862	S	S	*	*			cis	-150.7	154.4	-12.3	0	0	0	0	0	111.4
4	R	23.1	Very low	25.5	Very low	247 Å²	247	141.6 Å²	141.6	93%	0.932	86%	0.855	S	S	*	*			trans	-122.5	120.4	164.9	-103.2	-168.7	176.7	-168	0.6	107.6
5	V	25.4	Very low	25.6	Very low	145 Å²	145	147.6 Å²	147.6	88%	0.879	86%	0.856	S	S	*	*			trans	-148.1	147.9	159.8	179.6	0	0	0	0	110.3
6	T	23.9	Very low	25.9	Very low	133 Å²	133	143.3 Å²	143.3	82%	0.816	84%	0.843	S	S	*	*			trans	-140.5	152.7	-171.8	42.1	0	0	0	0	109.6
7	A	26.2	Very low	26	Very low	94 Å²	94	141.3 Å²	141.3	78%	0.777	84%	0.839	S	S	*	*			cis	-167.4	-158.9	-5.9	0	0	0	0	0	108.6
8	A	26.4	Very low	26.3	Very low	110 Å²	110	144.4 Å²	144.4	91%	0.909	83%	0.834	S	S	*	*			trans	77.6	147.9	174.6	0	0	0	0	0	116.6
9	G	26.1	Very low	26.5	Very low	63 Å²	63	144.6 Å²	144.6	65%	0.649	83%	0.826	S	S	*	*			cis	173.1	172.9	-5.9	0	0	0	0	0	113.5
10	S	26.4	Very low	26.4	Very low	137 Å²	137	144 Å²	144	96%	0.958	83%	0.83	S	S	*	*			trans	69.7	145.5	178.4	76.6	0	0	0	0	117.7
11	G	26.7	Very low	26.5	Very low	63 Å²	63	142.9 Å²	142.9	65%	0.649	83%	0.825	S	S	*	*			cis	178.3	161	-9.7	0	0	0	0	0	114.5
12	L	26.6	Very low	26.2	Very low	190 Å²	190	139.9 Å²	139.9	100%	0.995	81%	0.813	S	S	*	*			trans	59.6	135.8	161.8	-69.4	118.8	0	0	0	122.4
13	G	25.9	Very low	26.6	Very low	74 Å²	74	138.7 Å²	138.7	76%	0.763	81%	0.808	S	S	*	*			trans	163.7	125.7	162.9	0	0	0	0	0	112.9
14	L	26.2	Very low	26.9	Very low	146 Å²	146	141 Å²	141	76%	0.764	81%	0.812	S	S	*	*			trans	-123.5	150.8	-168.3	-115.6	80.5	0	0	0	114.1
15	R	27.1	Very low	27.3	Very low	231 Å²	231	135.8 Å²	135.8	87%	0.872	81%	0.808	S	S	*	*			trans	68.2	159.1	154.1	-68.1	174.8	178.9	-162.2	1.7	118.3
16	A	29.3	Very low	27.3	Very low	78 Å²	78	132.7 Å²	132.7	65%	0.645	81%	0.805	S	S	*	*			cis	-175.1	167.2	-27.2	0	0	0	0	0	110.3
17	S	28.5	Very low	27.6	Very low	110 Å²	110	131.7 Å²	131.7	77%	0.769	81%	0.811	S	S	*	*			trans	74.6	152.7	155.5	77.8	0	0	0	0	118.3
18	R	31.2	Very low	27.6	Very low	198 Å²	198	130.8 Å²	130.8	75%	0.747	81%	0.811	S	S	*	*			cis	-160.8	150.1	7.9	-135.7	171.1	-155.2	-106.9	10	113.3
19	E	29.7	Very low	27.8	Very low	148 Å²	148	132 Å²	132	69%	0.692	81%	0.811	S	S	*	*			trans	37.1	131.7	144	-71.3	160.5	169.4	0	0	123.9
20	C	24.1	Very low	28.4	Very low	132 Å²	132	134.2 Å²	134.2	89%	0.892	82%	0.823	S	S	*	*				-157.4	162.1	102.4	-154	0	0	0	0	111.8
21	V	28.8	Very low	28.5	Very low	120 Å²	120	131.4 Å²	131.4	73%	0.727	82%	0.815	S	S	*	*			trans	-130.9	144.4	-167.5	171.9	0	0	0	0	110.9
22	L	26.5	Very low	28.9	Very low	172 Å²	172	138 Å²	138	90%	0.901	83%	0.826	S	S	*	*			trans	-157.6	132.8	148.1	-110.7	155.1	0	0	0	112
23	R	28.5	Very low	29.3	Very low	228 Å²	228	135.4 Å²	135.4	86%	0.86	82%	0.819	S	S	*	*			trans	-102.3	139.3	171	-83.3	179.6	167.9	-175.6	-3	109.4
24	V	28.4	Very low	29.6	Very low	142 Å²	142	137.6 Å²	137.6	86%	0.861	82%	0.819	S	S	*	*			trans	-142	145.5	142.5	-176.6	0	0	0	0	108.8
25	T	30.8	Very low	30.1	Very low	138 Å²	138	139.4 Å²	139.4	85%	0.847	82%	0.824	S	S	*	*			trans	-89	145.9	-178.7	47	0	0	0	0	113.1
26	G	26.4	Very low	30.3	Very low	79 Å²	79	137.1 Å²	137.1	81%	0.814	82%	0.823	S	S	*	*			trans	-170.3	135.7	167.3	0	0	0	0	0	111.9
27	A	29.8	Very low	30.5	Very low	113 Å²	113	144 Å²	144	93%	0.934	83%	0.832	S	S	*	*			trans	-87.9	152	-176.6	0	0	0	0	0	112.6
28	G	26.6	Very low	30.8	Very low	75 Å²	75	149.6 Å²	149.6	77%	0.773	84%	0.837	S	S	*	*			trans	174.8	111.7	172.5	0	0	0	0	0	114.9
29	C	29.5	Very low	30.7	Very low	136 Å²	136	147.3 Å²	147.3	92%	0.919	84%	0.839	S	S	*	*			trans	7.5	138.7	162	-62.5	0	0	0	0	122
30	A	38.9	Very low	31.2	Very low	108 Å²	108	148.4 Å²	148.4	89%	0.893	84%	0.842	S	S	*	*			trans	-65.5	132.9	172.5	0	0	0	0	0	113.4
31	G	29.4	Very low	32.1	Very low	78 Å²	78	147.1 Å²	147.1	80%	0.804	83%	0.834	S	S	*	*			trans	-118	101.8	166.3	0	0	0	0	0	110.9
32	K	35.3	Very low	32.6	Very low	201 Å²	201	146.4 Å²	146.4	87%	0.874	84%	0.841	S	S	*	*			trans	-84	123.4	161.1	-75.3	-176.4	177.4	179.6	0	107.7	P34	K32-P34 WeakPolarHBondContact O-CD 3.3Å
33	T	33.8	Very low	33.6	Very low	137 Å²	137	146.1 Å²	146.1	84%	0.84	84%	0.835	S	S	*	*			trans	-56.7	124.7	172.3	7.5	0	0	0	0	109.9	Q35	T33-Q35 PolarHBondContact O-N 2.71Å; T33-Q35 VanDerWaalsContact O-N 3.15Å
34	P	33.3	Very low	35.3	Very low	119 Å²	119	139.6 Å²	139.6	77%	0.773	83%	0.83	S	S	*	*			trans	-66.4	114.6	172.1	-18.2	32	0	0	0	109.1	K32 E36	K32-P34 WeakPolarHBondContact O-CD 3.3Å; P34-E36 PolarHBondContact O-N 3.45Å
35	Q	35.9	Very low	38.2	Very low	184 Å²	184	137.6 Å²	137.6	86%	0.86	83%	0.828	S	S	*	*			trans	-65.3	115.3	167.4	-171.6	171.6	6.2	0	0	107.3	T33 R37	T33-Q35 PolarHBondContact O-N 2.71Å; T33-Q35 VanDerWaalsContact O-N 3.15Å; Q35-R37 PolarHBondContact O-N 3.21Å
36	E	31.6	Very low	41.2	Very low	183 Å²	183	134.2 Å²	134.2	86%	0.855	81%	0.805	S	S	*	*			trans	-54.2	106.9	-177.3	-68.5	-179.9	151.2	0	0	110.1	P34 R38	P34-E36 PolarHBondContact O-N 3.45Å; E36-R38 PolarHBondContact O-N 3.38Å
37	R	34	Very low	44.6	Very low	222 Å²	222	135.4 Å²	135.4	84%	0.838	79%	0.787	S	S	*	*			trans	-68.1	117.8	160.8	-65.6	-174.6	-170.7	-155.2	2.4	105.4	Q35 D39	Q35-R37 PolarHBondContact O-N 3.21Å; R37-D39 PolarHBondContact O-N 3.06Å
38	R	35.3	Very low	47.8	Very low	229 Å²	229	135.6 Å²	135.6	86%	0.864	77%	0.767	S	S	*	*			trans	-64	98	157.4	-69.8	-179.1	177.9	-177.9	-2.3	105.8	E36 F40	E36-R38 PolarHBondContact O-N 3.38Å; R38-F40 PolarHBondContact O-N 2.94Å; R38-F40 VanDerWaalsContact O-N 3.08Å
39	D	27.9	Very low	51.2	Low	149 Å²	149	132.2 Å²	132.2	80%	0.797	73%	0.732	S	S	*	*			trans	-58.4	115.1	165.4	-79.5	-31	0	0	0	106.6	R37 S41	R37-D39 PolarHBondContact O-N 3.06Å; D39-S41 PolarHBondContact O-N 3.31Å
40	F	41	Very low	54.5	Low	172 Å²	172	127.3 Å²	127.3	75%	0.754	70%	0.698	S	S	*	*			trans	-58.4	131.2	168	-81.9	-106.2	0	0	0	106.9	R38 A42	R38-F40 PolarHBondContact O-N 2.94Å; R38-F40 VanDerWaalsContact O-N 3.08Å; F40-A42 PolarHBondContact O-N 2.87Å
41	S	43.3	Very low	57.3	Low	104 Å²	104	122.3 Å²	122.3	73%	0.727	66%	0.656	S	S	*	*			trans	-46	133.3	168.3	50.4	0	0	0	0	109.1	D39 E43	D39-S41 PolarHBondContact O-N 3.31Å; S41-E43 PolarHBondContact O-N 3.38Å
42	A	39.4	Very low	60.6	Low	106 Å²	106	119.6 Å²	119.6	88%	0.876	62%	0.622	S	S	*	*			trans	-46.5	104.4	-176	0	0	0	0	0	111.3	F40 A44	F40-A42 PolarHBondContact O-N 2.87Å; A42-A44 PolarHBondContact O-N 3.26Å; A42-A44 VanDerWaalsContact O-N 3.12Å
43	E	47.4	Very low	63.7	Low	166 Å²	166	114 Å²	114	78%	0.776	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-62.6	116.3	179.8	-77.5	-180	148.4	0	0	108.2	S41 A45	S41-E43 PolarHBondContact O-N 3.38Å; E43-A45 PolarHBondContact O-N 3.2Å
44	A	62.7	Low	66.7	Low	90 Å²	90	108.1 Å²	108.1	74%	0.744	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-60.2	124.9	170.8	0	0	0	0	0	108.3	A42 L46	A42-A44 PolarHBondContact O-N 3.26Å; A42-A44 VanDerWaalsContact O-N 3.12Å; A44-L46 PolarHBondContact O-N 3.15Å
45	A	89.1	Confident	69.9	Low	101 Å²	101	102.5 Å²	102.5	84%	0.835	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-58.6	124.1	-176.4	0	0	0	0	0	110.8	E43 K47	E43-A45 PolarHBondContact O-N 3.2Å; A45-K47 PolarHBondContact O-N 3.15Å
46	L	95.7	Very high	72.8	Confident	66 Å²	66	100.5 Å²	100.5	35%	0.346	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-53.9	136.4	-176.4	-63.1	179	0	0	0	112.1	A44 E64	A44-L46 PolarHBondContact O-N 3.15Å; L46-E64 HydrophobicContact CD1-CB 4.07Å; L46-E64 HydrophobicContact CD2-CB 4.15Å; L46-E64 HydrophobicContact CD2-CG 3.78Å
47	K	96.4	Very high	76	Confident	105 Å²	105	98.3 Å²	98.3	46%	0.457	51%	0.507	S	S	.	.	B	Isolated β-bridge	trans	-60	148.8	173.4	-63.9	177	-177.6	173.2	0	110	A45 G67 W68 S69	A45-K47 PolarHBondContact O-N 3.15Å; K47-G67 PolarHBondContact N-O 3.42Å; K47-W68 HydrophobicContact CB-CD2 3.46Å; K47-W68 VanDerWaalsContact CB-CD2 3.46Å; K47-W68 HydrophobicContact CB-CE3 3.46Å; K47-W68 VanDerWaalsContact CB-CE3 3.46Å; K47-W68 HydrophobicContact CB-CG 3.95Å; K47-W68 HydrophobicContact CB-CH2 4.25Å; K47-W68 HydrophobicContact CB-CZ2 4.26Å; K47-W68 HydrophobicContact CB-CZ3 3.87Å; K47-W68 HydrophobicContact CD-CD2 4.25Å; K47-W68 HydrophobicContact CD-CH2 4.49Å; K47-W68 HydrophobicContact CD-CZ2 3.9Å; K47-W68 HydrophobicContact CG-CD2 4.48Å; K47-W68 CarbonylContact O-C 3.53Å; K47-W68 WeakPolarHBondContact O-CA 3.32Å; K47-S69 PolarHBondContact O-N 3.02Å
48	K	97.8	Very high	79.1	Confident	116 Å²	116	90.3 Å²	90.3	50%	0.504	48%	0.481	S	S	.	.			trans	-125.7	129.4	-176.1	-67.5	178.1	179.1	-179.8	0	111	F52	K48-F52 HydrophobicContact CB-CB 3.98Å; K48-F52 HydrophobicContact CB-CD2 4.28Å; K48-F52 HydrophobicContact CB-CG 4.1Å; K48-F52 HydrophobicContact CD-CB 4.47Å; K48-F52 HydrophobicContact CD-CD1 3.77Å; K48-F52 HydrophobicContact CD-CD2 4.01Å; K48-F52 HydrophobicContact CD-CE1 3.94Å; K48-F52 HydrophobicContact CD-CE2 4.17Å; K48-F52 HydrophobicContact CD-CG 3.81Å; K48-F52 HydrophobicContact CD-CZ 4.13Å; K48-F52 HydrophobicContact CG-CB 4.34Å; K48-F52 HydrophobicContact CG-CD1 4.36Å; K48-F52 HydrophobicContact CG-CD2 3.76Å; K48-F52 HydrophobicContact CG-CE2 4.14Å; K48-F52 HydrophobicContact CG-CG 3.88Å
49	T	98.1	Very high	82.1	Confident	5 Å²	5	80.9 Å²	80.9	3%	0.031	46%	0.455	C	S	.	.			trans	-71.3	162.3	170.2	65.3	0	0	0	0	110.3	L51 F52 W68 M70 D93 H96	T49-L51 PolarHBondContact O-N 3.46Å; T49-L51 VanDerWaalsContact O-N 3.13Å; T49-F52 WeakPolarHBondContact O-CB 3.21Å; T49-F52 PolarHBondContact O-N 2.87Å; T49-W68 HydrophobicContact CG2-CE3 3.91Å; T49-W68 HydrophobicContact CG2-CZ3 4.1Å; T49-M70 HydrophobicContact CG2-CE 4.2Å; T49-M70 HydrophobicContact CG2-SD 3.62Å; T49-D93 WeakPolarHBondContact CB-OD2 3.47Å; T49-D93 WeakPolarHBondContact CG2-OD2 3.25Å; T49-D93 PolarHBondContact OG1-OD2 2.96Å; T49-H96 HydrophobicContact CG2-CB 4.43Å
50	P	98.3	Very high	85.4	Confident	33 Å²	33	74.4 Å²	74.4	21%	0.214	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-22.6	174.2	-22.2	33.1	0	0	0	113.5	A191 R250 V253	P50-A191 HydrophobicContact CG-CB 4.16Å; P50-R250 HydrophobicContact CB-CG 4.29Å; P50-R250 HydrophobicContact CG-CG 3.51Å; P50-V253 HydrophobicContact CB-CG1 3.65Å; P50-V253 HydrophobicContact CG-CG1 4.29Å
51	L	98.6	Very high	88.1	Confident	2 Å²	2	71.5 Å²	71.5	1%	0.01	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	5.2	178.6	-64.7	174.7	0	0	0	113.6	T49 D53 F54 H55 D93 I193 V253 V254 A257	T49-L51 PolarHBondContact O-N 3.46Å; T49-L51 VanDerWaalsContact O-N 3.13Å; L51-D53 PolarHBondContact O-N 3.33Å; L51-F54 HydrophobicContact CB-CB 4.41Å; L51-F54 HydrophobicContact CB-CD1 4.39Å; L51-F54 HydrophobicContact CD2-CB 4.18Å; L51-F54 HydrophobicContact CD2-CD1 4.05Å; L51-F54 HydrophobicContact CD2-CG 4.12Å; L51-F54 CarbonylContact O-C 3.49Å; L51-F54 WeakPolarHBondContact O-CA 3.48Å; L51-F54 WeakPolarHBondContact O-CB 3.49Å; L51-F54 PolarHBondContact O-N 3.26Å; L51-F54 VanDerWaalsContact O-N 3.11Å; L51-H55 VanDerWaalsContact CB-CE1 3.47Å; L51-H55 WeakPolarHBondContact CB-CE1 3.43Å; L51-H55 WeakPolarHBondContact CB-NE2 3.4Å; L51-H55 PolarHBondContact O-CD2 3.05Å; L51-H55 VanDerWaalsContact O-CD2 3.22Å; L51-H55 PolarHBondContact O-N 3.22Å; L51-D93 HydrophobicContact CD1-CB 3.92Å; L51-I193 HydrophobicContact CD1-CG2 3.78Å; L51-V253 HydrophobicContact CD1-CG2 4.16Å; L51-V253 HydrophobicContact CD2-CG1 3.98Å; L51-V253 HydrophobicContact CD2-CG2 4.33Å; L51-V253 HydrophobicContact CG-CG1 4.06Å; L51-V253 HydrophobicContact CG-CG2 4.33Å; L51-V254 HydrophobicContact CD2-CB 4.5Å; L51-V254 HydrophobicContact CD2-CG2 3.99Å; L51-A257 HydrophobicContact CD2-CB 3.97Å
52	F	98.6	Very high	90.8	Very high	22 Å²	22	68.9 Å²	68.9	10%	0.096	39%	0.387	C	S	.	.	H	α-helix	trans	-51.5	-51	-175.8	171.6	-94.7	0	0	0	114.2	K48 T49 H55 R56 M62	K48-F52 HydrophobicContact CB-CB 3.98Å; K48-F52 HydrophobicContact CB-CD2 4.28Å; K48-F52 HydrophobicContact CB-CG 4.1Å; K48-F52 HydrophobicContact CD-CB 4.47Å; K48-F52 HydrophobicContact CD-CD1 3.77Å; K48-F52 HydrophobicContact CD-CD2 4.01Å; K48-F52 HydrophobicContact CD-CE1 3.94Å; K48-F52 HydrophobicContact CD-CE2 4.17Å; K48-F52 HydrophobicContact CD-CG 3.81Å; K48-F52 HydrophobicContact CD-CZ 4.13Å; K48-F52 HydrophobicContact CG-CB 4.34Å; K48-F52 HydrophobicContact CG-CD1 4.36Å; K48-F52 HydrophobicContact CG-CD2 3.76Å; K48-F52 HydrophobicContact CG-CE2 4.14Å; K48-F52 HydrophobicContact CG-CG 3.88Å; T49-F52 WeakPolarHBondContact O-CB 3.21Å; T49-F52 PolarHBondContact O-N 2.87Å; F52-H55 PolarHBondContact O-N 2.89Å; F52-R56 VanDerWaalsContact CE1-CD 3.49Å; F52-R56 WeakPolarHBondContact O-CG 3.26Å; F52-R56 PolarHBondContact O-N 3.48Å; F52-M62 HydrophobicContact CD2-CE 3.91Å; F52-M62 HydrophobicContact CE2-CE 4.22Å
53	D	98.5	Very high	93.5	Very high	82 Å²	82	66.4 Å²	66.4	44%	0.439	36%	0.361	S	S	.	.	H	α-helix	trans	-77.4	-28.5	179.2	-71.9	-51.7	0	0	0	112.3	L51 H55 R56 N57	L51-D53 PolarHBondContact O-N 3.33Å; D53-H55 VanDerWaalsContact C-N 3.32Å; D53-H55 PolarHBondContact O-N 3.08Å; D53-R56 PolarHBondContact O-N 2.75Å; D53-R56 IonicContact OD1-CZ 3.91Å; D53-R56 IonicContact OD1-NH1 2.67Å; D53-R56 PolarHBondContact OD1-NH1 2.69Å; D53-N57 WeakPolarHBondContact O-CB 3.34Å; D53-N57 PolarHBondContact O-N 2.9Å; D53-N57 PolarHBondContact O-ND2 3.35Å
54	F	98.7	Very high	95.9	Very high	14 Å²	14	65 Å²	65	6%	0.061	35%	0.354	C	S	.	.	H	α-helix	trans	-58.9	-43	169.2	171.8	-89.6	0	0	0	111.2	L51 N57 N58 V254 A257 E258 L261 L268	L51-F54 HydrophobicContact CB-CB 4.41Å; L51-F54 HydrophobicContact CB-CD1 4.39Å; L51-F54 HydrophobicContact CD2-CB 4.18Å; L51-F54 HydrophobicContact CD2-CD1 4.05Å; L51-F54 HydrophobicContact CD2-CG 4.12Å; L51-F54 CarbonylContact O-C 3.49Å; L51-F54 WeakPolarHBondContact O-CA 3.48Å; L51-F54 WeakPolarHBondContact O-CB 3.49Å; L51-F54 PolarHBondContact O-N 3.26Å; L51-F54 VanDerWaalsContact O-N 3.11Å; F54-N57 PolarHBondContact O-N 2.81Å; F54-N58 WeakPolarHBondContact CE2-ND2 3.45Å; F54-N58 WeakPolarHBondContact O-CB 3.33Å; F54-N58 PolarHBondContact O-N 3.01Å; F54-N58 PolarHBondContact O-ND2 3.07Å; F54-V254 HydrophobicContact CD2-CG1 4.35Å; F54-A257 HydrophobicContact CE1-CB 4.12Å; F54-A257 HydrophobicContact CE2-CB 4.24Å; F54-A257 HydrophobicContact CZ-CB 3.85Å; F54-E258 HydrophobicContact CD2-CG 4.09Å; F54-E258 HydrophobicContact CE2-CG 3.66Å; F54-L261 HydrophobicContact CE2-CD2 4.47Å; F54-L261 HydrophobicContact CZ-CD2 3.88Å; F54-L268 HydrophobicContact CD1-CD1 4.46Å; F54-L268 HydrophobicContact CE1-CD1 3.65Å; F54-L268 HydrophobicContact CE1-CD2 3.85Å; F54-L268 HydrophobicContact CE1-CG 4.41Å; F54-L268 HydrophobicContact CZ-CD1 4.16Å; F54-L268 HydrophobicContact CZ-CD2 4.17Å
55	H	98.7	Very high	97.4	Very high	2 Å²	2	64.4 Å²	64.4	1%	0.009	34%	0.335	C	S	.	.	H	α-helix	trans	-61.1	-47.9	175.6	-62.4	-30.8	0	0	0	111.5	L51 F52 D53 N57 N58 G59 G60 M62 P71 Y74 D93	L51-H55 VanDerWaalsContact CB-CE1 3.47Å; L51-H55 WeakPolarHBondContact CB-CE1 3.43Å; L51-H55 WeakPolarHBondContact CB-NE2 3.4Å; L51-H55 PolarHBondContact O-CD2 3.05Å; L51-H55 VanDerWaalsContact O-CD2 3.22Å; L51-H55 PolarHBondContact O-N 3.22Å; F52-H55 PolarHBondContact O-N 2.89Å; D53-H55 VanDerWaalsContact C-N 3.32Å; D53-H55 PolarHBondContact O-N 3.08Å; H55-N57 PolarHBondContact O-N 2.89Å; H55-N58 CarbonylContact O-C 3.54Å; H55-N58 PolarHBondContact O-N 3.34Å; H55-G59 PolarHBondContact O-N 2.81Å; H55-G60 WeakPolarHBondContact O-CA 3.36Å; H55-G60 PolarHBondContact O-N 3.19Å; H55-M62 HydrophobicContact CB-CE 4.09Å; H55-M62 HydrophobicContact CB-SD 3.82Å; H55-P71 HydrophobicContact CB-CG 4.41Å; H55-Y74 HydrophobicContact CB-CE1 4.43Å; H55-Y74 PolarHBondContact ND1-OH 3.47Å; H55-D93 IonicContact CD2-OD2 3.83Å; H55-D93 VanDerWaalsContact CE1-CB 3.46Å; H55-D93 WeakPolarHBondContact CE1-CB 3.39Å; H55-D93 IonicContact CE1-OD2 3.18Å; H55-D93 WeakPolarHBondContact NE2-CB 3.43Å; H55-D93 IonicContact NE2-OD2 2.7Å; H55-D93 PolarHBondContact NE2-OD2 3.21Å
56	R	98.4	Very high	97.6	Very high	141 Å²	141	61.9 Å²	61.9	53%	0.532	31%	0.314	S	S	.	.	H	α-helix	trans	-61.1	-45.2	179.5	-69.1	175.5	66.2	-140.3	1.2	111.8	F52 D53 N58 G59 M62	F52-R56 VanDerWaalsContact CE1-CD 3.49Å; F52-R56 WeakPolarHBondContact O-CG 3.26Å; F52-R56 PolarHBondContact O-N 3.48Å; D53-R56 PolarHBondContact O-N 2.75Å; D53-R56 IonicContact OD1-CZ 3.91Å; D53-R56 IonicContact OD1-NH1 2.67Å; D53-R56 PolarHBondContact OD1-NH1 2.69Å; R56-N58 VanDerWaalsContact C-N 3.26Å; R56-N58 PolarHBondContact O-N 2.87Å; R56-G59 PolarHBondContact O-N 2.89Å; R56-M62 HydrophobicContact CG-CG 4.06Å; R56-M62 HydrophobicContact CG-SD 4.43Å
57	N	98.3	Very high	97.5	Very high	137 Å²	137	60 Å²	60	73%	0.733	31%	0.311	S	S	*	.	H	α-helix	trans	-63.7	-32	178.3	-67.9	-14.2	0	0	0	112.2	D53 F54 H55 G59	D53-N57 WeakPolarHBondContact O-CB 3.34Å; D53-N57 PolarHBondContact O-N 2.9Å; D53-N57 PolarHBondContact O-ND2 3.35Å; F54-N57 PolarHBondContact O-N 2.81Å; H55-N57 PolarHBondContact O-N 2.89Å; N57-G59 VanDerWaalsContact C-N 3.3Å; N57-G59 PolarHBondContact O-N 3.4Å
58	N	98.3	Very high	97.6	Very high	55 Å²	55	56.8 Å²	56.8	29%	0.294	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	7.1	174	-73.6	-77	0	0	0	114.3	F54 H55 R56 Y74 L268	F54-N58 WeakPolarHBondContact CE2-ND2 3.45Å; F54-N58 WeakPolarHBondContact O-CB 3.33Å; F54-N58 PolarHBondContact O-N 3.01Å; F54-N58 PolarHBondContact O-ND2 3.07Å; H55-N58 CarbonylContact O-C 3.54Å; H55-N58 PolarHBondContact O-N 3.34Å; R56-N58 VanDerWaalsContact C-N 3.26Å; R56-N58 PolarHBondContact O-N 2.87Å; N58-Y74 HydrophobicContact CB-CD1 4.41Å; N58-Y74 HydrophobicContact CB-CE1 4.36Å; N58-L268 HydrophobicContact CB-CD1 3.54Å
59	G	98.1	Very high	97.6	Very high	31 Å²	31	52 Å²	52	32%	0.32	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.2	25.8	176.9	0	0	0	0	0	114.7	H55 R56 N57 Y74	H55-G59 PolarHBondContact O-N 2.81Å; R56-G59 PolarHBondContact O-N 2.89Å; N57-G59 VanDerWaalsContact C-N 3.3Å; N57-G59 PolarHBondContact O-N 3.4Å; G59-Y74 WeakPolarHBondContact O-CA 3.35Å
60	G	98.4	Very high	97.6	Very high	12 Å²	12	51.8 Å²	51.8	12%	0.124	28%	0.275	C	S	.	.			trans	-64.8	128.5	174.3	0	0	0	0	0	112.1	H55 M62 Y74	H55-G60 WeakPolarHBondContact O-CA 3.36Å; H55-G60 PolarHBondContact O-N 3.19Å; G60-M62 PolarHBondContact O-N 2.8Å; G60-Y74 VanDerWaalsContact CA-CD1 3.43Å
61	K	98.3	Very high	97.6	Very high	112 Å²	112	50.4 Å²	50.4	49%	0.487	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	97	174.8	-61	-175.6	-168.3	165.4	0	108.4	P71 V72 Q73	K61-P71 WeakPolarHBondContact O-CA 3.26Å; K61-V72 HydrophobicContact CB-CG1 4.19Å; K61-V72 PolarHBondContact O-N 2.85Å; K61-Q73 HydrophobicContact CB-CG 4.37Å; K61-Q73 HydrophobicContact CD-CG 3.82Å; K61-Q73 HydrophobicContact CG-CG 4.33Å; K61-Q73 PolarHBondContact N-O 2.91Å
62	M	98.3	Very high	97.6	Very high	48 Å²	48	52.8 Å²	52.8	24%	0.236	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	135.6	-174.1	-48.5	-51.7	-72.2	0	0	111.3	F52 H55 R56 G60 S69 M70 P71	F52-M62 HydrophobicContact CD2-CE 3.91Å; F52-M62 HydrophobicContact CE2-CE 4.22Å; H55-M62 HydrophobicContact CB-CE 4.09Å; H55-M62 HydrophobicContact CB-SD 3.82Å; R56-M62 HydrophobicContact CG-CG 4.06Å; R56-M62 HydrophobicContact CG-SD 4.43Å; G60-M62 PolarHBondContact O-N 2.8Å; M62-S69 WeakPolarHBondContact CE-O 3.42Å; M62-M70 CarbonylContact C-O 3.59Å; M62-M70 WeakPolarHBondContact CA-O 3.45Å; M62-P71 HydrophobicContact SD-CB 4.01Å
63	V	97.8	Very high	97.5	Very high	55 Å²	55	53.6 Å²	53.6	33%	0.333	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	165.9	174.9	-59.6	0	0	0	0	109.9	S69 M70 V72 L271	V63-S69 WeakPolarHBondContact O-CA 3.38Å; V63-M70 PolarHBondContact N-O 3.41Å; V63-M70 PolarHBondContact O-N 3.14Å; V63-V72 HydrophobicContact CG1-CB 3.99Å; V63-V72 HydrophobicContact CG1-CG1 3.84Å; V63-V72 HydrophobicContact CG2-CB 3.82Å; V63-L271 HydrophobicContact CG2-CD1 4.23Å
64	E	97.1	Very high	97.5	Very high	136 Å²	136	50.5 Å²	50.5	64%	0.636	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.2	134.5	163.1	-179.3	-176.3	-179.4	0	0	110.6	L46 W68	L46-E64 HydrophobicContact CD1-CB 4.07Å; L46-E64 HydrophobicContact CD2-CB 4.15Å; L46-E64 HydrophobicContact CD2-CG 3.78Å; E64-W68 CarbonylContact C-O 3.57Å; E64-W68 WeakPolarHBondContact CA-O 3.34Å
65	F	95.1	Very high	97.4	Very high	78 Å²	78	58.2 Å²	58.2	34%	0.342	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	115.8	164.7	-178.1	-102.5	0	0	0	109.3	G67 W68 M70 H96 L271	F65-G67 VanDerWaalsContact C-N 3.26Å; F65-G67 PolarHBondContact O-N 3.22Å; F65-W68 PolarHBondContact N-O 3.5Å; F65-W68 WeakPolarHBondContact O-CB 3.26Å; F65-W68 PolarHBondContact O-N 3.01Å; F65-M70 HydrophobicContact CB-CB 4.16Å; F65-M70 HydrophobicContact CB-CG 4.14Å; F65-M70 HydrophobicContact CD1-CG 4.48Å; F65-H96 AromaticContact CD1-CD2 3.86Å; F65-H96 AromaticContact CD1-NE2 3.67Å; F65-H96 AromaticContact CE1-CD2 3.86Å; F65-H96 AromaticContact CE1-NE2 3.45Å; F65-H96 WeakPolarHBondContact CE1-NE2 3.32Å; F65-L271 HydrophobicContact CB-CD1 3.55Å; F65-L271 HydrophobicContact CD1-CD1 4.24Å; F65-L271 HydrophobicContact CD1-CD2 4.13Å; F65-L271 HydrophobicContact CD2-CD1 3.78Å; F65-L271 HydrophobicContact CD2-CD2 4.46Å; F65-L271 HydrophobicContact CE1-CD2 4.23Å; F65-L271 HydrophobicContact CG-CD1 3.59Å; F65-L271 HydrophobicContact CG-CD2 4.24Å; F65-L271 HydrophobicContact CZ-CD2 4.45Å
66	A	92	Very high	97.2	Very high	47 Å²	47	61.2 Å²	61.2	39%	0.388	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.1	39.1	-178.4	0	0	0	0	0	114.3	W68 A159	A66-W68 VanDerWaalsContact C-N 3.27Å; A66-W68 VanDerWaalsContact O-CD1 3.27Å; A66-W68 PolarHBondContact O-N 3.22Å; A66-A159 HydrophobicContact CB-CB 4.37Å
67	G	94.3	Very high	97.1	Very high	27 Å²	27	57.1 Å²	57.1	28%	0.278	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.7	5.8	-176	0	0	0	0	0	115.6	K47 F65	K47-G67 PolarHBondContact N-O 3.42Å; F65-G67 VanDerWaalsContact C-N 3.26Å; F65-G67 PolarHBondContact O-N 3.22Å
68	W	97.5	Very high	97	Very high	38 Å²	38	54.4 Å²	54.4	14%	0.144	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	153	173.5	-63.4	81.6	0	0	0	111.9	K47 T49 E64 F65 A66 M70 H96	K47-W68 HydrophobicContact CB-CD2 3.46Å; K47-W68 VanDerWaalsContact CB-CD2 3.46Å; K47-W68 HydrophobicContact CB-CE3 3.46Å; K47-W68 VanDerWaalsContact CB-CE3 3.46Å; K47-W68 HydrophobicContact CB-CG 3.95Å; K47-W68 HydrophobicContact CB-CH2 4.25Å; K47-W68 HydrophobicContact CB-CZ2 4.26Å; K47-W68 HydrophobicContact CB-CZ3 3.87Å; K47-W68 HydrophobicContact CD-CD2 4.25Å; K47-W68 HydrophobicContact CD-CH2 4.49Å; K47-W68 HydrophobicContact CD-CZ2 3.9Å; K47-W68 HydrophobicContact CG-CD2 4.48Å; K47-W68 CarbonylContact O-C 3.53Å; K47-W68 WeakPolarHBondContact O-CA 3.32Å; T49-W68 HydrophobicContact CG2-CE3 3.91Å; T49-W68 HydrophobicContact CG2-CZ3 4.1Å; E64-W68 CarbonylContact C-O 3.57Å; E64-W68 WeakPolarHBondContact CA-O 3.34Å; F65-W68 PolarHBondContact N-O 3.5Å; F65-W68 WeakPolarHBondContact O-CB 3.26Å; F65-W68 PolarHBondContact O-N 3.01Å; A66-W68 VanDerWaalsContact C-N 3.27Å; A66-W68 VanDerWaalsContact O-CD1 3.27Å; A66-W68 PolarHBondContact O-N 3.22Å; W68-M70 HydrophobicContact CB-CG 3.88Å; W68-M70 HydrophobicContact CB-SD 4.13Å; W68-H96 HydrophobicContact CB-CB 4.37Å; W68-H96 HydrophobicContact CD2-CB 3.58Å; W68-H96 HydrophobicContact CE3-CB 4.13Å; W68-H96 HydrophobicContact CG-CB 3.67Å; W68-H96 HydrophobicContact CZ2-CB 4.25Å
69	S	98.1	Very high	96.9	Very high	14 Å²	14	56 Å²	56	10%	0.098	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	101.8	170.1	-170.1	0	0	0	0	110.3	K47 M62 V63	K47-S69 PolarHBondContact O-N 3.02Å; M62-S69 WeakPolarHBondContact CE-O 3.42Å; V63-S69 WeakPolarHBondContact O-CA 3.38Å
70	M	98.4	Very high	96.9	Very high	1 Å²	1	56.5 Å²	56.5	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	149.5	-172.1	-62.8	-56.6	-62.3	0	0	112	T49 M62 V63 F65 W68 V72 D93 H96 L271	T49-M70 HydrophobicContact CG2-CE 4.2Å; T49-M70 HydrophobicContact CG2-SD 3.62Å; M62-M70 CarbonylContact C-O 3.59Å; M62-M70 WeakPolarHBondContact CA-O 3.45Å; V63-M70 PolarHBondContact N-O 3.41Å; V63-M70 PolarHBondContact O-N 3.14Å; F65-M70 HydrophobicContact CB-CB 4.16Å; F65-M70 HydrophobicContact CB-CG 4.14Å; F65-M70 HydrophobicContact CD1-CG 4.48Å; W68-M70 HydrophobicContact CB-CG 3.88Å; W68-M70 HydrophobicContact CB-SD 4.13Å; M70-V72 PolarHBondContact O-N 3.44Å; M70-D93 HydrophobicContact CE-CB 4.23Å; M70-D93 VanDerWaalsContact CE-O 3.25Å; M70-D93 WeakPolarHBondContact CE-O 3.4Å; M70-H96 VanDerWaalsContact CE-ND1 3.33Å; M70-H96 WeakPolarHBondContact CE-ND1 3Å; M70-H96 HydrophobicContact SD-CB 4.4Å; M70-L271 HydrophobicContact CB-CD1 3.87Å; M70-L271 HydrophobicContact CB-CG 4.41Å
71	P	98.3	Very high	96.9	Very high	4 Å²	4	56.4 Å²	56.4	3%	0.026	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	117	178.4	29.5	-30.9	0	0	0	111.3	H55 K61 M62 Q73 Y74 G270 L271	H55-P71 HydrophobicContact CB-CG 4.41Å; K61-P71 WeakPolarHBondContact O-CA 3.26Å; M62-P71 HydrophobicContact SD-CB 4.01Å; P71-Q73 VanDerWaalsContact C-N 3.34Å; P71-Y74 HydrophobicContact CB-CE1 4.36Å; P71-Y74 HydrophobicContact CB-CE2 4.1Å; P71-Y74 HydrophobicContact CG-CE2 4.19Å; P71-Y74 WeakPolarHBondContact CG-OH 3.39Å; P71-G270 CarbonylContact O-C 3.51Å; P71-G270 WeakPolarHBondContact O-CA 3.32Å; P71-L271 PolarHBondContact O-N 3.18Å
72	V	98.1	Very high	97	Very high	52 Å²	52	51 Å²	51	32%	0.315	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	-33.1	174.1	72	0	0	0	0	111.9	K61 V63 M70 G270 L271 G272	K61-V72 HydrophobicContact CB-CG1 4.19Å; K61-V72 PolarHBondContact O-N 2.85Å; V63-V72 HydrophobicContact CG1-CB 3.99Å; V63-V72 HydrophobicContact CG1-CG1 3.84Å; V63-V72 HydrophobicContact CG2-CB 3.82Å; M70-V72 PolarHBondContact O-N 3.44Å; V72-G270 CarbonylContact O-C 3.55Å; V72-L271 HydrophobicContact CG2-CB 4.47Å; V72-L271 PolarHBondContact O-N 3.03Å; V72-G272 PolarHBondContact O-N 2.95Å
73	Q	97.9	Very high	97	Very high	40 Å²	40	51.2 Å²	51.2	19%	0.187	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	177.4	171.6	63.6	164.7	86.8	0	0	110.2	K61 P71 D76	K61-Q73 HydrophobicContact CB-CG 4.37Å; K61-Q73 HydrophobicContact CD-CG 3.82Å; K61-Q73 HydrophobicContact CG-CG 4.33Å; K61-Q73 PolarHBondContact N-O 2.91Å; P71-Q73 VanDerWaalsContact C-N 3.34Å; Q73-D76 PolarHBondContact NE2-O 3.14Å
74	Y	98.2	Very high	97	Very high	17 Å²	17	49.4 Å²	49.4	7%	0.067	26%	0.264	C	S	.	.			trans	-112.4	-145.1	172.5	-65.3	-92.7	0	0	0	110.5	H55 N58 G59 G60 P71 L268	H55-Y74 HydrophobicContact CB-CE1 4.43Å; H55-Y74 PolarHBondContact ND1-OH 3.47Å; N58-Y74 HydrophobicContact CB-CD1 4.41Å; N58-Y74 HydrophobicContact CB-CE1 4.36Å; G59-Y74 WeakPolarHBondContact O-CA 3.35Å; G60-Y74 VanDerWaalsContact CA-CD1 3.43Å; P71-Y74 HydrophobicContact CB-CE1 4.36Å; P71-Y74 HydrophobicContact CB-CE2 4.1Å; P71-Y74 HydrophobicContact CG-CE2 4.19Å; P71-Y74 WeakPolarHBondContact CG-OH 3.39Å; Y74-L268 HydrophobicContact CD1-CB 4.21Å; Y74-L268 HydrophobicContact CD1-CD1 4.09Å; Y74-L268 HydrophobicContact CD2-CB 3.75Å; Y74-L268 WeakPolarHBondContact CD2-O 3.24Å; Y74-L268 HydrophobicContact CE1-CB 3.9Å; Y74-L268 HydrophobicContact CE1-CD1 3.49Å; Y74-L268 VanDerWaalsContact CE1-CD1 3.49Å; Y74-L268 HydrophobicContact CE1-CG 4.36Å; Y74-L268 HydrophobicContact CE2-CB 3.41Å; Y74-L268 VanDerWaalsContact CE2-CB 3.41Å; Y74-L268 HydrophobicContact CG-CB 4.14Å; Y74-L268 VanDerWaalsContact CZ-CB 3.48Å
75	K	95.3	Very high	97.1	Very high	176 Å²	176	42.9 Å²	42.9	77%	0.765	23%	0.234	S	C	*	.	S	Bend	trans	-59.1	-51.1	173.4	-64.2	178.4	-177.8	173.3	0	111.6
76	D	94.2	Very high	97.3	Very high	64 Å²	64	40.4 Å²	40.4	34%	0.342	22%	0.222	S	C	.	.	S	Bend	trans	-64.6	150.5	176.4	-72.6	-7.2	0	0	0	111.1	Q73 A80 K267	Q73-D76 PolarHBondContact NE2-O 3.14Å; D76-A80 HydrophobicContact CB-CB 4.32Å; D76-K267 IonicContact OD2-NZ 2.86Å; D76-K267 PolarHBondContact OD2-NZ 2.96Å
77	S	97.1	Very high	97.6	Very high	55 Å²	55	43.5 Å²	43.5	39%	0.385	23%	0.229	S	C	.	.			trans	-66.9	153.7	172	73.4	0	0	0	0	110.4	I79 A80 S81	S77-I79 PolarHBondContact O-N 3.08Å; S77-I79 VanDerWaalsContact O-N 3.14Å; S77-A80 PolarHBondContact O-N 3.21Å; S77-A80 VanDerWaalsContact O-N 3.08Å; S77-A80 PolarHBondContact OG-N 3.25Å; S77-A80 VanDerWaalsContact OG-N 3.13Å; S77-S81 WeakPolarHBondContact O-CB 3.28Å; S77-S81 PolarHBondContact O-N 3.4Å
78	H	95.3	Very high	97.8	Very high	80 Å²	80	45.3 Å²	45.3	37%	0.37	23%	0.23	S	C	.	.	H	α-helix	trans	-59.8	-25.4	175.6	68.6	84.6	0	0	0	112.6	H82	H78-H82 WeakPolarHBondContact O-CB 3.14Å; H78-H82 PolarHBondContact O-N 3.33Å
79	I	97.6	Very high	97.9	Very high	88 Å²	88	43.5 Å²	43.5	45%	0.451	22%	0.223	S	C	.	.	H	α-helix	trans	-69.4	-47.5	173.7	-60.4	176.8	0	0	0	110.7	S77 H82 M83 P367	S77-I79 PolarHBondContact O-N 3.08Å; S77-I79 VanDerWaalsContact O-N 3.14Å; I79-H82 WeakPolarHBondContact O-CB 3.34Å; I79-H82 PolarHBondContact O-N 2.85Å; I79-M83 WeakPolarHBondContact O-CG 3.28Å; I79-M83 PolarHBondContact O-N 2.96Å; I79-P367 HydrophobicContact CG2-CB 4.08Å; I79-P367 HydrophobicContact CG2-CG 4.19Å
80	A	98.4	Very high	97.9	Very high	43 Å²	43	42.8 Å²	42.8	36%	0.355	22%	0.218	S	C	.	.	H	α-helix	trans	-66.9	-40.1	177.6	0	0	0	0	0	111.8	D76 S77 M83 H84	D76-A80 HydrophobicContact CB-CB 4.32Å; S77-A80 PolarHBondContact O-N 3.21Å; S77-A80 VanDerWaalsContact O-N 3.08Å; S77-A80 PolarHBondContact OG-N 3.25Å; S77-A80 VanDerWaalsContact OG-N 3.13Å; A80-M83 PolarHBondContact O-N 3.06Å; A80-H84 WeakPolarHBondContact O-CB 3.33Å; A80-H84 PolarHBondContact O-N 3.47Å
81	S	98.6	Very high	97.9	Very high	9 Å²	9	43 Å²	43	6%	0.063	22%	0.219	C	C	.	.	H	α-helix	trans	-64.3	-37.6	174.5	174.4	0	0	0	0	112.5	S77 T85 A269 A273	S77-S81 WeakPolarHBondContact O-CB 3.28Å; S77-S81 PolarHBondContact O-N 3.4Å; S81-T85 PolarHBondContact O-N 3.48Å; S81-T85 VanDerWaalsContact O-N 3.1Å; S81-T85 PolarHBondContact O-OG1 2.81Å; S81-A269 WeakPolarHBondContact OG-CA 3.25Å; S81-A269 WeakPolarHBondContact OG-CB 3.5Å; S81-A273 WeakPolarHBondContact OG-CB 3.4Å
82	H	98.8	Very high	98	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.4	-52.9	171.8	177.9	121.4	0	0	0	111.3	H78 I79 H84 T85 R86 S276 L277 E280 P367	H78-H82 WeakPolarHBondContact O-CB 3.14Å; H78-H82 PolarHBondContact O-N 3.33Å; I79-H82 WeakPolarHBondContact O-CB 3.34Å; I79-H82 PolarHBondContact O-N 2.85Å; H82-H84 VanDerWaalsContact C-N 3.35Å; H82-H84 PolarHBondContact O-N 2.91Å; H82-T85 WeakPolarHBondContact O-CB 3.22Å; H82-T85 PolarHBondContact O-N 2.95Å; H82-R86 PolarHBondContact O-N 3.06Å; H82-S276 WeakPolarHBondContact ND1-CB 3.18Å; H82-S276 PolarHBondContact ND1-OG 2.75Å; H82-L277 PolarHBondContact ND1-N 3Å; H82-E280 IonicContact CE1-OE1 2.7Å; H82-E280 IonicContact CE1-OE2 3.8Å; H82-E280 PolarHBondContact CE1-OE2 3.21Å; H82-E280 IonicContact NE2-OE1 3.73Å; H82-E280 PolarHBondContact NE2-OE1 3.24Å; H82-E280 IonicContact NE2-OE2 2.73Å; H82-E280 PolarHBondContact NE2-OE2 3.35Å; H82-P367 HydrophobicContact CB-CG 4.04Å
83	M	98.8	Very high	98	Very high	52 Å²	52	41.1 Å²	41.1	26%	0.256	21%	0.207	S	C	.	.	H	α-helix	trans	-60.4	-43.6	179.4	-67.5	-55.9	-52.3	0	0	111.8	I79 A80 T85 R86 E87 P367	I79-M83 WeakPolarHBondContact O-CG 3.28Å; I79-M83 PolarHBondContact O-N 2.96Å; A80-M83 PolarHBondContact O-N 3.06Å; M83-T85 PolarHBondContact O-N 2.73Å; M83-R86 WeakPolarHBondContact O-CA 3.37Å; M83-R86 WeakPolarHBondContact O-CB 3.44Å; M83-R86 PolarHBondContact O-N 2.85Å; M83-E87 WeakPolarHBondContact CE-OE1 3.26Å; M83-E87 WeakPolarHBondContact O-CB 3.49Å; M83-E87 WeakPolarHBondContact O-CG 3.14Å; M83-E87 PolarHBondContact O-N 3.02Å; M83-P367 HydrophobicContact CG-CB 4.14Å; M83-P367 HydrophobicContact SD-CB 3.7Å
84	H	98.9	Very high	98	Very high	16 Å²	16	39.3 Å²	39.3	7%	0.074	20%	0.198	C	C	.	.	H	α-helix	trans	-55.9	-37.2	174	-172.9	97.5	0	0	0	112.4	A80 H82 R86 E87 H88 C89 E265 K267	A80-H84 WeakPolarHBondContact O-CB 3.33Å; A80-H84 PolarHBondContact O-N 3.47Å; H82-H84 VanDerWaalsContact C-N 3.35Å; H82-H84 PolarHBondContact O-N 2.91Å; H84-R86 VanDerWaalsContact C-N 3.33Å; H84-R86 PolarHBondContact O-N 2.77Å; H84-E87 PolarHBondContact O-N 2.59Å; H84-H88 AromaticContact CE1-CD2 3.77Å; H84-H88 AromaticContact CE1-CG 3.96Å; H84-H88 AromaticContact ND1-CD2 3.85Å; H84-H88 WeakPolarHBondContact O-CA 3.31Å; H84-H88 WeakPolarHBondContact O-CB 3.19Å; H84-H88 PolarHBondContact O-N 2.68Å; H84-C89 PolarHBondContact CD2-O 2.88Å; H84-C89 VanDerWaalsContact CD2-O 3.28Å; H84-C89 PolarHBondContact NE2-O 3.4Å; H84-C89 VanDerWaalsContact NE2-O 3.15Å; H84-E265 PolarHBondContact NE2-O 3.25Å; H84-K267 HydrophobicContact CB-CD 4.46Å; H84-K267 WeakPolarHBondContact ND1-CD 3.36Å; H84-K267 WeakPolarHBondContact ND1-CE 3.47Å
85	T	98.9	Very high	98.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-69.9	-30.6	177.6	-48.9	0	0	0	0	112.4	S81 H82 M83 S90 F92 Q196 G197 T239 L277	S81-T85 PolarHBondContact O-N 3.48Å; S81-T85 VanDerWaalsContact O-N 3.1Å; S81-T85 PolarHBondContact O-OG1 2.81Å; H82-T85 WeakPolarHBondContact O-CB 3.22Å; H82-T85 PolarHBondContact O-N 2.95Å; M83-T85 PolarHBondContact O-N 2.73Å; T85-S90 WeakPolarHBondContact OG1-CB 3.49Å; T85-S90 PolarHBondContact OG1-OG 2.7Å; T85-F92 HydrophobicContact CG2-CE2 4.01Å; T85-F92 HydrophobicContact CG2-CZ 4.12Å; T85-Q196 HydrophobicContact CG2-CB 4.21Å; T85-Q196 WeakPolarHBondContact CG2-O 3.33Å; T85-G197 WeakPolarHBondContact O-CA 3.4Å; T85-T239 HydrophobicContact CG2-CG2 4.44Å; T85-L277 HydrophobicContact CG2-CD1 3.65Å; T85-L277 HydrophobicContact CG2-CD2 4.39Å
86	R	98.7	Very high	98.1	Very high	25 Å²	25	30.9 Å²	30.9	9%	0.094	16%	0.163	C	C	.	.	H	α-helix	trans	-78.2	-27.1	175.5	-66.9	-81.3	-169.6	-134.2	-10.6	113	H82 M83 H84 P198 T239 E241 L277 E280	H82-R86 PolarHBondContact O-N 3.06Å; M83-R86 WeakPolarHBondContact O-CA 3.37Å; M83-R86 WeakPolarHBondContact O-CB 3.44Å; M83-R86 PolarHBondContact O-N 2.85Å; H84-R86 VanDerWaalsContact C-N 3.33Å; H84-R86 PolarHBondContact O-N 2.77Å; R86-P198 WeakPolarHBondContact O-CD 3.38Å; R86-P198 WeakPolarHBondContact O-CG 3.28Å; R86-T239 PolarHBondContact NH1-O 3.42Å; R86-E241 WeakPolarHBondContact CD-OE1 3.45Å; R86-E241 IonicContact CZ-OE1 2.75Å; R86-E241 IonicContact NE-OE1 3.79Å; R86-E241 IonicContact NH1-OE1 3.63Å; R86-E241 PolarHBondContact NH1-OE1 2.92Å; R86-L277 HydrophobicContact CG-CD2 3.96Å; R86-L277 PolarHBondContact NH2-O 3.35Å; R86-E280 IonicContact CZ-OE2 2.75Å; R86-E280 IonicContact NE-OE2 2.75Å; R86-E280 PolarHBondContact NE-OE2 2.7Å; R86-E280 IonicContact NH2-OE2 3.78Å; R86-E280 PolarHBondContact NH2-OE2 2.84Å
87	E	98.6	Very high	98.3	Very high	113 Å²	113	28.7 Å²	28.7	53%	0.528	15%	0.151	S	C	.	.	H	α-helix	trans	-100.6	-30.9	-172.8	-69.1	166.1	178.1	0	0	113	M83 H84	M83-E87 WeakPolarHBondContact CE-OE1 3.26Å; M83-E87 WeakPolarHBondContact O-CB 3.49Å; M83-E87 WeakPolarHBondContact O-CG 3.14Å; M83-E87 PolarHBondContact O-N 3.02Å; H84-E87 PolarHBondContact O-N 2.59Å
88	H	98.8	Very high	98.4	Very high	64 Å²	64	27.1 Å²	27.1	30%	0.296	14%	0.139	S	C	.	.	S	Bend	trans	-132.7	-119.3	-174.6	-60.8	-79.5	0	0	0	110.7	H84 G197 P198 T199 E265	H84-H88 AromaticContact CE1-CD2 3.77Å; H84-H88 AromaticContact CE1-CG 3.96Å; H84-H88 AromaticContact ND1-CD2 3.85Å; H84-H88 WeakPolarHBondContact O-CA 3.31Å; H84-H88 WeakPolarHBondContact O-CB 3.19Å; H84-H88 PolarHBondContact O-N 2.68Å; H88-G197 CarbonylContact O-C 3.58Å; H88-G197 VanDerWaalsContact O-CA 3.27Å; H88-G197 WeakPolarHBondContact O-CA 3.35Å; H88-P198 WeakPolarHBondContact O-CD 3.38Å; H88-P198 WeakPolarHBondContact O-CG 3.46Å; H88-T199 WeakPolarHBondContact CA-OG1 3.37Å; H88-T199 PolarHBondContact O-N 3.22Å; H88-T199 VanDerWaalsContact O-N 3.09Å; H88-T199 PolarHBondContact O-OG1 2.93Å; H88-E265 WeakPolarHBondContact CB-O 3.39Å; H88-E265 IonicContact CE1-OE2 2.79Å; H88-E265 IonicContact CG-OE2 2.67Å; H88-E265 IonicContact ND1-OE1 3.67Å; H88-E265 IonicContact ND1-OE2 2.74Å; H88-E265 PolarHBondContact ND1-OE2 3.21Å
89	C	98.7	Very high	98.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	159.7	162.4	57.3	0	0	0	0	113.1	H84 L195 Q196 T199 T200 E265 V266 K267	H84-C89 PolarHBondContact CD2-O 2.88Å; H84-C89 VanDerWaalsContact CD2-O 3.28Å; H84-C89 PolarHBondContact NE2-O 3.4Å; H84-C89 VanDerWaalsContact NE2-O 3.15Å; C89-L195 HydrophobicContact CB-CD1 4.16Å; C89-Q196 CarbonylContact C-O 3.53Å; C89-Q196 WeakPolarHBondContact CA-O 3.37Å; C89-Q196 VanDerWaalsContact CB-O 3.28Å; C89-Q196 WeakPolarHBondContact CB-O 3.24Å; C89-T199 PolarHBondContact N-OG1 3.06Å; C89-T199 PolarHBondContact SG-OG1 2.99Å; C89-T199 VanDerWaalsContact SG-OG1 3.4Å; C89-T200 WeakPolarHBondContact CB-OG1 3.33Å; C89-E265 PolarHBondContact N-O 3.07Å; C89-E265 VanDerWaalsContact O-O 3.06Å; C89-V266 WeakPolarHBondContact O-CA 3.23Å; C89-K267 PolarHBondContact O-N 2.96Å
90	S	98.9	Very high	98.6	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	144	179.9	-61.9	0	0	0	0	112.8	T85 L195 Q196 K267	T85-S90 WeakPolarHBondContact OG1-CB 3.49Å; T85-S90 PolarHBondContact OG1-OG 2.7Å; S90-L195 WeakPolarHBondContact O-CA 3.35Å; S90-Q196 PolarHBondContact N-O 3.41Å; S90-Q196 PolarHBondContact O-N 2.73Å; S90-K267 CarbonylContact C-O 3.53Å; S90-K267 WeakPolarHBondContact CA-O 3.17Å
91	I	98.9	Very high	98.6	Very high	5 Å²	5	19.1 Å²	19.1	3%	0.026	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	129	168.3	-56.1	169.1	0	0	0	109.2	I193 A194 L195 L260 L261 V266 K267 L268 A269	I91-I193 HydrophobicContact CG2-CB 4.33Å; I91-A194 CarbonylContact C-O 3.52Å; I91-A194 WeakPolarHBondContact CA-O 3.46Å; I91-L195 HydrophobicContact CG1-CD1 3.99Å; I91-L260 HydrophobicContact CD1-CB 3.69Å; I91-L260 HydrophobicContact CD1-CD1 4.35Å; I91-L260 HydrophobicContact CG1-CB 4.48Å; I91-L261 HydrophobicContact CD1-CB 4.47Å; I91-V266 HydrophobicContact CD1-CG1 3.66Å; I91-V266 HydrophobicContact CG1-CG1 3.62Å; I91-K267 PolarHBondContact N-O 3.24Å; I91-L268 HydrophobicContact CB-CD2 3.94Å; I91-L268 HydrophobicContact CD1-CD2 4.04Å; I91-L268 HydrophobicContact CG2-CD2 4.38Å; I91-A269 PolarHBondContact O-N 3.34Å
92	F	98.9	Very high	98.6	Very high	6 Å²	6	18.7 Å²	18.7	3%	0.026	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	128.9	165.9	-58.6	-100.2	0	0	0	108.8	T85 V94 I193 A194 Q196 T239 A269 A273 R274 L277	T85-F92 HydrophobicContact CG2-CE2 4.01Å; T85-F92 HydrophobicContact CG2-CZ 4.12Å; F92-V94 HydrophobicContact CB-CG1 4.2Å; F92-V94 PolarHBondContact O-N 3.16Å; F92-I193 WeakPolarHBondContact O-CA 3.46Å; F92-A194 HydrophobicContact CB-CB 4.29Å; F92-A194 PolarHBondContact N-O 2.95Å; F92-A194 PolarHBondContact O-N 3.4Å; F92-Q196 HydrophobicContact CD2-CB 4.41Å; F92-Q196 HydrophobicContact CD2-CG 4.09Å; F92-Q196 HydrophobicContact CE2-CB 4.05Å; F92-Q196 HydrophobicContact CE2-CG 4.16Å; F92-T239 HydrophobicContact CE2-CG2 4.26Å; F92-T239 HydrophobicContact CZ-CG2 4.42Å; F92-A269 HydrophobicContact CD1-CB 3.78Å; F92-A269 HydrophobicContact CD2-CB 4.37Å; F92-A269 HydrophobicContact CE1-CB 3.29Å; F92-A269 HydrophobicContact CE2-CB 3.93Å; F92-A269 HydrophobicContact CG-CB 4.3Å; F92-A269 HydrophobicContact CZ-CB 3.36Å; F92-A273 HydrophobicContact CE1-CB 4.43Å; F92-R274 HydrophobicContact CD1-CB 3.99Å; F92-R274 HydrophobicContact CD1-CG 4.5Å; F92-R274 HydrophobicContact CE1-CB 3.84Å; F92-L277 HydrophobicContact CE1-CD1 4.38Å; F92-L277 HydrophobicContact CZ-CD1 3.66Å
93	D	98.8	Very high	98.6	Very high	11 Å²	11	21.1 Å²	21.1	6%	0.059	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	117.8	165.9	175.7	18.5	0	0	0	109.4	T49 L51 H55 M70 S95	T49-D93 WeakPolarHBondContact CB-OD2 3.47Å; T49-D93 WeakPolarHBondContact CG2-OD2 3.25Å; T49-D93 PolarHBondContact OG1-OD2 2.96Å; L51-D93 HydrophobicContact CD1-CB 3.92Å; H55-D93 IonicContact CD2-OD2 3.83Å; H55-D93 VanDerWaalsContact CE1-CB 3.46Å; H55-D93 WeakPolarHBondContact CE1-CB 3.39Å; H55-D93 IonicContact CE1-OD2 3.18Å; H55-D93 WeakPolarHBondContact NE2-CB 3.43Å; H55-D93 IonicContact NE2-OD2 2.7Å; H55-D93 PolarHBondContact NE2-OD2 3.21Å; M70-D93 HydrophobicContact CE-CB 4.23Å; M70-D93 VanDerWaalsContact CE-O 3.25Å; M70-D93 WeakPolarHBondContact CE-O 3.4Å; D93-S95 WeakPolarHBondContact OD1-CB 3.46Å; D93-S95 PolarHBondContact OD1-N 3.41Å; D93-S95 PolarHBondContact OD1-OG 2.8Å
94	V	98.4	Very high	98.6	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.006	10%	0.097	C	C	.	.			trans	-124.1	19.9	179	-61.3	0	0	0	0	111.6	F92 H96 M97 L192 A194	F92-V94 HydrophobicContact CB-CG1 4.2Å; F92-V94 PolarHBondContact O-N 3.16Å; V94-H96 PolarHBondContact O-N 3.07Å; V94-M97 HydrophobicContact CB-CE 3.82Å; V94-M97 HydrophobicContact CB-CG 4.33Å; V94-M97 HydrophobicContact CB-SD 4.26Å; V94-M97 HydrophobicContact CG2-CE 3.81Å; V94-M97 WeakPolarHBondContact O-CB 3.39Å; V94-M97 WeakPolarHBondContact O-CG 3.45Å; V94-M97 PolarHBondContact O-N 3.47Å; V94-L192 CarbonylContact C-O 3.48Å; V94-L192 VanDerWaalsContact C-O 3.26Å; V94-L192 WeakPolarHBondContact CA-O 3.32Å; V94-L192 HydrophobicContact CG2-CB 4.05Å; V94-L192 HydrophobicContact CG2-CD2 3.91Å; V94-L192 HydrophobicContact CG2-CG 3.69Å; V94-L192 VanDerWaalsContact CG2-O 3.27Å; V94-L192 WeakPolarHBondContact CG2-O 3.29Å; V94-L192 PolarHBondContact N-O 3.04Å; V94-A194 HydrophobicContact CG2-CB 4.42Å
95	S	98.5	Very high	98.6	Very high	9 Å²	9	25.8 Å²	25.8	6%	0.063	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	1.9	179.8	-44.9	0	0	0	0	114.6	D93 L192	D93-S95 WeakPolarHBondContact OD1-CB 3.46Å; D93-S95 PolarHBondContact OD1-N 3.41Å; D93-S95 PolarHBondContact OD1-OG 2.8Å; S95-L192 PolarHBondContact N-O 2.81Å; S95-L192 PolarHBondContact OG-N 2.67Å; S95-L192 PolarHBondContact OG-O 2.85Å
96	H	96.9	Very high	98.6	Very high	7 Å²	7	27.3 Å²	27.3	3%	0.032	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-14.5	173.8	56.1	-71	0	0	0	112.2	T49 F65 W68 M70 V94 A159	T49-H96 HydrophobicContact CG2-CB 4.43Å; F65-H96 AromaticContact CD1-CD2 3.86Å; F65-H96 AromaticContact CD1-NE2 3.67Å; F65-H96 AromaticContact CE1-CD2 3.86Å; F65-H96 AromaticContact CE1-NE2 3.45Å; F65-H96 WeakPolarHBondContact CE1-NE2 3.32Å; W68-H96 HydrophobicContact CB-CB 4.37Å; W68-H96 HydrophobicContact CD2-CB 3.58Å; W68-H96 HydrophobicContact CE3-CB 4.13Å; W68-H96 HydrophobicContact CG-CB 3.67Å; W68-H96 HydrophobicContact CZ2-CB 4.25Å; M70-H96 VanDerWaalsContact CE-ND1 3.33Å; M70-H96 WeakPolarHBondContact CE-ND1 3Å; M70-H96 HydrophobicContact SD-CB 4.4Å; V94-H96 PolarHBondContact O-N 3.07Å; H96-A159 HydrophobicContact CB-CB 4.09Å; H96-A159 WeakPolarHBondContact CD2-CB 3.23Å; H96-A159 WeakPolarHBondContact O-CA 3.32Å; H96-A159 WeakPolarHBondContact O-CB 3.46Å
97	M	97.8	Very high	98.6	Very high	18 Å²	18	28.6 Å²	28.6	9%	0.089	14%	0.137	C	C	.	.	S	Bend	trans	-71.8	144.5	175.8	-59.5	-164.2	-49.2	0	0	111	V94 Q99 V156 S157 L192	V94-M97 HydrophobicContact CB-CE 3.82Å; V94-M97 HydrophobicContact CB-CG 4.33Å; V94-M97 HydrophobicContact CB-SD 4.26Å; V94-M97 HydrophobicContact CG2-CE 3.81Å; V94-M97 WeakPolarHBondContact O-CB 3.39Å; V94-M97 WeakPolarHBondContact O-CG 3.45Å; V94-M97 PolarHBondContact O-N 3.47Å; M97-Q99 PolarHBondContact O-N 2.9Å; M97-V156 HydrophobicContact CB-CG1 4.09Å; M97-V156 HydrophobicContact CE-CG1 3.75Å; M97-S157 WeakPolarHBondContact CB-O 3.41Å; M97-L192 HydrophobicContact CB-CD2 4.38Å; M97-L192 HydrophobicContact CE-CD2 3.47Å; M97-L192 VanDerWaalsContact CE-CD2 3.47Å
98	L	98.4	Very high	98.6	Very high	23 Å²	23	25 Å²	25	12%	0.12	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	127	-178.3	-178.4	65.7	0	0	0	109.8	V156 S157 A162 D165 F187	L98-V156 VanDerWaalsContact O-CA 3.28Å; L98-V156 WeakPolarHBondContact O-CA 3.49Å; L98-S157 PolarHBondContact N-O 3.43Å; L98-S157 PolarHBondContact O-N 2.82Å; L98-A162 HydrophobicContact CB-CB 3.96Å; L98-A162 HydrophobicContact CD1-CB 4.41Å; L98-A162 HydrophobicContact CD2-CB 4.46Å; L98-D165 HydrophobicContact CD2-CB 4.11Å; L98-F187 HydrophobicContact CD1-CD1 4Å; L98-F187 HydrophobicContact CD2-CD1 4.4Å; L98-F187 HydrophobicContact CD2-CE1 4.31Å
99	Q	98.8	Very high	98.6	Very high	4 Å²	4	26.9 Å²	26.9	2%	0.019	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	127.6	173.5	-69.8	165.8	87.8	0	0	110	M97 Y154 V155 V156 I188 E190 L192 S247	M97-Q99 PolarHBondContact O-N 2.9Å; Q99-Y154 HydrophobicContact CB-CE2 4.35Å; Q99-Y154 HydrophobicContact CG-CE2 4.41Å; Q99-Y154 PolarHBondContact OE1-OH 3.28Å; Q99-Y154 VanDerWaalsContact OE1-OH 3.06Å; Q99-V155 WeakPolarHBondContact CA-O 3.45Å; Q99-V156 HydrophobicContact CG-CG2 4.34Å; Q99-I188 HydrophobicContact CB-CD1 3.92Å; Q99-I188 HydrophobicContact CB-CG1 3.45Å; Q99-I188 VanDerWaalsContact CB-CG1 3.45Å; Q99-I188 PolarHBondContact O-N 3.47Å; Q99-E190 PolarHBondContact NE2-O 3.1Å; Q99-L192 HydrophobicContact CG-CD2 4.37Å; Q99-S247 PolarHBondContact OE1-OG 2.85Å
100	T	98.9	Very high	98.6	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	136.8	-178.6	-49	0	0	0	0	110.9	V155 M169 L185 E186 F187	T100-V155 PolarHBondContact N-O 2.97Å; T100-V155 PolarHBondContact O-N 2.88Å; T100-M169 HydrophobicContact CG2-CE 3.76Å; T100-L185 HydrophobicContact CG2-CD2 4.3Å; T100-E186 CarbonylContact C-O 3.56Å; T100-E186 WeakPolarHBondContact CA-O 3.25Å; T100-F187 HydrophobicContact CG2-CD1 3.91Å; T100-F187 HydrophobicContact CG2-CE1 3.93Å; T100-F187 HydrophobicContact CG2-CG 4.4Å; T100-F187 HydrophobicContact CG2-CZ 4.41Å; T100-F187 VanDerWaalsContact OG1-CD1 3.3Å; T100-F187 WeakPolarHBondContact OG1-CD1 3.33Å
101	K	98.9	Very high	98.6	Very high	39 Å²	39	26.9 Å²	26.9	17%	0.17	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	137.9	165.2	-52.2	178.5	-163.2	140.1	0	109.6	Y152 L153 E186 I188	K101-Y152 HydrophobicContact CB-CD2 3.84Å; K101-Y152 HydrophobicContact CB-CE2 4.37Å; K101-Y152 HydrophobicContact CB-CG 4.29Å; K101-Y152 HydrophobicContact CD-CD2 3.98Å; K101-Y152 HydrophobicContact CD-CE1 4.31Å; K101-Y152 HydrophobicContact CD-CE2 3.76Å; K101-Y152 HydrophobicContact CD-CG 4.37Å; K101-Y152 HydrophobicContact CG-CD2 3.83Å; K101-Y152 HydrophobicContact CG-CE2 3.82Å; K101-L153 CarbonylContact C-O 3.38Å; K101-L153 VanDerWaalsContact CA-O 3.26Å; K101-L153 WeakPolarHBondContact CA-O 3.38Å; K101-E186 HydrophobicContact CB-CB 4.25Å; K101-E186 WeakPolarHBondContact CD-OE2 3Å; K101-E186 PolarHBondContact N-O 3.26Å; K101-E186 IonicContact NZ-OE1 2.77Å; K101-E186 PolarHBondContact NZ-OE1 3.29Å; K101-E186 IonicContact NZ-OE2 3.59Å; K101-E186 PolarHBondContact O-N 2.63Å; K101-I188 HydrophobicContact CD-CG2 4.36Å; K101-I188 HydrophobicContact CG-CG2 4.3Å
102	I	98.9	Very high	98.6	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	116.6	176.8	-47	-179.9	0	0	0	108.7	R107 F110 M111 Y152 L153 V155 M169 V183 D184 L185	I102-R107 HydrophobicContact CB-CB 4.4Å; I102-R107 HydrophobicContact CG2-CB 3.75Å; I102-R107 WeakPolarHBondContact O-CD 3.39Å; I102-F110 HydrophobicContact CD1-CD1 4.19Å; I102-F110 HydrophobicContact CD1-CE1 4.08Å; I102-F110 HydrophobicContact CG2-CD1 3.77Å; I102-F110 HydrophobicContact CG2-CE1 4.18Å; I102-M111 HydrophobicContact CD1-CB 4.47Å; I102-M111 HydrophobicContact CD1-CE 4.29Å; I102-M111 HydrophobicContact CD1-SD 3.46Å; I102-M111 WeakPolarHBondContact CD1-SD 3.48Å; I102-Y152 CarbonylContact O-C 3.44Å; I102-Y152 VanDerWaalsContact O-CA 3.28Å; I102-Y152 WeakPolarHBondContact O-CA 3.33Å; I102-Y152 WeakPolarHBondContact O-CB 3.33Å; I102-L153 HydrophobicContact CB-CB 4.12Å; I102-L153 HydrophobicContact CD1-CD1 4.45Å; I102-L153 HydrophobicContact CG1-CB 4.46Å; I102-L153 PolarHBondContact N-O 3.22Å; I102-L153 PolarHBondContact O-N 2.72Å; I102-V155 HydrophobicContact CD1-CG2 3.88Å; I102-V155 HydrophobicContact CG1-CG2 4.35Å; I102-M169 HydrophobicContact CD1-CE 3.92Å; I102-M169 HydrophobicContact CG1-CE 4.19Å; I102-V183 HydrophobicContact CG2-CG2 3.84Å; I102-D184 WeakPolarHBondContact CA-O 3.09Å; I102-L185 HydrophobicContact CB-CD2 4.26Å; I102-L185 HydrophobicContact CD1-CD2 4.37Å; I102-L185 HydrophobicContact CG1-CD2 3.77Å; I102-L185 HydrophobicContact CG2-CD2 4.01Å
103	H	98.8	Very high	98.6	Very high	51 Å²	51	28 Å²	28	24%	0.236	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	176.3	-173	-63.9	-72	0	0	0	112.2	Y152 V183 D184 E186	H103-Y152 WeakPolarHBondContact ND1-CB 3.4Å; H103-V183 VanDerWaalsContact O-CA 3.29Å; H103-V183 WeakPolarHBondContact O-CA 3.3Å; H103-D184 HydrophobicContact CB-CB 4.43Å; H103-D184 PolarHBondContact N-O 2.8Å; H103-D184 PolarHBondContact O-N 3.12Å; H103-E186 IonicContact CD2-OE2 3.64Å; H103-E186 IonicContact CE1-OE2 3.91Å; H103-E186 IonicContact NE2-OE2 2.99Å; H103-E186 PolarHBondContact NE2-OE2 2.86Å
104	G	98.5	Very high	98.6	Very high	19 Å²	19	27.4 Å²	27.4	20%	0.196	13%	0.132	C	C	.	.	S	Bend	trans	85.6	161.1	178.9	0	0	0	0	0	113.7	D106 R107 D182	G104-D106 VanDerWaalsContact C-N 3.27Å; G104-D106 PolarHBondContact O-N 2.84Å; G104-R107 WeakPolarHBondContact O-CB 3.3Å; G104-R107 VanDerWaalsContact O-CD 3.31Å; G104-R107 WeakPolarHBondContact O-CD 3.47Å; G104-R107 VanDerWaalsContact O-CG 3.24Å; G104-R107 WeakPolarHBondContact O-CG 3.49Å; G104-R107 PolarHBondContact O-N 3.01Å; G104-R107 PolarHBondContact O-NH1 2.92Å; G104-D182 CarbonylContact C-O 3.58Å; G104-D182 VanDerWaalsContact C-O 3.29Å; G104-D182 WeakPolarHBondContact CA-O 3.3Å; G104-D182 WeakPolarHBondContact CA-OD1 3.22Å
105	K	98.4	Very high	98.6	Very high	147 Å²	147	27.4 Å²	27.4	64%	0.639	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-29.8	-177.1	80.2	-159.1	179.7	-165	0	112.7	R107 D182	K105-R107 VanDerWaalsContact C-N 3.35Å; K105-D182 WeakPolarHBondContact CB-OD2 3.47Å; K105-D182 HydrophobicContact CD-CB 4.02Å; K105-D182 HydrophobicContact CG-CB 4Å; K105-D182 WeakPolarHBondContact CG-OD2 3.46Å; K105-D182 PolarHBondContact N-O 3.11Å; K105-D182 PolarHBondContact N-OD2 2.6Å
106	D	98.8	Very high	98.6	Very high	32 Å²	32	27 Å²	27	17%	0.171	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	2.6	-175.8	-64.8	-64.6	0	0	0	113.1	G104 I108 K109 F110 F181 D182	G104-D106 VanDerWaalsContact C-N 3.27Å; G104-D106 PolarHBondContact O-N 2.84Å; D106-I108 PolarHBondContact O-N 2.9Å; D106-I108 VanDerWaalsContact O-N 3.08Å; D106-K109 WeakPolarHBondContact O-CB 3.44Å; D106-K109 PolarHBondContact O-N 3.3Å; D106-F110 PolarHBondContact O-N 2.95Å; D106-F181 HydrophobicContact CB-CB 4.01Å; D106-F181 HydrophobicContact CB-CD1 4.27Å; D106-F181 HydrophobicContact CB-CG 4.49Å; D106-D182 WeakPolarHBondContact CB-O 3.37Å; D106-D182 PolarHBondContact N-O 3.29Å; D106-D182 PolarHBondContact OD2-N 2.86Å
107	R	98.8	Very high	98.7	Very high	51 Å²	51	26.8 Å²	26.8	19%	0.192	13%	0.129	C	C	.	.	H	α-helix	trans	-47.8	-37.9	-178.7	66.3	-171.4	178	-84.1	5.8	115.5	I102 G104 K105 M111 G151 L153	I102-R107 HydrophobicContact CB-CB 4.4Å; I102-R107 HydrophobicContact CG2-CB 3.75Å; I102-R107 WeakPolarHBondContact O-CD 3.39Å; G104-R107 WeakPolarHBondContact O-CB 3.3Å; G104-R107 VanDerWaalsContact O-CD 3.31Å; G104-R107 WeakPolarHBondContact O-CD 3.47Å; G104-R107 VanDerWaalsContact O-CG 3.24Å; G104-R107 WeakPolarHBondContact O-CG 3.49Å; G104-R107 PolarHBondContact O-N 3.01Å; G104-R107 PolarHBondContact O-NH1 2.92Å; K105-R107 VanDerWaalsContact C-N 3.35Å; R107-M111 WeakPolarHBondContact O-CB 2.94Å; R107-M111 PolarHBondContact O-N 3.06Å; R107-G151 WeakPolarHBondContact CD-O 3.38Å; R107-G151 PolarHBondContact NE-O 2.82Å; R107-G151 PolarHBondContact NH1-O 3.36Å; R107-G151 PolarHBondContact NH2-O 3.5Å; R107-L153 HydrophobicContact CB-CD1 4.43Å; R107-L153 HydrophobicContact CB-CG 4.36Å; R107-L153 HydrophobicContact CG-CD1 4.44Å; R107-L153 HydrophobicContact CG-CG 4.08Å; R107-L153 WeakPolarHBondContact O-CD1 3.46Å
108	I	98.8	Very high	98.7	Very high	39 Å²	39	27 Å²	27	20%	0.2	13%	0.13	C	C	.	.	H	α-helix	trans	-68.4	-49.2	178.6	-66.5	176.2	0	0	0	109.9	D106 F110 M111 E112 I119 A120 L153	D106-I108 PolarHBondContact O-N 2.9Å; D106-I108 VanDerWaalsContact O-N 3.08Å; I108-F110 VanDerWaalsContact C-N 3.32Å; I108-F110 PolarHBondContact O-N 3.33Å; I108-M111 PolarHBondContact O-N 3.24Å; I108-E112 WeakPolarHBondContact O-CB 3.27Å; I108-E112 WeakPolarHBondContact O-CG 3.46Å; I108-E112 PolarHBondContact O-N 3.48Å; I108-I119 HydrophobicContact CG1-CG2 4.46Å; I108-I119 HydrophobicContact CG2-CB 4.23Å; I108-I119 HydrophobicContact CG2-CG2 4.24Å; I108-A120 HydrophobicContact CG2-CB 3.94Å; I108-L153 HydrophobicContact CG1-CD2 4.32Å
109	K	98.7	Very high	98.8	Very high	103 Å²	103	25.9 Å²	25.9	45%	0.448	12%	0.124	S	C	.	.	H	α-helix	trans	-62.2	-40.6	178.1	-176.6	-176.2	172.6	-175.9	0	111.6	D106 S113 Y176 F181	D106-K109 WeakPolarHBondContact O-CB 3.44Å; D106-K109 PolarHBondContact O-N 3.3Å; K109-S113 PolarHBondContact O-N 3Å; K109-S113 VanDerWaalsContact O-N 3.15Å; K109-Y176 HydrophobicContact CD-CE1 4.5Å; K109-Y176 HydrophobicContact CG-CE1 4.23Å; K109-Y176 PolarHBondContact O-OH 2.89Å; K109-F181 HydrophobicContact CD-CE1 4.38Å
110	F	98.9	Very high	98.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-57.8	-54.4	173	170.4	-94.4	0	0	0	111.7	I102 D106 I108 E112 S113 L114 M169 R172 L173 Y176 V183 L185	I102-F110 HydrophobicContact CD1-CD1 4.19Å; I102-F110 HydrophobicContact CD1-CE1 4.08Å; I102-F110 HydrophobicContact CG2-CD1 3.77Å; I102-F110 HydrophobicContact CG2-CE1 4.18Å; D106-F110 PolarHBondContact O-N 2.95Å; I108-F110 VanDerWaalsContact C-N 3.32Å; I108-F110 PolarHBondContact O-N 3.33Å; F110-E112 VanDerWaalsContact C-N 3.35Å; F110-E112 PolarHBondContact O-N 2.92Å; F110-S113 WeakPolarHBondContact O-CB 3.49Å; F110-S113 PolarHBondContact O-N 3.47Å; F110-S113 VanDerWaalsContact O-N 3.16Å; F110-S113 PolarHBondContact O-OG 2.8Å; F110-L114 HydrophobicContact CE1-CD1 3.87Å; F110-L114 HydrophobicContact CE2-CD1 4.41Å; F110-L114 HydrophobicContact CZ-CD1 3.81Å; F110-M169 HydrophobicContact CE1-CE 4.49Å; F110-R172 HydrophobicContact CD2-CG 4.08Å; F110-R172 HydrophobicContact CE2-CB 3.99Å; F110-R172 HydrophobicContact CE2-CG 3.69Å; F110-R172 HydrophobicContact CZ-CG 4.46Å; F110-L173 HydrophobicContact CE2-CB 4.15Å; F110-L173 HydrophobicContact CE2-CD1 4.35Å; F110-L173 HydrophobicContact CZ-CB 4.47Å; F110-Y176 VanDerWaalsContact CA-CE1 3.49Å; F110-Y176 HydrophobicContact CB-CD1 3.94Å; F110-Y176 HydrophobicContact CB-CE1 3.87Å; F110-Y176 HydrophobicContact CD2-CD1 4.02Å; F110-Y176 HydrophobicContact CD2-CD2 4.28Å; F110-Y176 HydrophobicContact CD2-CE1 4.46Å; F110-Y176 AromaticContact CD2-CG 3.93Å; F110-Y176 HydrophobicContact CD2-CG 3.93Å; F110-V183 HydrophobicContact CB-CB 4.41Å; F110-V183 HydrophobicContact CB-CG1 4.47Å; F110-V183 HydrophobicContact CB-CG2 3.84Å; F110-V183 HydrophobicContact CD1-CG2 4.05Å; F110-V183 HydrophobicContact CD2-CG1 4.3Å; F110-V183 HydrophobicContact CD2-CG2 4.11Å; F110-V183 HydrophobicContact CG-CG2 3.72Å; F110-L185 HydrophobicContact CE1-CD2 3.91Å; F110-L185 HydrophobicContact CZ-CD1 4.28Å; F110-L185 HydrophobicContact CZ-CD2 4.2Å
111	M	98.8	Very high	98.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.7	-45.3	-179	-174.3	81.3	-86.1	0	0	111.4	I102 R107 I108 S113 L114 V115 I119 F132 L143 V145 L153 V155	I102-M111 HydrophobicContact CD1-CB 4.47Å; I102-M111 HydrophobicContact CD1-CE 4.29Å; I102-M111 HydrophobicContact CD1-SD 3.46Å; I102-M111 WeakPolarHBondContact CD1-SD 3.48Å; R107-M111 WeakPolarHBondContact O-CB 2.94Å; R107-M111 PolarHBondContact O-N 3.06Å; I108-M111 PolarHBondContact O-N 3.24Å; M111-S113 PolarHBondContact O-N 3.44Å; M111-L114 HydrophobicContact CE-CB 4.33Å; M111-L114 HydrophobicContact CE-CD1 4.29Å; M111-L114 WeakPolarHBondContact O-CB 3.46Å; M111-L114 PolarHBondContact O-N 3.44Å; M111-V115 HydrophobicContact CE-CG1 3.68Å; M111-V115 HydrophobicContact CG-CG2 4.18Å; M111-V115 WeakPolarHBondContact O-CG2 3.39Å; M111-V115 PolarHBondContact O-N 3Å; M111-V115 VanDerWaalsContact O-N 3.15Å; M111-I119 HydrophobicContact CG-CD1 4.43Å; M111-I119 HydrophobicContact CG-CG1 3.98Å; M111-I119 HydrophobicContact CG-CG2 4.4Å; M111-F132 HydrophobicContact CE-CE1 3.52Å; M111-F132 HydrophobicContact CE-CZ 3.99Å; M111-L143 HydrophobicContact CE-CD1 4.34Å; M111-V145 HydrophobicContact CG-CG2 4.12Å; M111-V145 HydrophobicContact SD-CB 4.48Å; M111-V145 HydrophobicContact SD-CG2 3.91Å; M111-L153 HydrophobicContact CB-CD1 3.6Å; M111-L153 HydrophobicContact CG-CD1 3.9Å; M111-L153 HydrophobicContact SD-CD1 4.44Å; M111-V155 HydrophobicContact SD-CG2 3.77Å
112	E	98.9	Very high	98.7	Very high	15 Å²	15	33 Å²	33	7%	0.07	17%	0.165	C	C	.	.	H	α-helix	trans	-63.4	-26.5	179	-74.9	-170.6	178	0	0	113.9	I108 F110 L114 I119 A120 R308 R309	I108-E112 WeakPolarHBondContact O-CB 3.27Å; I108-E112 WeakPolarHBondContact O-CG 3.46Å; I108-E112 PolarHBondContact O-N 3.48Å; F110-E112 VanDerWaalsContact C-N 3.35Å; F110-E112 PolarHBondContact O-N 2.92Å; E112-L114 PolarHBondContact O-N 3.23Å; E112-I119 HydrophobicContact CG-CB 3.76Å; E112-I119 HydrophobicContact CG-CG1 3.66Å; E112-I119 WeakPolarHBondContact OE1-CA 3.5Å; E112-I119 WeakPolarHBondContact OE1-CB 3.3Å; E112-I119 PolarHBondContact OE1-N 3.04Å; E112-A120 PolarHBondContact OE1-N 2.75Å; E112-R308 IonicContact OE1-CZ 2.75Å; E112-R308 IonicContact OE1-NH2 4Å; E112-R308 PolarHBondContact OE1-NH2 3.43Å; E112-R308 IonicContact OE2-CZ 3.55Å; E112-R308 VanDerWaalsContact OE2-CZ 3.31Å; E112-R308 IonicContact OE2-NH1 2.7Å; E112-R308 PolarHBondContact OE2-NH1 3.4Å; E112-R308 IonicContact OE2-NH2 2.68Å; E112-R308 PolarHBondContact OE2-NH2 3.25Å; E112-R309 PolarHBondContact O-NH1 3.05Å; E112-R309 PolarHBondContact O-NH2 3.08Å; E112-R309 IonicContact OE2-NE 3.57Å
113	S	98.7	Very high	98.7	Very high	18 Å²	18	40.4 Å²	40.4	13%	0.126	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-12	173.6	81.4	0	0	0	0	114	K109 F110 M111 R172 Y176 P316	K109-S113 PolarHBondContact O-N 3Å; K109-S113 VanDerWaalsContact O-N 3.15Å; F110-S113 WeakPolarHBondContact O-CB 3.49Å; F110-S113 PolarHBondContact O-N 3.47Å; F110-S113 VanDerWaalsContact O-N 3.16Å; F110-S113 PolarHBondContact O-OG 2.8Å; M111-S113 PolarHBondContact O-N 3.44Å; S113-R172 VanDerWaalsContact CB-NH1 3.34Å; S113-R172 PolarHBondContact O-NH1 3.23Å; S113-R172 PolarHBondContact OG-NH1 3.07Å; S113-Y176 WeakPolarHBondContact CB-OH 3.25Å; S113-P316 WeakPolarHBondContact O-CD 3.12Å; S113-P316 VanDerWaalsContact O-CG 3.31Å; S113-P316 WeakPolarHBondContact O-CG 3.27Å
114	L	98.8	Very high	98.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-29.5	-177.6	-62.6	170	0	0	0	112.6	F110 M111 E112 F132 T133 H168 M169 R172	F110-L114 HydrophobicContact CE1-CD1 3.87Å; F110-L114 HydrophobicContact CE2-CD1 4.41Å; F110-L114 HydrophobicContact CZ-CD1 3.81Å; M111-L114 HydrophobicContact CE-CB 4.33Å; M111-L114 HydrophobicContact CE-CD1 4.29Å; M111-L114 WeakPolarHBondContact O-CB 3.46Å; M111-L114 PolarHBondContact O-N 3.44Å; E112-L114 PolarHBondContact O-N 3.23Å; L114-F132 HydrophobicContact CB-CD1 3.71Å; L114-F132 HydrophobicContact CB-CE1 3.67Å; L114-F132 HydrophobicContact CD1-CE1 4.06Å; L114-F132 HydrophobicContact CG-CE1 4.44Å; L114-T133 PolarHBondContact O-N 3Å; L114-H168 WeakPolarHBondContact CD2-NE2 3.37Å; L114-M169 HydrophobicContact CD1-CG 4.24Å; L114-R172 HydrophobicContact CD1-CB 4.41Å; L114-R172 HydrophobicContact CD1-CG 4.27Å; L114-R172 HydrophobicContact CD2-CB 3.79Å; L114-R172 HydrophobicContact CD2-CG 3.77Å; L114-R172 HydrophobicContact CG-CB 4.43Å; L114-R172 HydrophobicContact CG-CG 4.05Å
115	V	98.9	Very high	98.7	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-124.2	159.2	-170.2	-53.1	0	0	0	0	115.1	M111 I119 S130 L131 F132 L143 R309	M111-V115 HydrophobicContact CE-CG1 3.68Å; M111-V115 HydrophobicContact CG-CG2 4.18Å; M111-V115 WeakPolarHBondContact O-CG2 3.39Å; M111-V115 PolarHBondContact O-N 3Å; M111-V115 VanDerWaalsContact O-N 3.15Å; V115-I119 HydrophobicContact CG2-CD1 4.08Å; V115-I119 HydrophobicContact CG2-CG1 4.1Å; V115-S130 WeakPolarHBondContact CB-OG 3.23Å; V115-L131 VanDerWaalsContact CA-O 3.24Å; V115-L131 WeakPolarHBondContact CA-O 3.46Å; V115-L131 WeakPolarHBondContact CB-O 3.48Å; V115-F132 HydrophobicContact CG1-CD1 3.43Å; V115-F132 VanDerWaalsContact CG1-CD1 3.43Å; V115-F132 HydrophobicContact CG1-CE1 3.63Å; V115-F132 HydrophobicContact CG1-CG 4.29Å; V115-L143 HydrophobicContact CG1-CD1 4.27Å; V115-L143 HydrophobicContact CG1-CD2 4.03Å; V115-R309 PolarHBondContact O-NH1 3.35Å
116	V	98.9	Very high	98.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.193	C	C	.	.	S	Bend	trans	-81.8	-15.5	-175.9	-57.2	0	0	0	0	115.6	L131 T133 I305 G306 R309 F315	V116-L131 HydrophobicContact CG2-CB 4Å; V116-L131 HydrophobicContact CG2-CD1 4.32Å; V116-L131 HydrophobicContact CG2-CG 4.25Å; V116-L131 PolarHBondContact N-O 3.15Å; V116-T133 HydrophobicContact CG1-CG2 3.71Å; V116-I305 HydrophobicContact CB-CB 4.48Å; V116-I305 HydrophobicContact CB-CG1 4.18Å; V116-I305 HydrophobicContact CB-CG2 4.36Å; V116-I305 HydrophobicContact CG2-CG1 4.3Å; V116-I305 WeakPolarHBondContact O-CA 3.34Å; V116-G306 PolarHBondContact O-N 3.49Å; V116-R309 WeakPolarHBondContact O-CG 3.44Å; V116-F315 HydrophobicContact CB-CD2 4.48Å; V116-F315 HydrophobicContact CG1-CD2 3.81Å; V116-F315 HydrophobicContact CG1-CE2 3.99Å
117	A	98.8	Very high	98.7	Very high	3 Å²	3	37.9 Å²	37.9	3%	0.025	19%	0.187	C	C	.	.	S	Bend	trans	-80.3	161	-175.2	0	0	0	0	0	113.9	I119 T128 S130 T304 R309	A117-I119 HydrophobicContact CB-CD1 3.87Å; A117-I119 PolarHBondContact O-N 2.7Å; A117-T128 HydrophobicContact CB-CG2 3.85Å; A117-S130 WeakPolarHBondContact CB-OG 3.46Å; A117-S130 PolarHBondContact N-OG 3Å; A117-S130 VanDerWaalsContact N-OG 3.1Å; A117-T304 WeakPolarHBondContact CA-O 3.44Å; A117-R309 WeakPolarHBondContact O-CG 3.18Å; A117-R309 PolarHBondContact O-NH1 3.25Å
118	D	98.4	Very high	98.7	Very high	22 Å²	22	37 Å²	37	12%	0.118	19%	0.187	C	C	.	.			trans	-84.1	93.3	171.4	-122.8	-50.4	0	0	0	108.8	E121 K307 R308 R309	D118-E121 HydrophobicContact CB-CB 4.16Å; D118-E121 HydrophobicContact CB-CG 4.15Å; D118-K307 PolarHBondContact OD2-N 3.2Å; D118-R308 IonicContact OD1-CZ 3.54Å; D118-R308 VanDerWaalsContact OD1-CZ 3.24Å; D118-R308 IonicContact OD1-NE 3.47Å; D118-R308 PolarHBondContact OD1-NE 3.37Å; D118-R308 IonicContact OD1-NH2 3.52Å; D118-R308 PolarHBondContact OD1-NH2 3.06Å; D118-R308 VanDerWaalsContact OD2-CB 3.3Å; D118-R308 WeakPolarHBondContact OD2-CB 3.48Å; D118-R308 PolarHBondContact OD2-N 3.22Å; D118-R309 HydrophobicContact CB-CG 4.4Å
119	I	98.8	Very high	98.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	-82.6	-33.2	-175.9	-51.2	-55.4	0	0	0	110.6	I108 M111 E112 V115 A117 E121 L122 T128 V145 L153	I108-I119 HydrophobicContact CG1-CG2 4.46Å; I108-I119 HydrophobicContact CG2-CB 4.23Å; I108-I119 HydrophobicContact CG2-CG2 4.24Å; M111-I119 HydrophobicContact CG-CD1 4.43Å; M111-I119 HydrophobicContact CG-CG1 3.98Å; M111-I119 HydrophobicContact CG-CG2 4.4Å; E112-I119 HydrophobicContact CG-CB 3.76Å; E112-I119 HydrophobicContact CG-CG1 3.66Å; E112-I119 WeakPolarHBondContact OE1-CA 3.5Å; E112-I119 WeakPolarHBondContact OE1-CB 3.3Å; E112-I119 PolarHBondContact OE1-N 3.04Å; V115-I119 HydrophobicContact CG2-CD1 4.08Å; V115-I119 HydrophobicContact CG2-CG1 4.1Å; A117-I119 HydrophobicContact CB-CD1 3.87Å; A117-I119 PolarHBondContact O-N 2.7Å; I119-E121 VanDerWaalsContact C-N 3.32Å; I119-E121 PolarHBondContact O-N 2.95Å; I119-L122 HydrophobicContact CD1-CD1 4.34Å; I119-L122 HydrophobicContact CG2-CD1 4.28Å; I119-L122 WeakPolarHBondContact O-CB 3.43Å; I119-L122 PolarHBondContact O-N 2.75Å; I119-T128 HydrophobicContact CD1-CG2 4.48Å; I119-V145 HydrophobicContact CD1-CG1 3.5Å; I119-V145 HydrophobicContact CD1-CG2 4.3Å; I119-L153 HydrophobicContact CG2-CD1 3.97Å; I119-L153 HydrophobicContact CG2-CD2 4.19Å
120	A	98.4	Very high	98.7	Very high	39 Å²	39	32 Å²	32	32%	0.322	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-43.4	175.5	0	0	0	0	0	112.7	I108 E112 L122 K147	I108-A120 HydrophobicContact CG2-CB 3.94Å; E112-A120 PolarHBondContact OE1-N 2.75Å; A120-L122 VanDerWaalsContact C-N 3.29Å; A120-L122 PolarHBondContact O-N 3.24Å; A120-K147 PolarHBondContact O-NZ 3.3Å
121	E	98.1	Very high	98.7	Very high	141 Å²	141	32 Å²	32	66%	0.659	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-12.6	-178.4	-66	-66	140.6	0	0	114.2	D118 I119 K123	D118-E121 HydrophobicContact CB-CB 4.16Å; D118-E121 HydrophobicContact CB-CG 4.15Å; I119-E121 VanDerWaalsContact C-N 3.32Å; I119-E121 PolarHBondContact O-N 2.95Å; E121-K123 PolarHBondContact O-N 3.42Å
122	L	98.7	Very high	98.7	Very high	12 Å²	12	32 Å²	32	6%	0.063	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-59.5	137.8	173.4	-66.7	176	0	0	0	109.5	I119 A120 Q126 T128 K147	I119-L122 HydrophobicContact CD1-CD1 4.34Å; I119-L122 HydrophobicContact CG2-CD1 4.28Å; I119-L122 WeakPolarHBondContact O-CB 3.43Å; I119-L122 PolarHBondContact O-N 2.75Å; A120-L122 VanDerWaalsContact C-N 3.29Å; A120-L122 PolarHBondContact O-N 3.24Å; L122-Q126 HydrophobicContact CD2-CB 4.48Å; L122-Q126 HydrophobicContact CD2-CG 4.13Å; L122-T128 HydrophobicContact CD1-CG2 4.29Å; L122-T128 HydrophobicContact CD2-CG2 4.11Å; L122-K147 HydrophobicContact CB-CB 3.86Å; L122-K147 HydrophobicContact CB-CD 3.98Å; L122-K147 HydrophobicContact CD1-CB 4.19Å; L122-K147 WeakPolarHBondContact O-CD 3.04Å; L122-K147 WeakPolarHBondContact O-CE 3.45Å; L122-K147 PolarHBondContact O-NZ 3.16Å
123	K	98.6	Very high	98.7	Very high	156 Å²	156	31.3 Å²	31.3	68%	0.678	16%	0.163	S	C	*	.	P	Polyproline II helix	trans	-74.9	163.4	167.1	-64.9	177.2	-178.4	177.4	0	110	E121 N125 Q126	E121-K123 PolarHBondContact O-N 3.42Å; K123-N125 PolarHBondContact O-N 2.68Å; K123-Q126 HydrophobicContact CB-CB 4.1Å; K123-Q126 WeakPolarHBondContact O-CB 3.28Å; K123-Q126 PolarHBondContact O-N 3.16Å
124	D	98.4	Very high	98.7	Very high	103 Å²	103	31.9 Å²	31.9	55%	0.551	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	134.9	173.7	-79.3	10.1	0	0	0	110.9	Q126 K147 N149	D124-Q126 PolarHBondContact O-N 3.44Å; D124-K147 WeakPolarHBondContact OD1-CE 3.43Å; D124-N149 HydrophobicContact CB-CB 4.04Å
125	N	98.6	Very high	98.7	Very high	22 Å²	22	38 Å²	38	12%	0.118	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	10.2	-168.1	-66.2	-34.1	0	0	0	116.8	K123 K147 T148 N149 T219 S220 R232	K123-N125 PolarHBondContact O-N 2.68Å; N125-K147 WeakPolarHBondContact CA-O 3.37Å; N125-K147 PolarHBondContact N-O 3.08Å; N125-T148 WeakPolarHBondContact OD1-CA 3.46Å; N125-N149 PolarHBondContact ND2-ND2 3.07Å; N125-N149 PolarHBondContact ND2-OD1 3.46Å; N125-N149 PolarHBondContact OD1-N 3.29Å; N125-N149 PolarHBondContact OD1-OD1 2.68Å; N125-T219 CarbonylContact O-C 3.51Å; N125-T219 WeakPolarHBondContact O-CA 3.45Å; N125-S220 VanDerWaalsContact CB-O 3.25Å; N125-S220 WeakPolarHBondContact CB-O 3.21Å; N125-S220 PolarHBondContact O-N 3.04Å; N125-S220 PolarHBondContact O-OG 3.41Å; N125-R232 PolarHBondContact OD1-NH2 2.95Å
126	Q	98.8	Very high	98.6	Very high	68 Å²	68	46.1 Å²	46.1	32%	0.318	23%	0.228	S	C	.	.	B	Isolated β-bridge	trans	-86.1	143.4	170.5	-166.2	-179	9.1	0	0	111	L122 K123 D124 T146 K147	L122-Q126 HydrophobicContact CD2-CB 4.48Å; L122-Q126 HydrophobicContact CD2-CG 4.13Å; K123-Q126 HydrophobicContact CB-CB 4.1Å; K123-Q126 WeakPolarHBondContact O-CB 3.28Å; K123-Q126 PolarHBondContact O-N 3.16Å; D124-Q126 PolarHBondContact O-N 3.44Å; Q126-T146 WeakPolarHBondContact O-CA 3.47Å; Q126-K147 PolarHBondContact O-N 2.99Å
127	G	98.8	Very high	98.6	Very high	4 Å²	4	46.1 Å²	46.1	4%	0.041	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	175.4	170.1	0	0	0	0	0	114	V145 M218	G127-V145 CarbonylContact C-O 3.59Å; G127-V145 WeakPolarHBondContact CA-O 3.4Å; G127-M218 PolarHBondContact N-O 2.92Å; G127-M218 WeakPolarHBondContact O-CB 3.5Å
128	T	98.9	Very high	98.6	Very high	31 Å²	31	46.1 Å²	46.1	19%	0.19	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	154	173.3	-176.5	0	0	0	0	109.9	A117 I119 L122 I144 V145	A117-T128 HydrophobicContact CB-CG2 3.85Å; I119-T128 HydrophobicContact CD1-CG2 4.48Å; L122-T128 HydrophobicContact CD1-CG2 4.29Å; L122-T128 HydrophobicContact CD2-CG2 4.11Å; T128-I144 WeakPolarHBondContact O-CA 3.48Å; T128-V145 HydrophobicContact CG2-CG1 4.05Å; T128-V145 PolarHBondContact N-O 2.92Å; T128-V145 PolarHBondContact O-N 2.81Å
129	L	98.9	Very high	98.6	Very high	38 Å²	38	45 Å²	45	20%	0.199	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	139.2	156.3	-173.7	70.6	0	0	0	108.5	D142 L143 W303 T304	L129-D142 HydrophobicContact CD1-CB 4.43Å; L129-L143 CarbonylContact C-O 3.44Å; L129-L143 WeakPolarHBondContact CA-O 3.44Å; L129-W303 HydrophobicContact CB-CH2 3.84Å; L129-W303 HydrophobicContact CB-CZ3 4.33Å; L129-W303 HydrophobicContact CD2-CH2 3.56Å; L129-W303 HydrophobicContact CD2-CZ2 3.7Å; L129-W303 HydrophobicContact CG-CH2 4.31Å; L129-T304 HydrophobicContact CD2-CG2 4.09Å; L129-T304 HydrophobicContact CG-CG2 4.4Å
130	S	98.9	Very high	98.6	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	176.7	168.1	-149.7	0	0	0	0	110.5	V115 A117 L143	V115-S130 WeakPolarHBondContact CB-OG 3.23Å; A117-S130 WeakPolarHBondContact CB-OG 3.46Å; A117-S130 PolarHBondContact N-OG 3Å; A117-S130 VanDerWaalsContact N-OG 3.1Å; S130-L143 PolarHBondContact N-O 2.9Å; S130-L143 PolarHBondContact O-N 3.35Å
131	L	98.9	Very high	98.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	127.1	-175	-54.3	172.1	0	0	0	107.7	V115 V116 T133 I139 D141 D142 P296 L301	V115-L131 VanDerWaalsContact CA-O 3.24Å; V115-L131 WeakPolarHBondContact CA-O 3.46Å; V115-L131 WeakPolarHBondContact CB-O 3.48Å; V116-L131 HydrophobicContact CG2-CB 4Å; V116-L131 HydrophobicContact CG2-CD1 4.32Å; V116-L131 HydrophobicContact CG2-CG 4.25Å; V116-L131 PolarHBondContact N-O 3.15Å; L131-T133 HydrophobicContact CB-CG2 4.48Å; L131-I139 HydrophobicContact CB-CG2 4.35Å; L131-I139 HydrophobicContact CD1-CD1 3.97Å; L131-I139 HydrophobicContact CD1-CG1 4.19Å; L131-I139 HydrophobicContact CD2-CD1 4.5Å; L131-I139 HydrophobicContact CD2-CG2 4.21Å; L131-D141 WeakPolarHBondContact CA-O 3.38Å; L131-D142 HydrophobicContact CD2-CB 3.49Å; L131-D142 VanDerWaalsContact CD2-CB 3.49Å; L131-P296 HydrophobicContact CD1-CB 3.77Å; L131-P296 HydrophobicContact CD1-CG 3.69Å; L131-L301 HydrophobicContact CD1-CB 4.09Å; L131-L301 HydrophobicContact CD1-CD1 3.98Å; L131-L301 HydrophobicContact CD2-CD1 4.04Å
132	F	98.9	Very high	98.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	136.7	159.6	-72.5	-51.5	0	0	0	108	M111 L114 V115 I139 I140 D141 L143 D165 M169	M111-F132 HydrophobicContact CE-CE1 3.52Å; M111-F132 HydrophobicContact CE-CZ 3.99Å; L114-F132 HydrophobicContact CB-CD1 3.71Å; L114-F132 HydrophobicContact CB-CE1 3.67Å; L114-F132 HydrophobicContact CD1-CE1 4.06Å; L114-F132 HydrophobicContact CG-CE1 4.44Å; V115-F132 HydrophobicContact CG1-CD1 3.43Å; V115-F132 VanDerWaalsContact CG1-CD1 3.43Å; V115-F132 HydrophobicContact CG1-CE1 3.63Å; V115-F132 HydrophobicContact CG1-CG 4.29Å; F132-I139 CarbonylContact O-C 3.46Å; F132-I139 WeakPolarHBondContact O-CA 3.44Å; F132-I140 HydrophobicContact CB-CB 3.81Å; F132-I140 HydrophobicContact CB-CG2 4.42Å; F132-I140 PolarHBondContact O-N 2.95Å; F132-D141 HydrophobicContact CD2-CB 4.2Å; F132-D141 PolarHBondContact N-O 3.22Å; F132-L143 HydrophobicContact CB-CD2 4.43Å; F132-L143 HydrophobicContact CD1-CD2 4.18Å; F132-L143 HydrophobicContact CD2-CD2 3.65Å; F132-L143 HydrophobicContact CE1-CD1 4.43Å; F132-L143 HydrophobicContact CE1-CD2 4.38Å; F132-L143 HydrophobicContact CE2-CD1 4.24Å; F132-L143 HydrophobicContact CE2-CD2 3.86Å; F132-L143 HydrophobicContact CG-CD2 3.8Å; F132-L143 HydrophobicContact CZ-CD1 4.02Å; F132-L143 HydrophobicContact CZ-CD2 4.22Å; F132-D165 HydrophobicContact CE2-CB 4.25Å; F132-M169 HydrophobicContact CE1-CG 4.44Å; F132-M169 HydrophobicContact CE2-SD 4.44Å; F132-M169 HydrophobicContact CZ-CG 3.91Å; F132-M169 HydrophobicContact CZ-SD 3.81Å
133	T	98.8	Very high	98.6	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.006	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	149.5	-179	40.7	0	0	0	0	111.4	L114 V116 L131 G138 I140 P296 P316 I321	L114-T133 PolarHBondContact O-N 3Å; V116-T133 HydrophobicContact CG1-CG2 3.71Å; L131-T133 HydrophobicContact CB-CG2 4.48Å; T133-G138 CarbonylContact C-O 3.56Å; T133-G138 VanDerWaalsContact CA-O 3.28Å; T133-G138 WeakPolarHBondContact CA-O 3.24Å; T133-I140 WeakPolarHBondContact O-CD1 3.08Å; T133-P296 HydrophobicContact CG2-CG 4.1Å; T133-P316 WeakPolarHBondContact O-CB 3.19Å; T133-P316 PolarHBondContact OG1-O 2.6Å; T133-I321 HydrophobicContact CG2-CD1 4.09Å
134	N	98.4	Very high	98.7	Very high	29 Å²	29	31.8 Å²	31.8	16%	0.155	16%	0.158	C	C	.	.			trans	-96.8	169.2	173.5	67	40	0	0	0	111.2	K136 G137 G138 I140 E292 P316 G317	N134-K136 PolarHBondContact O-N 2.83Å; N134-K136 VanDerWaalsContact O-N 3.08Å; N134-K136 WeakPolarHBondContact OD1-CA 3.39Å; N134-K136 WeakPolarHBondContact OD1-CB 3.24Å; N134-K136 PolarHBondContact OD1-N 2.89Å; N134-G137 WeakPolarHBondContact O-CA 3.41Å; N134-G137 PolarHBondContact O-N 3.1Å; N134-G137 PolarHBondContact OD1-N 2.83Å; N134-G138 PolarHBondContact N-O 3.27Å; N134-G138 PolarHBondContact OD1-N 3.04Å; N134-I140 HydrophobicContact CB-CD1 3.97Å; N134-I140 HydrophobicContact CB-CG1 4.01Å; N134-E292 PolarHBondContact ND2-O 3.33Å; N134-P316 CarbonylContact O-C 3.16Å; N134-G317 PolarHBondContact O-N 3.39Å
135	E	98	Very high	98.7	Very high	129 Å²	129	26.9 Å²	26.9	60%	0.603	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-12.8	-179.5	-58.3	-54.2	157.7	0	0	114.6	G137 G317	E135-G137 VanDerWaalsContact C-N 3.27Å; E135-G317 PolarHBondContact OE2-N 3.22Å; E135-G317 VanDerWaalsContact OE2-N 3.14Å
136	K	98.1	Very high	98.7	Very high	171 Å²	171	25.9 Å²	25.9	74%	0.743	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.6	2.7	171.4	-58.1	178	-178	174.1	0	112.3	N134 G138 I320	N134-K136 PolarHBondContact O-N 2.83Å; N134-K136 VanDerWaalsContact O-N 3.08Å; N134-K136 WeakPolarHBondContact OD1-CA 3.39Å; N134-K136 WeakPolarHBondContact OD1-CB 3.24Å; N134-K136 PolarHBondContact OD1-N 2.89Å; K136-G138 VanDerWaalsContact C-N 3.27Å; K136-G138 PolarHBondContact O-N 3.47Å; K136-I320 WeakPolarHBondContact O-CD1 3.42Å
137	G	98.2	Very high	98.7	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.118	C	C	.	.	S	Bend	trans	78.7	2.7	-178	0	0	0	0	0	114.8	N134 E135 T295 P296	N134-G137 WeakPolarHBondContact O-CA 3.41Å; N134-G137 PolarHBondContact O-N 3.1Å; N134-G137 PolarHBondContact OD1-N 2.83Å; E135-G137 VanDerWaalsContact C-N 3.27Å; G137-T295 WeakPolarHBondContact O-CA 3.46Å; G137-T295 WeakPolarHBondContact O-CG2 3.39Å; G137-P296 WeakPolarHBondContact O-CD 3.48Å
138	G	98.6	Very high	98.7	Very high	2 Å²	2	24.3 Å²	24.3	2%	0.021	12%	0.117	C	C	.	.			trans	-76.5	154.2	177.8	0	0	0	0	0	112.6	T133 N134 K136 E292 T294	T133-G138 CarbonylContact C-O 3.56Å; T133-G138 VanDerWaalsContact CA-O 3.28Å; T133-G138 WeakPolarHBondContact CA-O 3.24Å; N134-G138 PolarHBondContact N-O 3.27Å; N134-G138 PolarHBondContact OD1-N 3.04Å; K136-G138 VanDerWaalsContact C-N 3.27Å; K136-G138 PolarHBondContact O-N 3.47Å; G138-E292 WeakPolarHBondContact CA-O 3.49Å; G138-T294 WeakPolarHBondContact CA-O 3.22Å
139	I	98.9	Very high	98.6	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	124.6	-177	-62.4	162.2	0	0	0	110	L131 F132 Y286 I290 D291 E292 T294 P296 A299 L301	L131-I139 HydrophobicContact CB-CG2 4.35Å; L131-I139 HydrophobicContact CD1-CD1 3.97Å; L131-I139 HydrophobicContact CD1-CG1 4.19Å; L131-I139 HydrophobicContact CD2-CD1 4.5Å; L131-I139 HydrophobicContact CD2-CG2 4.21Å; F132-I139 CarbonylContact O-C 3.46Å; F132-I139 WeakPolarHBondContact O-CA 3.44Å; I139-Y286 HydrophobicContact CG2-CD2 4.27Å; I139-Y286 HydrophobicContact CG2-CE2 4.13Å; I139-Y286 WeakPolarHBondContact O-CE2 3.47Å; I139-Y286 PolarHBondContact O-OH 2.76Å; I139-I290 HydrophobicContact CD1-CB 3.94Å; I139-I290 HydrophobicContact CD1-CD1 4.47Å; I139-I290 HydrophobicContact CD1-CG2 3.84Å; I139-I290 HydrophobicContact CG2-CD1 4.37Å; I139-D291 PolarHBondContact N-O 2.97Å; I139-D291 CarbonylContact O-C 3.43Å; I139-E292 WeakPolarHBondContact O-CA 3.45Å; I139-E292 VanDerWaalsContact O-CG 3.23Å; I139-E292 WeakPolarHBondContact O-CG 3.4Å; I139-E292 PolarHBondContact O-N 2.91Å; I139-T294 WeakPolarHBondContact CG1-O 3.5Å; I139-T294 PolarHBondContact N-O 2.75Å; I139-T294 VanDerWaalsContact N-O 3.1Å; I139-P296 HydrophobicContact CD1-CG 4.35Å; I139-P296 HydrophobicContact CG1-CG 4.11Å; I139-A299 HydrophobicContact CD1-CB 4.23Å; I139-L301 HydrophobicContact CD1-CD1 4.39Å
140	I	98.6	Very high	98.6	Very high	13 Å²	13	29.7 Å²	29.7	7%	0.067	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-42.8	177.2	-59.8	171	0	0	0	110.7	F132 T133 N134 K164 Y286 E292	F132-I140 HydrophobicContact CB-CB 3.81Å; F132-I140 HydrophobicContact CB-CG2 4.42Å; F132-I140 PolarHBondContact O-N 2.95Å; T133-I140 WeakPolarHBondContact O-CD1 3.08Å; N134-I140 HydrophobicContact CB-CD1 3.97Å; N134-I140 HydrophobicContact CB-CG1 4.01Å; I140-K164 HydrophobicContact CG2-CD 4.16Å; I140-K164 HydrophobicContact CG2-CG 4.45Å; I140-K164 WeakPolarHBondContact O-CE 3.47Å; I140-K164 PolarHBondContact O-NZ 2.94Å; I140-Y286 VanDerWaalsContact O-CE2 3.23Å; I140-Y286 WeakPolarHBondContact O-CE2 3.38Å; I140-Y286 PolarHBondContact O-OH 2.75Å; I140-Y286 VanDerWaalsContact O-OH 3.11Å; I140-E292 HydrophobicContact CG1-CG 4.4Å
141	D	98.8	Very high	98.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	163.1	167.9	-159.6	36	0	0	0	109.8	L131 F132 S157 N158 C161 Y286	L131-D141 WeakPolarHBondContact CA-O 3.38Å; F132-D141 HydrophobicContact CD2-CB 4.2Å; F132-D141 PolarHBondContact N-O 3.22Å; D141-S157 WeakPolarHBondContact OD2-CB 3.39Å; D141-N158 VanDerWaalsContact CG-ND2 3.34Å; D141-N158 PolarHBondContact OD1-ND2 3.36Å; D141-N158 WeakPolarHBondContact OD2-CB 3.39Å; D141-N158 PolarHBondContact OD2-N 3.5Å; D141-N158 PolarHBondContact OD2-ND2 2.79Å; D141-C161 HydrophobicContact CB-CB 4.09Å; D141-C161 VanDerWaalsContact CG-SG 3.58Å; D141-C161 PolarHBondContact OD1-SG 2.89Å; D141-Y286 WeakPolarHBondContact OD1-CD1 3.42Å
142	D	98.8	Very high	98.4	Very high	21 Å²	21	32.9 Å²	32.9	11%	0.112	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	141.3	165.3	76.5	-55	0	0	0	112.1	L129 L131 N158 I290	L129-D142 HydrophobicContact CD1-CB 4.43Å; L131-D142 HydrophobicContact CD2-CB 3.49Å; L131-D142 VanDerWaalsContact CD2-CB 3.49Å; D142-N158 PolarHBondContact O-ND2 3.15Å; D142-N158 PolarHBondContact OD1-ND2 2.93Å; D142-I290 HydrophobicContact CB-CD1 3.99Å
143	L	98.9	Very high	98.4	Very high	3 Å²	3	32.9 Å²	32.9	2%	0.016	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	152.6	-171.7	61.7	147.2	0	0	0	112.6	M111 V115 L129 S130 F132 V145 V155 V156	M111-L143 HydrophobicContact CE-CD1 4.34Å; V115-L143 HydrophobicContact CG1-CD1 4.27Å; V115-L143 HydrophobicContact CG1-CD2 4.03Å; L129-L143 CarbonylContact C-O 3.44Å; L129-L143 WeakPolarHBondContact CA-O 3.44Å; S130-L143 PolarHBondContact N-O 2.9Å; S130-L143 PolarHBondContact O-N 3.35Å; F132-L143 HydrophobicContact CB-CD2 4.43Å; F132-L143 HydrophobicContact CD1-CD2 4.18Å; F132-L143 HydrophobicContact CD2-CD2 3.65Å; F132-L143 HydrophobicContact CE1-CD1 4.43Å; F132-L143 HydrophobicContact CE1-CD2 4.38Å; F132-L143 HydrophobicContact CE2-CD1 4.24Å; F132-L143 HydrophobicContact CE2-CD2 3.86Å; F132-L143 HydrophobicContact CG-CD2 3.8Å; F132-L143 HydrophobicContact CZ-CD1 4.02Å; F132-L143 HydrophobicContact CZ-CD2 4.22Å; L143-V145 HydrophobicContact CD1-CB 4.36Å; L143-V155 HydrophobicContact CB-CG1 4.47Å; L143-V155 HydrophobicContact CD1-CG1 3.61Å; L143-V156 WeakPolarHBondContact CA-O 3.31Å; L143-V156 WeakPolarHBondContact CB-O 3.35Å
144	I	98.9	Very high	98.4	Very high	33 Å²	33	33.2 Å²	33.2	17%	0.169	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	125.7	163.3	-66.3	175.9	0	0	0	108.4	T128 V155 V156 M218 C236	T128-I144 WeakPolarHBondContact O-CA 3.48Å; I144-V155 WeakPolarHBondContact O-CA 3.47Å; I144-V156 PolarHBondContact N-O 2.8Å; I144-V156 PolarHBondContact O-N 2.69Å; I144-M218 HydrophobicContact CD1-CE 4.28Å; I144-M218 HydrophobicContact CG1-CE 4.27Å; I144-M218 HydrophobicContact CG2-CE 3.91Å; I144-C236 HydrophobicContact CD1-CB 4.19Å
145	V	98.9	Very high	98.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	132.6	173.2	52.9	0	0	0	0	109.8	M111 I119 G127 T128 L143 L153 Y154 V155	M111-V145 HydrophobicContact CG-CG2 4.12Å; M111-V145 HydrophobicContact SD-CB 4.48Å; M111-V145 HydrophobicContact SD-CG2 3.91Å; I119-V145 HydrophobicContact CD1-CG1 3.5Å; I119-V145 HydrophobicContact CD1-CG2 4.3Å; G127-V145 CarbonylContact C-O 3.59Å; G127-V145 WeakPolarHBondContact CA-O 3.4Å; T128-V145 HydrophobicContact CG2-CG1 4.05Å; T128-V145 PolarHBondContact N-O 2.92Å; T128-V145 PolarHBondContact O-N 2.81Å; L143-V145 HydrophobicContact CD1-CB 4.36Å; V145-L153 HydrophobicContact CG2-CB 4.49Å; V145-Y154 CarbonylContact C-O 3.6Å; V145-Y154 WeakPolarHBondContact CA-O 3.47Å; V145-V155 HydrophobicContact CB-CG2 4.17Å; V145-V155 HydrophobicContact CG2-CG2 3.94Å
146	T	98.9	Very high	98.5	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.006	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	124.4	-176.8	-63.2	0	0	0	0	110	Q126 T148 L153 Y154 S220	Q126-T146 WeakPolarHBondContact O-CA 3.47Å; T146-T148 HydrophobicContact CG2-CG2 4.4Å; T146-T148 PolarHBondContact O-N 2.87Å; T146-L153 CarbonylContact O-C 3.08Å; T146-L153 WeakPolarHBondContact O-CA 3.47Å; T146-Y154 PolarHBondContact N-O 2.93Å; T146-Y154 PolarHBondContact O-N 2.9Å; T146-S220 VanDerWaalsContact CG2-OG 3.24Å; T146-S220 WeakPolarHBondContact CG2-OG 3.42Å
147	K	98.8	Very high	98.5	Very high	36 Å²	36	18.3 Å²	18.3	16%	0.157	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	112.3	170.7	179.3	-174.7	176.8	177.1	0	108.2	A120 L122 D124 N125 Q126 L153	A120-K147 PolarHBondContact O-NZ 3.3Å; L122-K147 HydrophobicContact CB-CB 3.86Å; L122-K147 HydrophobicContact CB-CD 3.98Å; L122-K147 HydrophobicContact CD1-CB 4.19Å; L122-K147 WeakPolarHBondContact O-CD 3.04Å; L122-K147 WeakPolarHBondContact O-CE 3.45Å; L122-K147 PolarHBondContact O-NZ 3.16Å; D124-K147 WeakPolarHBondContact OD1-CE 3.43Å; N125-K147 WeakPolarHBondContact CA-O 3.37Å; N125-K147 PolarHBondContact N-O 3.08Å; Q126-K147 PolarHBondContact O-N 2.99Å; K147-L153 HydrophobicContact CB-CD2 3.97Å; K147-L153 HydrophobicContact CG-CD2 4.14Å
148	T	98.6	Very high	98.5	Very high	2 Å²	2	20 Å²	20	1%	0.012	11%	0.109	C	C	.	.			trans	-90	152.7	-176.3	79.5	0	0	0	0	111.7	N125 T146 Q150 Y152 R232	N125-T148 WeakPolarHBondContact OD1-CA 3.46Å; T146-T148 HydrophobicContact CG2-CG2 4.4Å; T146-T148 PolarHBondContact O-N 2.87Å; T148-Q150 PolarHBondContact O-N 2.74Å; T148-Q150 PolarHBondContact OG1-N 2.87Å; T148-Y152 WeakPolarHBondContact CB-O 3.3Å; T148-Y152 HydrophobicContact CG2-CD2 3.81Å; T148-Y152 HydrophobicContact CG2-CE2 3.58Å; T148-Y152 WeakPolarHBondContact CG2-O 3.48Å; T148-Y152 PolarHBondContact N-O 3.36Å; T148-Y152 PolarHBondContact OG1-N 3.14Å; T148-Y152 PolarHBondContact OG1-O 3.1Å; T148-R232 VanDerWaalsContact CG2-CZ 3.44Å
149	N	97.5	Very high	98.4	Very high	82 Å²	82	20.6 Å²	20.6	44%	0.439	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	4.2	168	75	-23.1	0	0	0	113.6	D124 N125	D124-N149 HydrophobicContact CB-CB 4.04Å; N125-N149 PolarHBondContact ND2-ND2 3.07Å; N125-N149 PolarHBondContact ND2-OD1 3.46Å; N125-N149 PolarHBondContact OD1-N 3.29Å; N125-N149 PolarHBondContact OD1-OD1 2.68Å
150	Q	97.2	Very high	98.1	Very high	101 Å²	101	23.7 Å²	23.7	47%	0.472	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	11.4	-178	-58.9	-59.7	-63.6	0	0	112.6	T148 Y152	T148-Q150 PolarHBondContact O-N 2.74Å; T148-Q150 PolarHBondContact OG1-N 2.87Å; Q150-Y152 HydrophobicContact CB-CD1 3.74Å; Q150-Y152 HydrophobicContact CB-CE1 3.31Å; Q150-Y152 HydrophobicContact CG-CE1 4.13Å
151	G	96.8	Very high	98.1	Very high	36 Å²	36	23.4 Å²	23.4	37%	0.371	14%	0.144	S	C	.	.	S	Bend	trans	84.3	2.5	177.9	0	0	0	0	0	115.8	R107	R107-G151 WeakPolarHBondContact CD-O 3.38Å; R107-G151 PolarHBondContact NE-O 2.82Å; R107-G151 PolarHBondContact NH1-O 3.36Å; R107-G151 PolarHBondContact NH2-O 3.5Å
152	Y	98.7	Very high	97.9	Very high	30 Å²	30	24.1 Å²	24.1	12%	0.118	15%	0.15	C	C	.	.	S	Bend	trans	-124.1	161.9	176.7	62.5	-95.7	0	0	0	113	K101 I102 H103 T148 Q150	K101-Y152 HydrophobicContact CB-CD2 3.84Å; K101-Y152 HydrophobicContact CB-CE2 4.37Å; K101-Y152 HydrophobicContact CB-CG 4.29Å; K101-Y152 HydrophobicContact CD-CD2 3.98Å; K101-Y152 HydrophobicContact CD-CE1 4.31Å; K101-Y152 HydrophobicContact CD-CE2 3.76Å; K101-Y152 HydrophobicContact CD-CG 4.37Å; K101-Y152 HydrophobicContact CG-CD2 3.83Å; K101-Y152 HydrophobicContact CG-CE2 3.82Å; I102-Y152 CarbonylContact O-C 3.44Å; I102-Y152 VanDerWaalsContact O-CA 3.28Å; I102-Y152 WeakPolarHBondContact O-CA 3.33Å; I102-Y152 WeakPolarHBondContact O-CB 3.33Å; H103-Y152 WeakPolarHBondContact ND1-CB 3.4Å; T148-Y152 WeakPolarHBondContact CB-O 3.3Å; T148-Y152 HydrophobicContact CG2-CD2 3.81Å; T148-Y152 HydrophobicContact CG2-CE2 3.58Å; T148-Y152 WeakPolarHBondContact CG2-O 3.48Å; T148-Y152 PolarHBondContact N-O 3.36Å; T148-Y152 PolarHBondContact OG1-N 3.14Å; T148-Y152 PolarHBondContact OG1-O 3.1Å; Q150-Y152 HydrophobicContact CB-CD1 3.74Å; Q150-Y152 HydrophobicContact CB-CE1 3.31Å; Q150-Y152 HydrophobicContact CG-CE1 4.13Å
153	L	98.9	Very high	97.8	Very high	0 Å²	0	29 Å²	29	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	136.9	162.3	-52.6	179	0	0	0	109	K101 I102 R107 I108 M111 I119 V145 T146 K147	K101-L153 CarbonylContact C-O 3.38Å; K101-L153 VanDerWaalsContact CA-O 3.26Å; K101-L153 WeakPolarHBondContact CA-O 3.38Å; I102-L153 HydrophobicContact CB-CB 4.12Å; I102-L153 HydrophobicContact CD1-CD1 4.45Å; I102-L153 HydrophobicContact CG1-CB 4.46Å; I102-L153 PolarHBondContact N-O 3.22Å; I102-L153 PolarHBondContact O-N 2.72Å; R107-L153 HydrophobicContact CB-CD1 4.43Å; R107-L153 HydrophobicContact CB-CG 4.36Å; R107-L153 HydrophobicContact CG-CD1 4.44Å; R107-L153 HydrophobicContact CG-CG 4.08Å; R107-L153 WeakPolarHBondContact O-CD1 3.46Å; I108-L153 HydrophobicContact CG1-CD2 4.32Å; M111-L153 HydrophobicContact CB-CD1 3.6Å; M111-L153 HydrophobicContact CG-CD1 3.9Å; M111-L153 HydrophobicContact SD-CD1 4.44Å; I119-L153 HydrophobicContact CG2-CD1 3.97Å; I119-L153 HydrophobicContact CG2-CD2 4.19Å; V145-L153 HydrophobicContact CG2-CB 4.49Å; T146-L153 CarbonylContact O-C 3.08Å; T146-L153 WeakPolarHBondContact O-CA 3.47Å; K147-L153 HydrophobicContact CB-CD2 3.97Å; K147-L153 HydrophobicContact CG-CD2 4.14Å
154	Y	98.9	Very high	97.7	Very high	9 Å²	9	32.1 Å²	32.1	4%	0.035	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	124.5	173.1	175.6	-112.9	0	0	0	109.2	Q99 V145 T146 V156 I188 S247	Q99-Y154 HydrophobicContact CB-CE2 4.35Å; Q99-Y154 HydrophobicContact CG-CE2 4.41Å; Q99-Y154 PolarHBondContact OE1-OH 3.28Å; Q99-Y154 VanDerWaalsContact OE1-OH 3.06Å; V145-Y154 CarbonylContact C-O 3.6Å; V145-Y154 WeakPolarHBondContact CA-O 3.47Å; T146-Y154 PolarHBondContact N-O 2.93Å; T146-Y154 PolarHBondContact O-N 2.9Å; Y154-V156 HydrophobicContact CD1-CG2 4.29Å; Y154-V156 HydrophobicContact CE1-CG2 3.46Å; Y154-V156 VanDerWaalsContact CE1-CG2 3.46Å; Y154-V156 HydrophobicContact CE2-CG2 4.32Å; Y154-V156 VanDerWaalsContact CZ-CG2 3.47Å; Y154-V156 WeakPolarHBondContact OH-CG2 3.21Å; Y154-I188 HydrophobicContact CE2-CD1 4.16Å; Y154-S247 WeakPolarHBondContact OH-CB 3.45Å
155	V	98.9	Very high	97.7	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.006	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	135.2	-175.2	174.2	0	0	0	0	109.8	Q99 T100 I102 M111 L143 I144 V145	Q99-V155 WeakPolarHBondContact CA-O 3.45Å; T100-V155 PolarHBondContact N-O 2.97Å; T100-V155 PolarHBondContact O-N 2.88Å; I102-V155 HydrophobicContact CD1-CG2 3.88Å; I102-V155 HydrophobicContact CG1-CG2 4.35Å; M111-V155 HydrophobicContact SD-CG2 3.77Å; L143-V155 HydrophobicContact CB-CG1 4.47Å; L143-V155 HydrophobicContact CD1-CG1 3.61Å; I144-V155 WeakPolarHBondContact O-CA 3.47Å; V145-V155 HydrophobicContact CB-CG2 4.17Å; V145-V155 HydrophobicContact CG2-CG2 3.94Å
156	V	98.9	Very high	97.7	Very high	10 Å²	10	31.2 Å²	31.2	6%	0.061	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	124.1	172.4	-171.4	0	0	0	0	109.2	M97 L98 Q99 L143 I144 Y154 L192	M97-V156 HydrophobicContact CB-CG1 4.09Å; M97-V156 HydrophobicContact CE-CG1 3.75Å; L98-V156 VanDerWaalsContact O-CA 3.28Å; L98-V156 WeakPolarHBondContact O-CA 3.49Å; Q99-V156 HydrophobicContact CG-CG2 4.34Å; L143-V156 WeakPolarHBondContact CA-O 3.31Å; L143-V156 WeakPolarHBondContact CB-O 3.35Å; I144-V156 PolarHBondContact N-O 2.8Å; I144-V156 PolarHBondContact O-N 2.69Å; Y154-V156 HydrophobicContact CD1-CG2 4.29Å; Y154-V156 HydrophobicContact CE1-CG2 3.46Å; Y154-V156 VanDerWaalsContact CE1-CG2 3.46Å; Y154-V156 HydrophobicContact CE2-CG2 4.32Å; Y154-V156 VanDerWaalsContact CZ-CG2 3.47Å; Y154-V156 WeakPolarHBondContact OH-CG2 3.21Å; V156-L192 HydrophobicContact CG1-CD2 3.85Å
157	S	98.6	Very high	97.7	Very high	5 Å²	5	34 Å²	34	4%	0.035	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	172.2	179.7	77.3	0	0	0	0	113	M97 L98 D141 D165	M97-S157 WeakPolarHBondContact CB-O 3.41Å; L98-S157 PolarHBondContact N-O 3.43Å; L98-S157 PolarHBondContact O-N 2.82Å; D141-S157 WeakPolarHBondContact OD2-CB 3.39Å; S157-D165 WeakPolarHBondContact CB-OD2 3.37Å; S157-D165 PolarHBondContact OG-OD2 2.88Å
158	N	98.1	Very high	97.6	Very high	36 Å²	36	34.6 Å²	34.6	19%	0.193	21%	0.213	C	C	.	.			trans	-69.1	140.1	-164.7	-72.9	-65.7	0	0	0	113.5	D141 D142 G160 C161 A162	D141-N158 VanDerWaalsContact CG-ND2 3.34Å; D141-N158 PolarHBondContact OD1-ND2 3.36Å; D141-N158 WeakPolarHBondContact OD2-CB 3.39Å; D141-N158 PolarHBondContact OD2-N 3.5Å; D141-N158 PolarHBondContact OD2-ND2 2.79Å; D142-N158 PolarHBondContact O-ND2 3.15Å; D142-N158 PolarHBondContact OD1-ND2 2.93Å; N158-G160 VanDerWaalsContact C-N 3.3Å; N158-G160 PolarHBondContact O-N 2.86Å; N158-C161 HydrophobicContact CB-CB 4.24Å; N158-C161 CarbonylContact O-C 3.52Å; N158-C161 WeakPolarHBondContact O-CA 3.43Å; N158-C161 PolarHBondContact O-N 3.16Å; N158-A162 PolarHBondContact O-N 2.8Å
159	A	95.1	Very high	97.6	Very high	13 Å²	13	34.5 Å²	34.5	11%	0.107	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-39.4	178.9	0	0	0	0	0	113.9	A66 H96 C161 A162	A66-A159 HydrophobicContact CB-CB 4.37Å; H96-A159 HydrophobicContact CB-CB 4.09Å; H96-A159 WeakPolarHBondContact CD2-CB 3.23Å; H96-A159 WeakPolarHBondContact O-CA 3.32Å; H96-A159 WeakPolarHBondContact O-CB 3.46Å; A159-C161 PolarHBondContact O-N 2.89Å; A159-A162 WeakPolarHBondContact O-CB 3.34Å; A159-A162 PolarHBondContact O-N 2.93Å
160	G	94.1	Very high	97.7	Very high	65 Å²	65	35.8 Å²	35.8	67%	0.67	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-16.3	176.4	0	0	0	0	0	114	N158	N158-G160 VanDerWaalsContact C-N 3.3Å; N158-G160 PolarHBondContact O-N 2.86Å
161	C	96.8	Very high	97.8	Very high	7 Å²	7	33.5 Å²	33.5	5%	0.047	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-6.1	177.1	-65.9	0	0	0	0	112.7	D141 N158 A159 D163 K164 D165 Y286	D141-C161 HydrophobicContact CB-CB 4.09Å; D141-C161 VanDerWaalsContact CG-SG 3.58Å; D141-C161 PolarHBondContact OD1-SG 2.89Å; N158-C161 HydrophobicContact CB-CB 4.24Å; N158-C161 CarbonylContact O-C 3.52Å; N158-C161 WeakPolarHBondContact O-CA 3.43Å; N158-C161 PolarHBondContact O-N 3.16Å; A159-C161 PolarHBondContact O-N 2.89Å; C161-D163 VanDerWaalsContact C-N 3.33Å; C161-D163 PolarHBondContact O-N 3.41Å; C161-D163 VanDerWaalsContact O-N 3.12Å; C161-K164 CarbonylContact O-C 3.54Å; C161-K164 WeakPolarHBondContact O-CA 3.48Å; C161-K164 WeakPolarHBondContact O-CB 3.23Å; C161-K164 PolarHBondContact O-N 3.32Å; C161-D165 PolarHBondContact O-N 3.5Å; C161-Y286 WeakPolarHBondContact SG-CD1 3.12Å; C161-Y286 WeakPolarHBondContact SG-CE1 3.17Å
162	A	96.3	Very high	97.8	Very high	16 Å²	16	34.1 Å²	34.1	13%	0.132	20%	0.203	C	C	.	.	H	α-helix	trans	-51	-44.6	-170	0	0	0	0	0	114.5	L98 N158 A159 S166	L98-A162 HydrophobicContact CB-CB 3.96Å; L98-A162 HydrophobicContact CD1-CB 4.41Å; L98-A162 HydrophobicContact CD2-CB 4.46Å; N158-A162 PolarHBondContact O-N 2.8Å; A159-A162 WeakPolarHBondContact O-CB 3.34Å; A159-A162 PolarHBondContact O-N 2.93Å; A162-S166 WeakPolarHBondContact O-CB 3.19Å; A162-S166 PolarHBondContact O-N 3.15Å; A162-S166 PolarHBondContact O-OG 2.76Å
163	D	96.4	Very high	97.8	Very high	124 Å²	124	33.6 Å²	33.6	66%	0.663	20%	0.203	S	C	*	.	H	α-helix	trans	-71.2	-36.5	178	-66.6	-34.3	0	0	0	111.9	C161 A167	C161-D163 VanDerWaalsContact C-N 3.33Å; C161-D163 PolarHBondContact O-N 3.41Å; C161-D163 VanDerWaalsContact O-N 3.12Å; D163-A167 WeakPolarHBondContact O-CB 3.18Å; D163-A167 PolarHBondContact O-N 3.08Å; D163-A167 VanDerWaalsContact O-N 3.07Å
164	K	97.4	Very high	97.8	Very high	67 Å²	67	36.6 Å²	36.6	29%	0.291	23%	0.227	S	C	.	.	H	α-helix	trans	-67.5	-49.7	177.5	-175.1	176.4	70.3	171.5	0	111.5	I140 C161 A167 H168 Y286 E292	I140-K164 HydrophobicContact CG2-CD 4.16Å; I140-K164 HydrophobicContact CG2-CG 4.45Å; I140-K164 WeakPolarHBondContact O-CE 3.47Å; I140-K164 PolarHBondContact O-NZ 2.94Å; C161-K164 CarbonylContact O-C 3.54Å; C161-K164 WeakPolarHBondContact O-CA 3.48Å; C161-K164 WeakPolarHBondContact O-CB 3.23Å; C161-K164 PolarHBondContact O-N 3.32Å; K164-A167 PolarHBondContact O-N 3.29Å; K164-H168 WeakPolarHBondContact O-CB 3.26Å; K164-H168 PolarHBondContact O-N 2.92Å; K164-Y286 PolarHBondContact NZ-OH 2.94Å; K164-Y286 VanDerWaalsContact NZ-OH 3.07Å; K164-E292 IonicContact NZ-OE1 3.28Å; K164-E292 PolarHBondContact NZ-OE1 3.1Å
165	D	98.4	Very high	97.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-65.4	-43.6	179.5	-65.4	-5.3	0	0	0	111	L98 F132 S157 C161 A167 H168 M169	L98-D165 HydrophobicContact CD2-CB 4.11Å; F132-D165 HydrophobicContact CE2-CB 4.25Å; S157-D165 WeakPolarHBondContact CB-OD2 3.37Å; S157-D165 PolarHBondContact OG-OD2 2.88Å; C161-D165 PolarHBondContact O-N 3.5Å; D165-A167 VanDerWaalsContact C-N 3.29Å; D165-A167 PolarHBondContact O-N 3.29Å; D165-H168 PolarHBondContact O-N 3.33Å; D165-M169 WeakPolarHBondContact O-CB 3.13Å; D165-M169 WeakPolarHBondContact O-CG 3.2Å; D165-M169 PolarHBondContact O-N 3.34Å
166	S	98.2	Very high	97.8	Very high	15 Å²	15	42.7 Å²	42.7	11%	0.105	26%	0.255	C	S	.	.	H	α-helix	trans	-57.4	-43.7	174.4	-67.2	0	0	0	0	111.4	A162 K170 F187	A162-S166 WeakPolarHBondContact O-CB 3.19Å; A162-S166 PolarHBondContact O-N 3.15Å; A162-S166 PolarHBondContact O-OG 2.76Å; S166-K170 VanDerWaalsContact O-CB 3.25Å; S166-K170 WeakPolarHBondContact O-CB 3.47Å; S166-K170 VanDerWaalsContact O-CD 3.27Å; S166-K170 WeakPolarHBondContact O-CD 3.17Å; S166-K170 WeakPolarHBondContact O-CG 3.45Å; S166-K170 PolarHBondContact O-N 2.86Å; S166-F187 WeakPolarHBondContact OG-CE1 3.38Å
167	A	98.4	Very high	97.8	Very high	59 Å²	59	47 Å²	47	49%	0.488	27%	0.273	S	S	.	.	H	α-helix	trans	-67.3	-44.5	176.5	0	0	0	0	0	112	D163 K164 D165 K170 A171	D163-A167 WeakPolarHBondContact O-CB 3.18Å; D163-A167 PolarHBondContact O-N 3.08Å; D163-A167 VanDerWaalsContact O-N 3.07Å; K164-A167 PolarHBondContact O-N 3.29Å; D165-A167 VanDerWaalsContact C-N 3.29Å; D165-A167 PolarHBondContact O-N 3.29Å; A167-K170 PolarHBondContact O-N 3.4Å; A167-A171 WeakPolarHBondContact O-CB 3.35Å; A167-A171 PolarHBondContact O-N 2.9Å
168	H	98.3	Very high	97.8	Very high	48 Å²	48	51 Å²	51	22%	0.222	31%	0.307	C	S	.	.	H	α-helix	trans	-60.5	-48.4	179.2	-176	54.7	0	0	0	112	L114 K164 D165 A171 R172	L114-H168 WeakPolarHBondContact CD2-NE2 3.37Å; K164-H168 WeakPolarHBondContact O-CB 3.26Å; K164-H168 PolarHBondContact O-N 2.92Å; D165-H168 PolarHBondContact O-N 3.33Å; H168-A171 PolarHBondContact O-N 3.18Å; H168-R172 PolarHBondContact O-N 2.86Å
169	M	98.6	Very high	97.8	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-65.2	-40.8	176.5	-68.2	177.6	60.6	0	0	112	T100 I102 F110 L114 F132 D165 L173 L185	T100-M169 HydrophobicContact CG2-CE 3.76Å; I102-M169 HydrophobicContact CD1-CE 3.92Å; I102-M169 HydrophobicContact CG1-CE 4.19Å; F110-M169 HydrophobicContact CE1-CE 4.49Å; L114-M169 HydrophobicContact CD1-CG 4.24Å; F132-M169 HydrophobicContact CE1-CG 4.44Å; F132-M169 HydrophobicContact CE2-SD 4.44Å; F132-M169 HydrophobicContact CZ-CG 3.91Å; F132-M169 HydrophobicContact CZ-SD 3.81Å; D165-M169 WeakPolarHBondContact O-CB 3.13Å; D165-M169 WeakPolarHBondContact O-CG 3.2Å; D165-M169 PolarHBondContact O-N 3.34Å; M169-L173 VanDerWaalsContact O-CB 3.31Å; M169-L173 WeakPolarHBondContact O-CB 3.39Å; M169-L173 PolarHBondContact O-N 2.7Å; M169-L185 HydrophobicContact CB-CD1 3.7Å; M169-L185 HydrophobicContact CE-CD1 4.19Å; M169-L185 HydrophobicContact CE-CD2 3.56Å
170	K	98.8	Very high	97.9	Very high	110 Å²	110	54.8 Å²	54.8	48%	0.478	35%	0.349	S	S	.	.	H	α-helix	trans	-64.8	-37.9	176.5	-75.6	167.8	-171	172.3	0	112.7	S166 A167 L173 A174 F187	S166-K170 VanDerWaalsContact O-CB 3.25Å; S166-K170 WeakPolarHBondContact O-CB 3.47Å; S166-K170 VanDerWaalsContact O-CD 3.27Å; S166-K170 WeakPolarHBondContact O-CD 3.17Å; S166-K170 WeakPolarHBondContact O-CG 3.45Å; S166-K170 PolarHBondContact O-N 2.86Å; A167-K170 PolarHBondContact O-N 3.4Å; K170-L173 WeakPolarHBondContact O-CB 3.45Å; K170-L173 PolarHBondContact O-N 3.36Å; K170-A174 PolarHBondContact O-N 3.19Å; K170-A174 VanDerWaalsContact O-N 3.08Å; K170-F187 HydrophobicContact CD-CE2 4.36Å; K170-F187 HydrophobicContact CG-CE2 4.19Å; K170-F187 HydrophobicContact CG-CZ 4.25Å
171	A	98.4	Very high	98.2	Very high	53 Å²	53	54.8 Å²	54.8	44%	0.438	33%	0.331	S	S	.	.	H	α-helix	trans	-62.7	-51.8	175.9	0	0	0	0	0	111.2	A167 H168 L173 A174 E175	A167-A171 WeakPolarHBondContact O-CB 3.35Å; A167-A171 PolarHBondContact O-N 2.9Å; H168-A171 PolarHBondContact O-N 3.18Å; A171-L173 PolarHBondContact O-N 2.83Å; A171-A174 WeakPolarHBondContact O-CB 3.19Å; A171-A174 PolarHBondContact O-N 3.08Å; A171-A174 VanDerWaalsContact O-N 3.15Å; A171-E175 PolarHBondContact O-N 2.99Å
172	R	98.4	Very high	98.2	Very high	48 Å²	48	58.1 Å²	58.1	18%	0.181	35%	0.348	C	S	.	.	H	α-helix	trans	-63	-30.1	175.5	-177.2	54.6	55.3	81.9	-4.1	112.6	F110 S113 L114 H168 E175 Y176	F110-R172 HydrophobicContact CD2-CG 4.08Å; F110-R172 HydrophobicContact CE2-CB 3.99Å; F110-R172 HydrophobicContact CE2-CG 3.69Å; F110-R172 HydrophobicContact CZ-CG 4.46Å; S113-R172 VanDerWaalsContact CB-NH1 3.34Å; S113-R172 PolarHBondContact O-NH1 3.23Å; S113-R172 PolarHBondContact OG-NH1 3.07Å; L114-R172 HydrophobicContact CD1-CB 4.41Å; L114-R172 HydrophobicContact CD1-CG 4.27Å; L114-R172 HydrophobicContact CD2-CB 3.79Å; L114-R172 HydrophobicContact CD2-CG 3.77Å; L114-R172 HydrophobicContact CG-CB 4.43Å; L114-R172 HydrophobicContact CG-CG 4.05Å; H168-R172 PolarHBondContact O-N 2.86Å; R172-E175 VanDerWaalsContact CD-OE2 3.3Å; R172-E175 WeakPolarHBondContact CD-OE2 3.34Å; R172-E175 IonicContact CZ-OE2 3.79Å; R172-E175 IonicContact NE-OE2 2.75Å; R172-E175 PolarHBondContact NE-OE2 3Å; R172-E175 IonicContact NH2-OE2 3.43Å; R172-E175 PolarHBondContact O-N 3.39Å; R172-Y176 HydrophobicContact CG-CD2 4.14Å; R172-Y176 HydrophobicContact CG-CE2 4.27Å; R172-Y176 WeakPolarHBondContact O-CD2 3.18Å; R172-Y176 PolarHBondContact O-N 3.11Å
173	L	98.7	Very high	98.4	Very high	19 Å²	19	57.6 Å²	57.6	10%	0.099	34%	0.343	C	S	.	.	H	α-helix	trans	-65.5	-42	175.7	-176.3	70.2	0	0	0	111.2	F110 M169 K170 A171 Y176 K177 V183 L185	F110-L173 HydrophobicContact CE2-CB 4.15Å; F110-L173 HydrophobicContact CE2-CD1 4.35Å; F110-L173 HydrophobicContact CZ-CB 4.47Å; M169-L173 VanDerWaalsContact O-CB 3.31Å; M169-L173 WeakPolarHBondContact O-CB 3.39Å; M169-L173 PolarHBondContact O-N 2.7Å; K170-L173 WeakPolarHBondContact O-CB 3.45Å; K170-L173 PolarHBondContact O-N 3.36Å; A171-L173 PolarHBondContact O-N 2.83Å; L173-Y176 PolarHBondContact O-N 2.94Å; L173-K177 HydrophobicContact CD1-CG 4.44Å; L173-K177 HydrophobicContact CG-CD 4.26Å; L173-K177 HydrophobicContact CG-CG 4.45Å; L173-K177 WeakPolarHBondContact O-CB 3.4Å; L173-K177 WeakPolarHBondContact O-CG 3.42Å; L173-K177 PolarHBondContact O-N 3.36Å; L173-V183 HydrophobicContact CD1-CB 4.38Å; L173-V183 HydrophobicContact CD1-CG1 3.84Å; L173-V183 HydrophobicContact CD1-CG2 4Å; L173-L185 HydrophobicContact CB-CD1 4.09Å; L173-L185 HydrophobicContact CD1-CG 4.22Å; L173-L185 HydrophobicContact CD2-CB 4.2Å; L173-L185 HydrophobicContact CD2-CD1 3.96Å; L173-L185 HydrophobicContact CD2-CG 3.88Å; L173-L185 HydrophobicContact CG-CD1 4.44Å; L173-L185 HydrophobicContact CG-CG 4.44Å
174	A	98.7	Very high	98.5	Very high	63 Å²	63	55.2 Å²	55.2	52%	0.521	33%	0.331	S	S	.	.	H	α-helix	trans	-61.9	-43.4	176.6	0	0	0	0	0	111.5	K170 A171 K177 A178	K170-A174 PolarHBondContact O-N 3.19Å; K170-A174 VanDerWaalsContact O-N 3.08Å; A171-A174 WeakPolarHBondContact O-CB 3.19Å; A171-A174 PolarHBondContact O-N 3.08Å; A171-A174 VanDerWaalsContact O-N 3.15Å; A174-K177 PolarHBondContact O-N 3.14Å; A174-A178 VanDerWaalsContact O-CB 3.27Å; A174-A178 WeakPolarHBondContact O-CB 3.38Å; A174-A178 PolarHBondContact O-N 3.33Å
175	E	98.4	Very high	98.5	Very high	110 Å²	110	53 Å²	53	51%	0.514	32%	0.322	S	S	.	.	H	α-helix	trans	-58.4	-46.7	173.3	-65.7	168.5	-168.8	0	0	111.7	A171 R172 A178 A179	A171-E175 PolarHBondContact O-N 2.99Å; R172-E175 VanDerWaalsContact CD-OE2 3.3Å; R172-E175 WeakPolarHBondContact CD-OE2 3.34Å; R172-E175 IonicContact CZ-OE2 3.79Å; R172-E175 IonicContact NE-OE2 2.75Å; R172-E175 PolarHBondContact NE-OE2 3Å; R172-E175 IonicContact NH2-OE2 3.43Å; R172-E175 PolarHBondContact O-N 3.39Å; E175-A178 PolarHBondContact O-N 3.28Å; E175-A179 WeakPolarHBondContact O-CB 3.09Å; E175-A179 PolarHBondContact O-N 3.42Å
176	Y	98.4	Very high	98.5	Very high	28 Å²	28	56.4 Å²	56.4	11%	0.11	34%	0.338	C	S	.	.	H	α-helix	trans	-67.2	-42.4	-179.4	-95.3	-121	0	0	0	113	K109 F110 S113 R172 L173 A179 G180 F181 V183	K109-Y176 HydrophobicContact CD-CE1 4.5Å; K109-Y176 HydrophobicContact CG-CE1 4.23Å; K109-Y176 PolarHBondContact O-OH 2.89Å; F110-Y176 VanDerWaalsContact CA-CE1 3.49Å; F110-Y176 HydrophobicContact CB-CD1 3.94Å; F110-Y176 HydrophobicContact CB-CE1 3.87Å; F110-Y176 HydrophobicContact CD2-CD1 4.02Å; F110-Y176 HydrophobicContact CD2-CD2 4.28Å; F110-Y176 HydrophobicContact CD2-CE1 4.46Å; F110-Y176 AromaticContact CD2-CG 3.93Å; F110-Y176 HydrophobicContact CD2-CG 3.93Å; S113-Y176 WeakPolarHBondContact CB-OH 3.25Å; R172-Y176 HydrophobicContact CG-CD2 4.14Å; R172-Y176 HydrophobicContact CG-CE2 4.27Å; R172-Y176 WeakPolarHBondContact O-CD2 3.18Å; R172-Y176 PolarHBondContact O-N 3.11Å; L173-Y176 PolarHBondContact O-N 2.94Å; Y176-A179 CarbonylContact O-C 3.54Å; Y176-A179 PolarHBondContact O-N 2.89Å; Y176-G180 PolarHBondContact O-N 2.85Å; Y176-F181 HydrophobicContact CD1-CB 3.8Å; Y176-F181 AromaticContact CD1-CD2 3.68Å; Y176-F181 HydrophobicContact CD1-CD2 3.68Å; Y176-F181 AromaticContact CD1-CG 3.86Å; Y176-F181 HydrophobicContact CD1-CG 3.86Å; Y176-F181 HydrophobicContact CE1-CD2 4.08Å; Y176-F181 HydrophobicContact CE1-CG 4.3Å; Y176-F181 HydrophobicContact CG-CB 4.42Å; Y176-F181 AromaticContact CG-CD2 4Å; Y176-F181 HydrophobicContact CG-CD2 4Å; Y176-F181 PolarHBondContact O-N 2.65Å; Y176-V183 HydrophobicContact CD1-CG1 4.04Å; Y176-V183 HydrophobicContact CG-CG1 4.36Å
177	K	98.4	Very high	98.5	Very high	100 Å²	100	58.9 Å²	58.9	44%	0.435	35%	0.347	S	S	.	.	H	α-helix	trans	-66.5	-39	176	-73.8	-173	177.6	-178.5	0	111.6	L173 A174 A179 G180 V183 D184	L173-K177 HydrophobicContact CD1-CG 4.44Å; L173-K177 HydrophobicContact CG-CD 4.26Å; L173-K177 HydrophobicContact CG-CG 4.45Å; L173-K177 WeakPolarHBondContact O-CB 3.4Å; L173-K177 WeakPolarHBondContact O-CG 3.42Å; L173-K177 PolarHBondContact O-N 3.36Å; A174-K177 PolarHBondContact O-N 3.14Å; K177-A179 VanDerWaalsContact C-N 3.27Å; K177-A179 PolarHBondContact O-N 2.94Å; K177-G180 PolarHBondContact O-N 2.87Å; K177-V183 WeakPolarHBondContact CE-O 3.27Å; K177-D184 IonicContact NZ-OD1 3.18Å; K177-D184 PolarHBondContact NZ-OD1 3.23Å
178	A	98.5	Very high	98.5	Very high	91 Å²	91	57.2 Å²	57.2	75%	0.752	33%	0.33	S	S	*	.	H	α-helix	trans	-63.7	-32.2	173.8	0	0	0	0	0	112.7	A174 E175 G180	A174-A178 VanDerWaalsContact O-CB 3.27Å; A174-A178 WeakPolarHBondContact O-CB 3.38Å; A174-A178 PolarHBondContact O-N 3.33Å; E175-A178 PolarHBondContact O-N 3.28Å; A178-G180 VanDerWaalsContact C-N 3.28Å; A178-G180 PolarHBondContact O-N 2.87Å
179	A	98.4	Very high	98.3	Very high	65 Å²	65	59.8 Å²	59.8	54%	0.537	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	3.6	173.2	0	0	0	0	0	114.4	E175 Y176 K177 F181	E175-A179 WeakPolarHBondContact O-CB 3.09Å; E175-A179 PolarHBondContact O-N 3.42Å; Y176-A179 CarbonylContact O-C 3.54Å; Y176-A179 PolarHBondContact O-N 2.89Å; K177-A179 VanDerWaalsContact C-N 3.27Å; K177-A179 PolarHBondContact O-N 2.94Å; A179-F181 HydrophobicContact CB-CD2 3.81Å; A179-F181 HydrophobicContact CB-CE2 3.67Å
180	G	98.4	Very high	98.2	Very high	63 Å²	63	62.8 Å²	62.8	65%	0.649	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.9	16.9	176	0	0	0	0	0	115.8	Y176 K177 A178	Y176-G180 PolarHBondContact O-N 2.85Å; K177-G180 PolarHBondContact O-N 2.87Å; A178-G180 VanDerWaalsContact C-N 3.28Å; A178-G180 PolarHBondContact O-N 2.87Å
181	F	98.7	Very high	98.2	Very high	64 Å²	64	57.5 Å²	57.5	28%	0.281	34%	0.336	S	S	.	.			trans	-77.6	143.7	173.7	-65	-66	0	0	0	112	D106 K109 Y176 A179 V183	D106-F181 HydrophobicContact CB-CB 4.01Å; D106-F181 HydrophobicContact CB-CD1 4.27Å; D106-F181 HydrophobicContact CB-CG 4.49Å; K109-F181 HydrophobicContact CD-CE1 4.38Å; Y176-F181 HydrophobicContact CD1-CB 3.8Å; Y176-F181 AromaticContact CD1-CD2 3.68Å; Y176-F181 HydrophobicContact CD1-CD2 3.68Å; Y176-F181 AromaticContact CD1-CG 3.86Å; Y176-F181 HydrophobicContact CD1-CG 3.86Å; Y176-F181 HydrophobicContact CE1-CD2 4.08Å; Y176-F181 HydrophobicContact CE1-CG 4.3Å; Y176-F181 HydrophobicContact CG-CB 4.42Å; Y176-F181 AromaticContact CG-CD2 4Å; Y176-F181 HydrophobicContact CG-CD2 4Å; Y176-F181 PolarHBondContact O-N 2.65Å; A179-F181 HydrophobicContact CB-CD2 3.81Å; A179-F181 HydrophobicContact CB-CE2 3.67Å; F181-V183 HydrophobicContact CB-CG1 4.4Å; F181-V183 PolarHBondContact O-N 3.16Å
182	D	98.6	Very high	98.2	Very high	77 Å²	77	55 Å²	55	41%	0.412	32%	0.315	S	S	.	.			trans	-89.7	94.4	175.3	162.3	40.4	0	0	0	109.4	G104 K105 D106	G104-D182 CarbonylContact C-O 3.58Å; G104-D182 VanDerWaalsContact C-O 3.29Å; G104-D182 WeakPolarHBondContact CA-O 3.3Å; G104-D182 WeakPolarHBondContact CA-OD1 3.22Å; K105-D182 WeakPolarHBondContact CB-OD2 3.47Å; K105-D182 HydrophobicContact CD-CB 4.02Å; K105-D182 HydrophobicContact CG-CB 4Å; K105-D182 WeakPolarHBondContact CG-OD2 3.46Å; K105-D182 PolarHBondContact N-O 3.11Å; K105-D182 PolarHBondContact N-OD2 2.6Å; D106-D182 WeakPolarHBondContact CB-O 3.37Å; D106-D182 PolarHBondContact N-O 3.29Å; D106-D182 PolarHBondContact OD2-N 2.86Å
183	V	98.8	Very high	98.2	Very high	5 Å²	5	52.8 Å²	52.8	3%	0.03	31%	0.307	C	S	.	.			trans	-149.5	144.8	176.4	53.5	0	0	0	0	110.7	I102 H103 F110 L173 Y176 K177 F181	I102-V183 HydrophobicContact CG2-CG2 3.84Å; H103-V183 VanDerWaalsContact O-CA 3.29Å; H103-V183 WeakPolarHBondContact O-CA 3.3Å; F110-V183 HydrophobicContact CB-CB 4.41Å; F110-V183 HydrophobicContact CB-CG1 4.47Å; F110-V183 HydrophobicContact CB-CG2 3.84Å; F110-V183 HydrophobicContact CD1-CG2 4.05Å; F110-V183 HydrophobicContact CD2-CG1 4.3Å; F110-V183 HydrophobicContact CD2-CG2 4.11Å; F110-V183 HydrophobicContact CG-CG2 3.72Å; L173-V183 HydrophobicContact CD1-CB 4.38Å; L173-V183 HydrophobicContact CD1-CG1 3.84Å; L173-V183 HydrophobicContact CD1-CG2 4Å; Y176-V183 HydrophobicContact CD1-CG1 4.04Å; Y176-V183 HydrophobicContact CG-CG1 4.36Å; K177-V183 WeakPolarHBondContact CE-O 3.27Å; F181-V183 HydrophobicContact CB-CG1 4.4Å; F181-V183 PolarHBondContact O-N 3.16Å
184	D	98.6	Very high	98.3	Very high	75 Å²	75	51.9 Å²	51.9	40%	0.401	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	162.1	172.2	-155	25.8	0	0	0	113.1	I102 H103 K177	I102-D184 WeakPolarHBondContact CA-O 3.09Å; H103-D184 HydrophobicContact CB-CB 4.43Å; H103-D184 PolarHBondContact N-O 2.8Å; H103-D184 PolarHBondContact O-N 3.12Å; K177-D184 IonicContact NZ-OD1 3.18Å; K177-D184 PolarHBondContact NZ-OD1 3.23Å
185	L	98.8	Very high	98.3	Very high	20 Å²	20	49 Å²	49	11%	0.105	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	124.2	-177.9	-64	179.6	0	0	0	111.9	T100 I102 F110 M169 L173 F187	T100-L185 HydrophobicContact CG2-CD2 4.3Å; I102-L185 HydrophobicContact CB-CD2 4.26Å; I102-L185 HydrophobicContact CD1-CD2 4.37Å; I102-L185 HydrophobicContact CG1-CD2 3.77Å; I102-L185 HydrophobicContact CG2-CD2 4.01Å; F110-L185 HydrophobicContact CE1-CD2 3.91Å; F110-L185 HydrophobicContact CZ-CD1 4.28Å; F110-L185 HydrophobicContact CZ-CD2 4.2Å; M169-L185 HydrophobicContact CB-CD1 3.7Å; M169-L185 HydrophobicContact CE-CD1 4.19Å; M169-L185 HydrophobicContact CE-CD2 3.56Å; L173-L185 HydrophobicContact CB-CD1 4.09Å; L173-L185 HydrophobicContact CD1-CG 4.22Å; L173-L185 HydrophobicContact CD2-CB 4.2Å; L173-L185 HydrophobicContact CD2-CD1 3.96Å; L173-L185 HydrophobicContact CD2-CG 3.88Å; L173-L185 HydrophobicContact CG-CD1 4.44Å; L173-L185 HydrophobicContact CG-CG 4.44Å; L185-F187 HydrophobicContact CB-CE2 3.98Å; L185-F187 HydrophobicContact CB-CZ 4.41Å; L185-F187 HydrophobicContact CD1-CE2 4.33Å; L185-F187 HydrophobicContact CD1-CZ 4.13Å
186	E	98.6	Very high	98.3	Very high	72 Å²	72	43.8 Å²	43.8	34%	0.336	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	105.6	173.2	-178.3	-161.5	148.5	0	0	108.8	T100 K101 H103 I188	T100-E186 CarbonylContact C-O 3.56Å; T100-E186 WeakPolarHBondContact CA-O 3.25Å; K101-E186 HydrophobicContact CB-CB 4.25Å; K101-E186 WeakPolarHBondContact CD-OE2 3Å; K101-E186 PolarHBondContact N-O 3.26Å; K101-E186 IonicContact NZ-OE1 2.77Å; K101-E186 PolarHBondContact NZ-OE1 3.29Å; K101-E186 IonicContact NZ-OE2 3.59Å; K101-E186 PolarHBondContact O-N 2.63Å; H103-E186 IonicContact CD2-OE2 3.64Å; H103-E186 IonicContact CE1-OE2 3.91Å; H103-E186 IonicContact NE2-OE2 2.99Å; H103-E186 PolarHBondContact NE2-OE2 2.86Å; E186-I188 HydrophobicContact CG-CG2 3.86Å; E186-I188 WeakPolarHBondContact OE1-CG2 3.38Å
187	F	98.2	Very high	98.3	Very high	66 Å²	66	42.4 Å²	42.4	29%	0.289	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	123	171.2	-59.8	-86.7	0	0	0	108.3	L98 T100 S166 K170 L185	L98-F187 HydrophobicContact CD1-CD1 4Å; L98-F187 HydrophobicContact CD2-CD1 4.4Å; L98-F187 HydrophobicContact CD2-CE1 4.31Å; T100-F187 HydrophobicContact CG2-CD1 3.91Å; T100-F187 HydrophobicContact CG2-CE1 3.93Å; T100-F187 HydrophobicContact CG2-CG 4.4Å; T100-F187 HydrophobicContact CG2-CZ 4.41Å; T100-F187 VanDerWaalsContact OG1-CD1 3.3Å; T100-F187 WeakPolarHBondContact OG1-CD1 3.33Å; S166-F187 WeakPolarHBondContact OG-CE1 3.38Å; K170-F187 HydrophobicContact CD-CE2 4.36Å; K170-F187 HydrophobicContact CG-CE2 4.19Å; K170-F187 HydrophobicContact CG-CZ 4.25Å; L185-F187 HydrophobicContact CB-CE2 3.98Å; L185-F187 HydrophobicContact CB-CZ 4.41Å; L185-F187 HydrophobicContact CD1-CE2 4.33Å; L185-F187 HydrophobicContact CD1-CZ 4.13Å
188	I	97.2	Very high	98.3	Very high	25 Å²	25	40.6 Å²	40.6	13%	0.128	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	142.2	-172.7	68.9	-179.1	0	0	0	111.6	Q99 K101 Y154 E186 E190	Q99-I188 HydrophobicContact CB-CD1 3.92Å; Q99-I188 HydrophobicContact CB-CG1 3.45Å; Q99-I188 VanDerWaalsContact CB-CG1 3.45Å; Q99-I188 PolarHBondContact O-N 3.47Å; K101-I188 HydrophobicContact CD-CG2 4.36Å; K101-I188 HydrophobicContact CG-CG2 4.3Å; Y154-I188 HydrophobicContact CE2-CD1 4.16Å; E186-I188 HydrophobicContact CG-CG2 3.86Å; E186-I188 WeakPolarHBondContact OE1-CG2 3.38Å; I188-E190 VanDerWaalsContact C-N 3.34Å; I188-E190 HydrophobicContact CB-CG 4.28Å; I188-E190 HydrophobicContact CD1-CB 4.33Å; I188-E190 HydrophobicContact CD1-CG 3.85Å; I188-E190 HydrophobicContact CG1-CB 4.46Å; I188-E190 HydrophobicContact CG1-CG 4.15Å
189	D	94.1	Very high	98.3	Very high	102 Å²	102	37.3 Å²	37.3	55%	0.545	22%	0.217	S	C	.	.			trans	-99.1	36.9	178.3	-172	34.1	0	0	0	111.9	R250	D189-R250 WeakPolarHBondContact O-CB 3.13Å; D189-R250 WeakPolarHBondContact O-CD 3.34Å; D189-R250 IonicContact OD1-CZ 2.68Å; D189-R250 IonicContact OD1-NH1 2.87Å; D189-R250 PolarHBondContact OD1-NH1 3.42Å; D189-R250 VanDerWaalsContact OD2-CD 3.22Å; D189-R250 WeakPolarHBondContact OD2-CD 3.38Å; D189-R250 IonicContact OD2-CZ 3.86Å; D189-R250 IonicContact OD2-NE 3.74Å; D189-R250 PolarHBondContact OD2-NE 2.78Å; D189-R250 IonicContact OD2-NH1 3.93Å; D189-R250 PolarHBondContact OD2-NH1 3.48Å; D189-R250 VanDerWaalsContact OD2-NH1 3.15Å
190	E	97.6	Very high	98.3	Very high	62 Å²	62	34.3 Å²	34.3	29%	0.29	19%	0.192	S	C	.	.			trans	-75.3	151.8	176.1	-59.7	-60.9	-173	0	0	111.4	Q99 I188 P249 R250	Q99-E190 PolarHBondContact NE2-O 3.1Å; I188-E190 VanDerWaalsContact C-N 3.34Å; I188-E190 HydrophobicContact CB-CG 4.28Å; I188-E190 HydrophobicContact CD1-CB 4.33Å; I188-E190 HydrophobicContact CD1-CG 3.85Å; I188-E190 HydrophobicContact CG1-CB 4.46Å; I188-E190 HydrophobicContact CG1-CG 4.15Å; E190-P249 WeakPolarHBondContact OE2-CA 3.46Å; E190-R250 PolarHBondContact OE2-N 3.24Å
191	A	98.6	Very high	98.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	153.2	171.3	0	0	0	0	0	110.3	P50 S247 V248 V253	P50-A191 HydrophobicContact CG-CB 4.16Å; A191-S247 CarbonylContact O-C 3.29Å; A191-S247 WeakPolarHBondContact O-CA 3.46Å; A191-V248 PolarHBondContact N-O 2.9Å; A191-V248 PolarHBondContact O-N 2.8Å; A191-V253 HydrophobicContact CB-CB 3.5Å; A191-V253 VanDerWaalsContact CB-CB 3.5Å; A191-V253 HydrophobicContact CB-CG1 3.55Å; A191-V253 HydrophobicContact CB-CG2 3.61Å
192	L	98.8	Very high	98.2	Very high	1 Å²	1	36 Å²	36	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	119.6	179.3	-167.7	68.4	0	0	0	109.3	V94 S95 M97 Q99 V156 E245 I246	V94-L192 CarbonylContact C-O 3.48Å; V94-L192 VanDerWaalsContact C-O 3.26Å; V94-L192 WeakPolarHBondContact CA-O 3.32Å; V94-L192 HydrophobicContact CG2-CB 4.05Å; V94-L192 HydrophobicContact CG2-CD2 3.91Å; V94-L192 HydrophobicContact CG2-CG 3.69Å; V94-L192 VanDerWaalsContact CG2-O 3.27Å; V94-L192 WeakPolarHBondContact CG2-O 3.29Å; V94-L192 PolarHBondContact N-O 3.04Å; S95-L192 PolarHBondContact N-O 2.81Å; S95-L192 PolarHBondContact OG-N 2.67Å; S95-L192 PolarHBondContact OG-O 2.85Å; M97-L192 HydrophobicContact CB-CD2 4.38Å; M97-L192 HydrophobicContact CE-CD2 3.47Å; M97-L192 VanDerWaalsContact CE-CD2 3.47Å; Q99-L192 HydrophobicContact CG-CD2 4.37Å; V156-L192 HydrophobicContact CG1-CD2 3.85Å; L192-E245 HydrophobicContact CD1-CB 4.42Å; L192-I246 WeakPolarHBondContact CA-O 3.44Å
193	I	98.8	Very high	98.2	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	140.7	175.2	62.1	173.6	0	0	0	110.1	L51 I91 F92 E245 I246 V248 V253 L256 L260	L51-I193 HydrophobicContact CD1-CG2 3.78Å; I91-I193 HydrophobicContact CG2-CB 4.33Å; F92-I193 WeakPolarHBondContact O-CA 3.46Å; I193-E245 CarbonylContact O-C 3.55Å; I193-E245 WeakPolarHBondContact O-CA 3.46Å; I193-I246 HydrophobicContact CD1-CD1 4.46Å; I193-I246 HydrophobicContact CG1-CB 4.04Å; I193-I246 HydrophobicContact CG1-CG1 4.47Å; I193-I246 PolarHBondContact N-O 2.92Å; I193-I246 PolarHBondContact O-N 3.42Å; I193-V248 HydrophobicContact CG1-CG2 4.44Å; I193-V253 HydrophobicContact CG2-CG2 3.78Å; I193-L256 HydrophobicContact CD1-CD2 3.84Å; I193-L256 HydrophobicContact CD1-CG 4.12Å; I193-L260 HydrophobicContact CD1-CD1 3.81Å
194	A	98.9	Very high	98.2	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.008	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	125	170.4	0	0	0	0	0	109.3	I91 F92 V94 Q196 V244 E245	I91-A194 CarbonylContact C-O 3.52Å; I91-A194 WeakPolarHBondContact CA-O 3.46Å; F92-A194 HydrophobicContact CB-CB 4.29Å; F92-A194 PolarHBondContact N-O 2.95Å; F92-A194 PolarHBondContact O-N 3.4Å; V94-A194 HydrophobicContact CG2-CB 4.42Å; A194-Q196 HydrophobicContact CB-CG 3.93Å; A194-V244 CarbonylContact C-O 3.5Å; A194-V244 WeakPolarHBondContact CA-O 3.19Å; A194-E245 HydrophobicContact CB-CG 3.91Å
195	L	98.9	Very high	98.1	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	119.5	168.4	-177.8	64	0	0	0	107.1	C89 S90 I91 T200 V203 L204 G243 V244 L260 V266	C89-L195 HydrophobicContact CB-CD1 4.16Å; S90-L195 WeakPolarHBondContact O-CA 3.35Å; I91-L195 HydrophobicContact CG1-CD1 3.99Å; L195-T200 HydrophobicContact CB-CG2 4.19Å; L195-T200 HydrophobicContact CD2-CG2 3.9Å; L195-T200 HydrophobicContact CG-CG2 3.77Å; L195-V203 HydrophobicContact CD2-CB 4.48Å; L195-V203 HydrophobicContact CD2-CG1 4.08Å; L195-L204 HydrophobicContact CD2-CB 4.38Å; L195-G243 CarbonylContact O-C 3.57Å; L195-G243 VanDerWaalsContact O-CA 3.24Å; L195-G243 WeakPolarHBondContact O-CA 3.38Å; L195-V244 HydrophobicContact CB-CG2 4.11Å; L195-V244 PolarHBondContact N-O 2.97Å; L195-V244 PolarHBondContact O-N 3.28Å; L195-V244 VanDerWaalsContact O-O 3.06Å; L195-L260 HydrophobicContact CD2-CD2 3.88Å; L195-V266 HydrophobicContact CD1-CG1 4.32Å
196	Q	98.9	Very high	98	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	138.7	-164.8	-57.1	-79.2	-72.4	0	0	110.7	T85 C89 S90 F92 A194 T200 C236 T239 V244	T85-Q196 HydrophobicContact CG2-CB 4.21Å; T85-Q196 WeakPolarHBondContact CG2-O 3.33Å; C89-Q196 CarbonylContact C-O 3.53Å; C89-Q196 WeakPolarHBondContact CA-O 3.37Å; C89-Q196 VanDerWaalsContact CB-O 3.28Å; C89-Q196 WeakPolarHBondContact CB-O 3.24Å; S90-Q196 PolarHBondContact N-O 3.41Å; S90-Q196 PolarHBondContact O-N 2.73Å; F92-Q196 HydrophobicContact CD2-CB 4.41Å; F92-Q196 HydrophobicContact CD2-CG 4.09Å; F92-Q196 HydrophobicContact CE2-CB 4.05Å; F92-Q196 HydrophobicContact CE2-CG 4.16Å; A194-Q196 HydrophobicContact CB-CG 3.93Å; Q196-T200 VanDerWaalsContact C-OG1 3.29Å; Q196-T200 WeakPolarHBondContact CA-OG1 3.31Å; Q196-T200 PolarHBondContact N-OG1 3.25Å; Q196-C236 PolarHBondContact NE2-O 3.39Å; Q196-T239 HydrophobicContact CB-CG2 3.72Å; Q196-T239 HydrophobicContact CG-CG2 3.8Å; Q196-T239 PolarHBondContact OE1-OG1 3.18Å; Q196-V244 PolarHBondContact NE2-O 2.49Å
197	G	98.8	Very high	97.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.181	C	C	.	.	S	Bend	trans	124.8	160.5	-179	0	0	0	0	0	113	T85 H88 T199 T200 D242	T85-G197 WeakPolarHBondContact O-CA 3.4Å; H88-G197 CarbonylContact O-C 3.58Å; H88-G197 VanDerWaalsContact O-CA 3.27Å; H88-G197 WeakPolarHBondContact O-CA 3.35Å; G197-T199 VanDerWaalsContact C-N 3.25Å; G197-T199 PolarHBondContact O-N 3.32Å; G197-T199 VanDerWaalsContact O-N 3.1Å; G197-T200 PolarHBondContact N-OG1 3.4Å; G197-T200 WeakPolarHBondContact O-CB 3.39Å; G197-T200 PolarHBondContact O-N 3Å; G197-T200 PolarHBondContact O-OG1 3.16Å; G197-D242 PolarHBondContact N-O 2.85Å
198	P	98.4	Very high	97.9	Very high	61 Å²	61	29.7 Å²	29.7	40%	0.396	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-29.5	-172.5	21.8	-36	0	0	0	115.6	R86 H88	R86-P198 WeakPolarHBondContact O-CD 3.38Å; R86-P198 WeakPolarHBondContact O-CG 3.28Å; H88-P198 WeakPolarHBondContact O-CD 3.38Å; H88-P198 WeakPolarHBondContact O-CG 3.46Å
199	T	98.6	Very high	97.7	Very high	23 Å²	23	38.7 Å²	38.7	14%	0.141	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	1.7	179.2	62.9	0	0	0	0	114.2	H88 C89 G197 A201 Q202 V203 E265	H88-T199 WeakPolarHBondContact CA-OG1 3.37Å; H88-T199 PolarHBondContact O-N 3.22Å; H88-T199 VanDerWaalsContact O-N 3.09Å; H88-T199 PolarHBondContact O-OG1 2.93Å; C89-T199 PolarHBondContact N-OG1 3.06Å; C89-T199 PolarHBondContact SG-OG1 2.99Å; C89-T199 VanDerWaalsContact SG-OG1 3.4Å; G197-T199 VanDerWaalsContact C-N 3.25Å; G197-T199 PolarHBondContact O-N 3.32Å; G197-T199 VanDerWaalsContact O-N 3.1Å; T199-A201 VanDerWaalsContact C-N 3.32Å; T199-A201 PolarHBondContact O-N 2.67Å; T199-Q202 PolarHBondContact O-N 3.26Å; T199-V203 WeakPolarHBondContact O-CG2 3.47Å; T199-V203 PolarHBondContact O-N 3.28Å; T199-E265 WeakPolarHBondContact CG2-OE2 3.49Å; T199-E265 PolarHBondContact OG1-OE2 3.06Å
200	T	98.3	Very high	97.5	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.006	20%	0.203	C	C	.	.	H	α-helix	trans	-51.3	-47.9	178.5	-64.5	0	0	0	0	112.7	C89 L195 Q196 G197 Q202 V203 L204 V244	C89-T200 WeakPolarHBondContact CB-OG1 3.33Å; L195-T200 HydrophobicContact CB-CG2 4.19Å; L195-T200 HydrophobicContact CD2-CG2 3.9Å; L195-T200 HydrophobicContact CG-CG2 3.77Å; Q196-T200 VanDerWaalsContact C-OG1 3.29Å; Q196-T200 WeakPolarHBondContact CA-OG1 3.31Å; Q196-T200 PolarHBondContact N-OG1 3.25Å; G197-T200 PolarHBondContact N-OG1 3.4Å; G197-T200 WeakPolarHBondContact O-CB 3.39Å; G197-T200 PolarHBondContact O-N 3Å; G197-T200 PolarHBondContact O-OG1 3.16Å; T200-Q202 PolarHBondContact O-N 3.06Å; T200-V203 PolarHBondContact O-N 3.12Å; T200-L204 WeakPolarHBondContact O-CB 3.09Å; T200-L204 PolarHBondContact O-N 2.79Å; T200-V244 HydrophobicContact CG2-CG2 4.24Å
201	A	97.3	Very high	97.4	Very high	28 Å²	28	36 Å²	36	23%	0.231	21%	0.207	C	C	.	.	H	α-helix	trans	-63.3	-42.4	-176	0	0	0	0	0	111.9	T199 Q205 L212	T199-A201 VanDerWaalsContact C-N 3.32Å; T199-A201 PolarHBondContact O-N 2.67Å; A201-Q205 WeakPolarHBondContact O-CB 3.43Å; A201-Q205 PolarHBondContact O-N 3.37Å; A201-L212 HydrophobicContact CB-CD2 4.2Å
202	Q	97.5	Very high	97.2	Very high	135 Å²	135	36.6 Å²	36.6	63%	0.631	21%	0.21	S	C	*	.	H	α-helix	trans	-63.2	-48.1	176	178.4	-172.9	-10.9	0	0	111.7	T199 T200	T199-Q202 PolarHBondContact O-N 3.26Å; T200-Q202 PolarHBondContact O-N 3.06Å
203	V	98.4	Very high	97	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.012	23%	0.229	C	C	.	.	H	α-helix	trans	-61.9	-48.7	-179.1	170.3	0	0	0	0	111.1	L195 T199 T200 L260 N263 E265 V266	L195-V203 HydrophobicContact CD2-CB 4.48Å; L195-V203 HydrophobicContact CD2-CG1 4.08Å; T199-V203 WeakPolarHBondContact O-CG2 3.47Å; T199-V203 PolarHBondContact O-N 3.28Å; T200-V203 PolarHBondContact O-N 3.12Å; V203-L260 HydrophobicContact CG1-CD2 3.85Å; V203-N263 HydrophobicContact CG1-CB 4.44Å; V203-E265 HydrophobicContact CG2-CB 3.98Å; V203-V266 HydrophobicContact CB-CG2 4.38Å; V203-V266 HydrophobicContact CG1-CG2 3.58Å; V203-V266 HydrophobicContact CG2-CG2 3.96Å
204	L	98.1	Very high	96.9	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-72.3	-35.6	-175.7	-170.3	68.7	0	0	0	112.4	L195 T200 A206 G207 L208 L212 V225 V233 V244 I246 L260	L195-L204 HydrophobicContact CD2-CB 4.38Å; T200-L204 WeakPolarHBondContact O-CB 3.09Å; T200-L204 PolarHBondContact O-N 2.79Å; L204-A206 PolarHBondContact O-N 3.07Å; L204-G207 WeakPolarHBondContact O-CA 3.03Å; L204-G207 PolarHBondContact O-N 3.21Å; L204-L208 HydrophobicContact CD2-CD1 4.1Å; L204-L208 HydrophobicContact CG-CD1 3.88Å; L204-L208 HydrophobicContact CG-CG 4.34Å; L204-L208 WeakPolarHBondContact O-CG 3.5Å; L204-L208 PolarHBondContact O-N 3.02Å; L204-L212 HydrophobicContact CB-CD2 3.96Å; L204-L212 HydrophobicContact CD2-CD1 4.21Å; L204-L212 HydrophobicContact CD2-CD2 3.85Å; L204-L212 HydrophobicContact CG-CD2 4.25Å; L204-V225 HydrophobicContact CD1-CG1 3.69Å; L204-V233 HydrophobicContact CD2-CG1 4.02Å; L204-V244 HydrophobicContact CD2-CB 4.37Å; L204-V244 HydrophobicContact CD2-CG1 3.92Å; L204-V244 HydrophobicContact CD2-CG2 3.66Å; L204-I246 HydrophobicContact CD1-CD1 3.71Å; L204-L260 HydrophobicContact CD1-CD2 4.48Å
205	Q	97.9	Very high	96.8	Very high	63 Å²	63	47.6 Å²	47.6	29%	0.294	27%	0.265	S	S	.	.	H	α-helix	trans	-58.3	-32.2	179.7	-177.2	60.2	80.3	0	0	112.6	A201 G207 L208 G210	A201-Q205 WeakPolarHBondContact O-CB 3.43Å; A201-Q205 PolarHBondContact O-N 3.37Å; Q205-G207 PolarHBondContact O-N 3.06Å; Q205-L208 PolarHBondContact NE2-O 2.87Å; Q205-L208 PolarHBondContact O-N 2.81Å; Q205-L208 VanDerWaalsContact O-N 3.12Å; Q205-G210 PolarHBondContact NE2-O 2.69Å; Q205-G210 PolarHBondContact OE1-O 3.01Å
206	A	97.3	Very high	96.8	Very high	82 Å²	82	49.6 Å²	49.6	68%	0.678	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-19.4	175	0	0	0	0	0	113.9	L204 F226	L204-A206 PolarHBondContact O-N 3.07Å; A206-F226 HydrophobicContact CB-CZ 4.41Å
207	G	96.6	Very high	96.8	Very high	13 Å²	13	52.6 Å²	52.6	13%	0.134	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	0.5	175.6	0	0	0	0	0	114.8	L204 Q205 F226	L204-G207 WeakPolarHBondContact O-CA 3.03Å; L204-G207 PolarHBondContact O-N 3.21Å; Q205-G207 PolarHBondContact O-N 3.06Å; G207-F226 VanDerWaalsContact CA-CZ 3.45Å; G207-F226 PolarHBondContact O-N 2.91Å
208	L	96.8	Very high	96.8	Very high	23 Å²	23	53.9 Å²	53.9	12%	0.12	30%	0.297	C	S	.	.			trans	-115.7	138.2	-172.4	-71.1	173.6	0	0	0	111.8	L204 Q205 L212 V223 V225	L204-L208 HydrophobicContact CD2-CD1 4.1Å; L204-L208 HydrophobicContact CG-CD1 3.88Å; L204-L208 HydrophobicContact CG-CG 4.34Å; L204-L208 WeakPolarHBondContact O-CG 3.5Å; L204-L208 PolarHBondContact O-N 3.02Å; Q205-L208 PolarHBondContact NE2-O 2.87Å; Q205-L208 PolarHBondContact O-N 2.81Å; Q205-L208 VanDerWaalsContact O-N 3.12Å; L208-L212 HydrophobicContact CD1-CB 4.08Å; L208-L212 HydrophobicContact CD1-CD1 3.98Å; L208-L212 HydrophobicContact CD1-CD2 4.19Å; L208-L212 HydrophobicContact CD1-CG 4.32Å; L208-V223 HydrophobicContact CD2-CB 4.42Å; L208-V223 HydrophobicContact CD2-CG1 3.68Å; L208-V223 HydrophobicContact CD2-CG2 3.82Å; L208-V225 HydrophobicContact CD2-CG2 3.93Å
209	K	93.4	Very high	96.8	Very high	214 Å²	214	52.3 Å²	52.3	93%	0.93	29%	0.287	S	S	*	.	S	Bend	trans	-80.6	-26.4	165	-66.2	-176.5	179.7	178.6	0	112.7
210	G	90.7	Very high	96.8	Very high	36 Å²	36	51.4 Å²	51.4	37%	0.371	28%	0.282	S	S	.	.	S	Bend	trans	-83.7	154.8	176.8	0	0	0	0	0	111.8	Q205 L212	Q205-G210 PolarHBondContact NE2-O 2.69Å; Q205-G210 PolarHBondContact OE1-O 3.01Å; G210-L212 PolarHBondContact O-N 3.41Å
211	D	94	Very high	96.8	Very high	72 Å²	72	54 Å²	54	39%	0.385	30%	0.297	S	S	.	.			trans	-82.4	111.5	176.4	170	10	0	0	0	110.4	S213 K214	D211-S213 VanDerWaalsContact C-N 3.29Å; D211-S213 VanDerWaalsContact CG-OG 3.25Å; D211-S213 PolarHBondContact O-N 3.12Å; D211-S213 WeakPolarHBondContact OD1-CB 3.34Å; D211-S213 PolarHBondContact OD1-N 3.42Å; D211-S213 PolarHBondContact OD1-OG 2.81Å; D211-S213 PolarHBondContact OD2-OG 2.9Å; D211-K214 HydrophobicContact CB-CD 4.24Å; D211-K214 PolarHBondContact O-N 2.6Å; D211-K214 VanDerWaalsContact OD2-CE 3.25Å; D211-K214 WeakPolarHBondContact OD2-CE 3.43Å; D211-K214 IonicContact OD2-NZ 2.95Å; D211-K214 PolarHBondContact OD2-NZ 3.22Å
212	L	95.4	Very high	96.8	Very high	11 Å²	11	55.7 Å²	55.7	6%	0.058	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-72.1	-19.2	-176	-173.2	62.5	0	0	0	112.9	A201 L204 L208 G210 K214 L215 R235	A201-L212 HydrophobicContact CB-CD2 4.2Å; L204-L212 HydrophobicContact CB-CD2 3.96Å; L204-L212 HydrophobicContact CD2-CD1 4.21Å; L204-L212 HydrophobicContact CD2-CD2 3.85Å; L204-L212 HydrophobicContact CG-CD2 4.25Å; L208-L212 HydrophobicContact CD1-CB 4.08Å; L208-L212 HydrophobicContact CD1-CD1 3.98Å; L208-L212 HydrophobicContact CD1-CD2 4.19Å; L208-L212 HydrophobicContact CD1-CG 4.32Å; G210-L212 PolarHBondContact O-N 3.41Å; L212-K214 PolarHBondContact O-N 2.89Å; L212-L215 HydrophobicContact CD1-CB 4.07Å; L212-L215 HydrophobicContact CD1-CD2 3.77Å; L212-L215 WeakPolarHBondContact O-CB 3.31Å; L212-L215 PolarHBondContact O-N 3.15Å; L212-R235 PolarHBondContact O-NH1 3.4Å; L212-R235 VanDerWaalsContact O-NH1 3.09Å
213	S	94.8	Very high	96.8	Very high	57 Å²	57	50.8 Å²	50.8	40%	0.399	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-63.4	-25.2	174.3	71.8	0	0	0	0	112.2	D211 L215 Y413	D211-S213 VanDerWaalsContact C-N 3.29Å; D211-S213 VanDerWaalsContact CG-OG 3.25Å; D211-S213 PolarHBondContact O-N 3.12Å; D211-S213 WeakPolarHBondContact OD1-CB 3.34Å; D211-S213 PolarHBondContact OD1-N 3.42Å; D211-S213 PolarHBondContact OD1-OG 2.81Å; D211-S213 PolarHBondContact OD2-OG 2.9Å; S213-L215 PolarHBondContact O-N 2.79Å; S213-Y413 VanDerWaalsContact O-CE1 3.22Å; S213-Y413 WeakPolarHBondContact O-CE1 3.49Å; S213-Y413 PolarHBondContact O-OH 2.94Å; S213-Y413 VanDerWaalsContact O-OH 3.08Å
214	K	96.1	Very high	96.8	Very high	162 Å²	162	54.1 Å²	54.1	70%	0.704	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-75.7	-11.4	175.8	-66.3	172.4	177.6	123.3	0	113.7	D211 L212	D211-K214 HydrophobicContact CB-CD 4.24Å; D211-K214 PolarHBondContact O-N 2.6Å; D211-K214 VanDerWaalsContact OD2-CE 3.25Å; D211-K214 WeakPolarHBondContact OD2-CE 3.43Å; D211-K214 IonicContact OD2-NZ 2.95Å; D211-K214 PolarHBondContact OD2-NZ 3.22Å; L212-K214 PolarHBondContact O-N 2.89Å
215	L	97.7	Very high	96.8	Very high	14 Å²	14	54.1 Å²	54.1	7%	0.073	30%	0.302	C	S	.	.			trans	-92.1	103	174.7	-162.6	74.1	0	0	0	108.3	L212 S213 T219 T221 V233 R235	L212-L215 HydrophobicContact CD1-CB 4.07Å; L212-L215 HydrophobicContact CD1-CD2 3.77Å; L212-L215 WeakPolarHBondContact O-CB 3.31Å; L212-L215 PolarHBondContact O-N 3.15Å; S213-L215 PolarHBondContact O-N 2.79Å; L215-T219 WeakPolarHBondContact CD1-OG1 3.4Å; L215-T221 HydrophobicContact CD1-CG2 4.23Å; L215-V233 HydrophobicContact CD2-CG1 3.87Å; L215-R235 HydrophobicContact CD2-CB 3.96Å; L215-R235 HydrophobicContact CG-CB 4.05Å; L215-R235 WeakPolarHBondContact O-CD 3.23Å; L215-R235 PolarHBondContact O-NH1 2.85Å
216	T	98.4	Very high	96.8	Very high	44 Å²	44	52.8 Å²	52.8	27%	0.27	30%	0.295	S	S	.	.			trans	-89.9	165.8	177.2	57.1	0	0	0	0	111.7	M218 T219 Y413 T414	T216-M218 PolarHBondContact O-N 3.43Å; T216-T219 PolarHBondContact N-OG1 2.91Å; T216-T219 WeakPolarHBondContact O-CB 3.28Å; T216-T219 PolarHBondContact O-N 2.79Å; T216-T219 PolarHBondContact O-OG1 3.32Å; T216-T219 WeakPolarHBondContact OG1-CG2 3.47Å; T216-Y413 HydrophobicContact CG2-CE1 4.09Å; T216-T414 WeakPolarHBondContact CG2-O 3.2Å
217	F	98.7	Very high	96.7	Very high	63 Å²	63	53.5 Å²	53.5	28%	0.276	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	134.7	-179.8	-179.3	-115.2	0	0	0	112.3	T219 R235 Y412 Y413	F217-T219 PolarHBondContact O-N 3.01Å; F217-R235 CarbonylContact C-O 3.59Å; F217-R235 WeakPolarHBondContact CA-O 3.3Å; F217-R235 WeakPolarHBondContact CD2-O 3.47Å; F217-Y412 HydrophobicContact CD1-CD2 4.43Å; F217-Y412 HydrophobicContact CD1-CG 4.25Å; F217-Y412 AromaticContact CD2-CD1 3.87Å; F217-Y412 HydrophobicContact CD2-CD1 3.87Å; F217-Y412 HydrophobicContact CD2-CG 4.01Å; F217-Y412 HydrophobicContact CE1-CD1 4.49Å; F217-Y412 AromaticContact CE1-CD2 3.99Å; F217-Y412 HydrophobicContact CE1-CD2 3.99Å; F217-Y412 HydrophobicContact CE1-CE2 4.32Å; F217-Y412 HydrophobicContact CE1-CG 4.09Å; F217-Y412 AromaticContact CE2-CD1 3.49Å; F217-Y412 HydrophobicContact CE2-CD1 3.49Å; F217-Y412 VanDerWaalsContact CE2-CD1 3.49Å; F217-Y412 HydrophobicContact CE2-CD2 4.41Å; F217-Y412 AromaticContact CE2-CE1 3.75Å; F217-Y412 HydrophobicContact CE2-CE1 3.75Å; F217-Y412 AromaticContact CE2-CG 3.85Å; F217-Y412 HydrophobicContact CE2-CG 3.85Å; F217-Y412 HydrophobicContact CG-CG 4.22Å; F217-Y412 AromaticContact CZ-CD1 3.84Å; F217-Y412 HydrophobicContact CZ-CD1 3.84Å; F217-Y412 AromaticContact CZ-CD2 3.98Å; F217-Y412 HydrophobicContact CZ-CD2 3.98Å; F217-Y412 AromaticContact CZ-CE1 3.88Å; F217-Y412 HydrophobicContact CZ-CE1 3.88Å; F217-Y412 HydrophobicContact CZ-CE2 4.03Å; F217-Y412 AromaticContact CZ-CG 3.89Å; F217-Y412 HydrophobicContact CZ-CG 3.89Å; F217-Y412 AromaticContact CZ-CZ 3.97Å; F217-Y413 VanDerWaalsContact CB-O 3.22Å; F217-Y413 WeakPolarHBondContact CB-O 3.38Å; F217-Y413 PolarHBondContact N-O 3.34Å
218	M	98.6	Very high	96.8	Very high	27 Å²	27	52.9 Å²	52.9	13%	0.133	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	28.1	-171.9	-54.8	-57.6	-70.2	0	0	114.8	G127 I144 T216 R235 C236	G127-M218 PolarHBondContact N-O 2.92Å; G127-M218 WeakPolarHBondContact O-CB 3.5Å; I144-M218 HydrophobicContact CD1-CE 4.28Å; I144-M218 HydrophobicContact CG1-CE 4.27Å; I144-M218 HydrophobicContact CG2-CE 3.91Å; T216-M218 PolarHBondContact O-N 3.43Å; M218-R235 PolarHBondContact N-O 2.8Å; M218-C236 HydrophobicContact SD-CB 3.67Å
219	T	98.8	Very high	96.8	Very high	28 Å²	28	54.1 Å²	54.1	17%	0.172	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-113.7	161.1	162.5	71.3	0	0	0	0	111.2	N125 L215 T216 F217 T234 R235	N125-T219 CarbonylContact O-C 3.51Å; N125-T219 WeakPolarHBondContact O-CA 3.45Å; L215-T219 WeakPolarHBondContact CD1-OG1 3.4Å; T216-T219 PolarHBondContact N-OG1 2.91Å; T216-T219 WeakPolarHBondContact O-CB 3.28Å; T216-T219 PolarHBondContact O-N 2.79Å; T216-T219 PolarHBondContact O-OG1 3.32Å; T216-T219 WeakPolarHBondContact OG1-CG2 3.47Å; F217-T219 PolarHBondContact O-N 3.01Å; T219-T234 WeakPolarHBondContact O-CA 3.22Å; T219-R235 PolarHBondContact O-N 2.93Å
220	S	98.6	Very high	96.9	Very high	5 Å²	5	49.2 Å²	49.2	4%	0.035	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	165.7	-173.8	58.1	0	0	0	0	112.7	N125 T146 R232 V233 T234	N125-S220 VanDerWaalsContact CB-O 3.25Å; N125-S220 WeakPolarHBondContact CB-O 3.21Å; N125-S220 PolarHBondContact O-N 3.04Å; N125-S220 PolarHBondContact O-OG 3.41Å; T146-S220 VanDerWaalsContact CG2-OG 3.24Å; T146-S220 WeakPolarHBondContact CG2-OG 3.42Å; S220-R232 PolarHBondContact OG-NH2 3.09Å; S220-V233 CarbonylContact C-O 3.07Å; S220-V233 WeakPolarHBondContact CA-O 3.48Å; S220-V233 WeakPolarHBondContact CB-O 3.13Å; S220-T234 WeakPolarHBondContact CB-OG1 3.21Å
221	T	97.7	Very high	97.3	Very high	54 Å²	54	47.5 Å²	47.5	33%	0.331	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	155.6	170.6	-169.5	0	0	0	0	110.6	L215 V223 R232 V233	L215-T221 HydrophobicContact CD1-CG2 4.23Å; T221-V223 HydrophobicContact CG2-CB 4.13Å; T221-V223 HydrophobicContact CG2-CG1 3.93Å; T221-R232 WeakPolarHBondContact O-CA 3.49Å; T221-V233 HydrophobicContact CG2-CB 4.4Å; T221-V233 PolarHBondContact N-O 3.26Å; T221-V233 PolarHBondContact O-N 2.7Å
222	L	97.2	Very high	97.5	Very high	65 Å²	65	44.5 Å²	44.5	34%	0.34	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	120.5	168.4	-170.3	72.2	0	0	0	107.4	D230 R232	L222-D230 WeakPolarHBondContact CD1-O 3.49Å; L222-R232 HydrophobicContact CD1-CB 4.39Å
223	V	97.4	Very high	97.7	Very high	32 Å²	32	44 Å²	44	19%	0.194	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	153.4	-169.3	67.9	0	0	0	0	111.7	L208 T221 V225 C231 V233	L208-V223 HydrophobicContact CD2-CB 4.42Å; L208-V223 HydrophobicContact CD2-CG1 3.68Å; L208-V223 HydrophobicContact CD2-CG2 3.82Å; T221-V223 HydrophobicContact CG2-CB 4.13Å; T221-V223 HydrophobicContact CG2-CG1 3.93Å; V223-V225 HydrophobicContact CG1-CG2 3.95Å; V223-C231 PolarHBondContact N-O 2.77Å; V223-C231 WeakPolarHBondContact O-CB 3.45Å; V223-C231 PolarHBondContact O-N 3.45Å; V223-V233 HydrophobicContact CG1-CB 4.28Å; V223-V233 HydrophobicContact CG1-CG2 3.62Å
224	T	98.3	Very high	97.9	Very high	72 Å²	72	41.5 Å²	41.5	44%	0.442	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	124.5	168.1	-48.8	0	0	0	0	110	V228	T224-V228 CarbonylContact C-O 3.56Å; T224-V228 VanDerWaalsContact CA-O 3.26Å; T224-V228 WeakPolarHBondContact CA-O 3.4Å; T224-V228 WeakPolarHBondContact CG2-O 3.48Å
225	V	98.2	Very high	98	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	119.5	177.6	-172.5	0	0	0	0	108.6	L204 L208 V223 S227 V228 C231 V233 I246 L256	L204-V225 HydrophobicContact CD1-CG1 3.69Å; L208-V225 HydrophobicContact CD2-CG2 3.93Å; V223-V225 HydrophobicContact CG1-CG2 3.95Å; V225-S227 VanDerWaalsContact C-N 3.28Å; V225-S227 PolarHBondContact O-N 2.92Å; V225-V228 PolarHBondContact N-O 3Å; V225-V228 WeakPolarHBondContact O-CB 3.44Å; V225-V228 PolarHBondContact O-N 3.02Å; V225-C231 HydrophobicContact CB-CB 4.33Å; V225-C231 HydrophobicContact CG2-CB 3.69Å; V225-V233 HydrophobicContact CG2-CG2 3.61Å; V225-I246 HydrophobicContact CG2-CG2 4.5Å; V225-L256 HydrophobicContact CB-CD1 4.28Å; V225-L256 HydrophobicContact CG1-CD1 3.7Å
226	F	97.4	Very high	98	Very high	34 Å²	34	33.7 Å²	33.7	15%	0.149	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.6	46.7	-178.2	-70.6	-70	0	0	0	113.7	A206 G207 V228 L256 K259 L260	A206-F226 HydrophobicContact CB-CZ 4.41Å; G207-F226 VanDerWaalsContact CA-CZ 3.45Å; G207-F226 PolarHBondContact O-N 2.91Å; F226-V228 PolarHBondContact O-N 2.91Å; F226-V228 VanDerWaalsContact O-N 3.17Å; F226-L256 HydrophobicContact CB-CD1 4.06Å; F226-L256 HydrophobicContact CD2-CD1 3.75Å; F226-L256 HydrophobicContact CG-CD1 4.38Å; F226-K259 HydrophobicContact CB-CB 4.43Å; F226-K259 HydrophobicContact CB-CG 3.83Å; F226-K259 HydrophobicContact CD1-CD 4.21Å; F226-K259 HydrophobicContact CD1-CG 3.42Å; F226-K259 VanDerWaalsContact CD1-CG 3.42Å; F226-K259 HydrophobicContact CD2-CG 4.14Å; F226-K259 HydrophobicContact CE1-CG 3.95Å; F226-K259 HydrophobicContact CG-CB 4.37Å; F226-K259 HydrophobicContact CG-CG 3.53Å; F226-L260 HydrophobicContact CD2-CD2 4.29Å; F226-L260 HydrophobicContact CE2-CD2 3.61Å; F226-L260 HydrophobicContact CE2-CG 4.26Å; F226-L260 HydrophobicContact CZ-CD2 4.49Å
227	S	96.5	Very high	98	Very high	98 Å²	98	32.4 Å²	32.4	69%	0.685	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.3	5.5	-176.3	-54.1	0	0	0	0	116.2	V225	V225-S227 VanDerWaalsContact C-N 3.28Å; V225-S227 PolarHBondContact O-N 2.92Å
228	V	98	Very high	98	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	116	166	-174.1	0	0	0	0	108.5	T224 V225 F226 V248 P249 R252 L256	T224-V228 CarbonylContact C-O 3.56Å; T224-V228 VanDerWaalsContact CA-O 3.26Å; T224-V228 WeakPolarHBondContact CA-O 3.4Å; T224-V228 WeakPolarHBondContact CG2-O 3.48Å; V225-V228 PolarHBondContact N-O 3Å; V225-V228 WeakPolarHBondContact O-CB 3.44Å; V225-V228 PolarHBondContact O-N 3.02Å; F226-V228 PolarHBondContact O-N 2.91Å; F226-V228 VanDerWaalsContact O-N 3.17Å; V228-V248 HydrophobicContact CG1-CG1 3.99Å; V228-P249 HydrophobicContact CG1-CG 4.38Å; V228-R252 HydrophobicContact CB-CB 4.45Å; V228-R252 HydrophobicContact CG1-CB 3.49Å; V228-R252 VanDerWaalsContact CG1-CB 3.49Å; V228-R252 HydrophobicContact CG1-CG 4.08Å; V228-R252 HydrophobicContact CG2-CB 4.09Å; V228-L256 HydrophobicContact CG2-CB 4.31Å
229	P	97.1	Very high	98	Very high	49 Å²	49	30 Å²	30	32%	0.318	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	171.7	179.5	34.2	-36.6	0	0	0	111.6	C231 P249	P229-C231 PolarHBondContact O-N 2.85Å; P229-P249 WeakPolarHBondContact O-CG 3.46Å
230	D	95.9	Very high	98	Very high	111 Å²	111	28.6 Å²	28.6	59%	0.594	17%	0.169	S	C	*	.	E	Extended strand (participates in β ladder)	trans	57.1	18.7	168.6	-50.4	-46.6	0	0	0	116.2	L222 R232 P249	L222-D230 WeakPolarHBondContact CD1-O 3.49Å; D230-R232 PolarHBondContact O-N 3.04Å; D230-P249 HydrophobicContact CB-CG 4.44Å
231	C	98.3	Very high	98	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	127.1	173.8	-64.7	0	0	0	0	110.6	V223 V225 P229 I246 S247	V223-C231 PolarHBondContact N-O 2.77Å; V223-C231 WeakPolarHBondContact O-CB 3.45Å; V223-C231 PolarHBondContact O-N 3.45Å; V225-C231 HydrophobicContact CB-CB 4.33Å; V225-C231 HydrophobicContact CG2-CB 3.69Å; P229-C231 PolarHBondContact O-N 2.85Å; C231-I246 HydrophobicContact CB-CG2 3.82Å; C231-S247 CarbonylContact C-O 3.44Å; C231-S247 WeakPolarHBondContact CA-O 3.3Å
232	R	98.5	Very high	98.1	Very high	8 Å²	8	26.8 Å²	26.8	3%	0.03	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	104.1	169	-168.4	174.2	-164.9	79	14.3	109.7	N125 T148 S220 T221 L222 D230 I246 S247	N125-R232 PolarHBondContact OD1-NH2 2.95Å; T148-R232 VanDerWaalsContact CG2-CZ 3.44Å; S220-R232 PolarHBondContact OG-NH2 3.09Å; T221-R232 WeakPolarHBondContact O-CA 3.49Å; L222-R232 HydrophobicContact CD1-CB 4.39Å; D230-R232 PolarHBondContact O-N 3.04Å; R232-I246 WeakPolarHBondContact O-CA 3.47Å; R232-S247 PolarHBondContact N-O 2.74Å; R232-S247 PolarHBondContact O-N 3.39Å
233	V	98.7	Very high	98.1	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	123.3	174.5	-178.8	0	0	0	0	108.5	L204 L215 S220 T221 V223 V225 V244 E245 I246	L204-V233 HydrophobicContact CD2-CG1 4.02Å; L215-V233 HydrophobicContact CD2-CG1 3.87Å; S220-V233 CarbonylContact C-O 3.07Å; S220-V233 WeakPolarHBondContact CA-O 3.48Å; S220-V233 WeakPolarHBondContact CB-O 3.13Å; T221-V233 HydrophobicContact CG2-CB 4.4Å; T221-V233 PolarHBondContact N-O 3.26Å; T221-V233 PolarHBondContact O-N 2.7Å; V223-V233 HydrophobicContact CG1-CB 4.28Å; V223-V233 HydrophobicContact CG1-CG2 3.62Å; V225-V233 HydrophobicContact CG2-CG2 3.61Å; V233-V244 HydrophobicContact CG1-CB 3.96Å; V233-V244 HydrophobicContact CG1-CG1 3.76Å; V233-V244 HydrophobicContact CG1-CG2 4.38Å; V233-E245 WeakPolarHBondContact CA-O 3.22Å; V233-I246 HydrophobicContact CG2-CG1 4.41Å; V233-I246 HydrophobicContact CG2-CG2 4.11Å
234	T	98.8	Very high	98.2	Very high	6 Å²	6	22.4 Å²	22.4	4%	0.037	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	127.4	174.9	-53.2	0	0	0	0	108.7	T219 S220 C236 V244 E245	T219-T234 WeakPolarHBondContact O-CA 3.22Å; S220-T234 WeakPolarHBondContact CB-OG1 3.21Å; T234-C236 HydrophobicContact CG2-CB 4.09Å; T234-C236 WeakPolarHBondContact CG2-SG 3.19Å; T234-C236 PolarHBondContact O-N 3.23Å; T234-V244 CarbonylContact O-C 3.52Å; T234-V244 WeakPolarHBondContact O-CA 3.48Å; T234-V244 WeakPolarHBondContact O-CB 3.43Å; T234-E245 PolarHBondContact N-O 3.22Å; T234-E245 PolarHBondContact O-N 2.98Å
235	R	98.8	Very high	98.2	Very high	8 Å²	8	19.6 Å²	19.6	3%	0.03	11%	0.114	C	C	.	.			trans	-82.2	73.8	178.9	-156.2	171.7	-169.7	161.7	-1.7	110.4	L212 L215 F217 M218 T219 D242 G243 V244 Y413	L212-R235 PolarHBondContact O-NH1 3.4Å; L212-R235 VanDerWaalsContact O-NH1 3.09Å; L215-R235 HydrophobicContact CD2-CB 3.96Å; L215-R235 HydrophobicContact CG-CB 4.05Å; L215-R235 WeakPolarHBondContact O-CD 3.23Å; L215-R235 PolarHBondContact O-NH1 2.85Å; F217-R235 CarbonylContact C-O 3.59Å; F217-R235 WeakPolarHBondContact CA-O 3.3Å; F217-R235 WeakPolarHBondContact CD2-O 3.47Å; M218-R235 PolarHBondContact N-O 2.8Å; T219-R235 PolarHBondContact O-N 2.93Å; R235-D242 IonicContact CZ-OD1 3.42Å; R235-D242 IonicContact CZ-OD2 3.65Å; R235-D242 IonicContact NE-OD1 2.69Å; R235-D242 PolarHBondContact NE-OD1 3.43Å; R235-D242 IonicContact NE-OD2 3.31Å; R235-D242 IonicContact NH2-OD1 3.15Å; R235-D242 PolarHBondContact NH2-OD1 3.39Å; R235-D242 IonicContact NH2-OD2 2.76Å; R235-D242 PolarHBondContact NH2-OD2 2.83Å; R235-G243 CarbonylContact C-O 3.56Å; R235-G243 WeakPolarHBondContact CA-O 3.33Å; R235-G243 WeakPolarHBondContact CG-O 3.35Å; R235-V244 HydrophobicContact CB-CG1 4.42Å; R235-V244 HydrophobicContact CG-CG1 4.24Å; R235-Y413 VanDerWaalsContact CZ-CG 3.47Å
236	C	98.8	Very high	98.3	Very high	3 Å²	3	19.6 Å²	19.6	2%	0.02	11%	0.114	C	C	.	.			trans	-135.5	175.8	178.9	60.6	0	0	0	0	109.9	I144 Q196 M218 T234 G243 V244	I144-C236 HydrophobicContact CD1-CB 4.19Å; Q196-C236 PolarHBondContact NE2-O 3.39Å; M218-C236 HydrophobicContact SD-CB 3.67Å; T234-C236 HydrophobicContact CG2-CB 4.09Å; T234-C236 WeakPolarHBondContact CG2-SG 3.19Å; T234-C236 PolarHBondContact O-N 3.23Å; C236-G243 PolarHBondContact N-O 3.01Å; C236-G243 CarbonylContact O-C 3.54Å; C236-V244 CarbonylContact O-C 3.56Å
237	G	98.3	Very high	98.3	Very high	17 Å²	17	18.3 Å²	18.3	18%	0.175	11%	0.11	C	C	.	.			trans	-179.3	165.6	-175.1	0	0	0	0	0	114.4
238	Y	98.8	Very high	98.4	Very high	37 Å²	37	13.6 Å²	13.6	15%	0.145	8%	0.077	C	C	.	.	S	Bend	trans	-123.1	34.5	-179	-164.7	-119.1	0	0	0	111.3	R274 R278 L283 C284 L285	Y238-R274 HydrophobicContact CD1-CG 3.97Å; Y238-R274 HydrophobicContact CE1-CG 4.42Å; Y238-R278 HydrophobicContact CD1-CB 3.6Å; Y238-R278 HydrophobicContact CD1-CG 4.07Å; Y238-R278 HydrophobicContact CD2-CB 4.28Å; Y238-R278 HydrophobicContact CE1-CB 3.43Å; Y238-R278 VanDerWaalsContact CE1-CB 3.43Å; Y238-R278 HydrophobicContact CE1-CG 3.43Å; Y238-R278 VanDerWaalsContact CE1-CG 3.43Å; Y238-R278 HydrophobicContact CE2-CB 4.09Å; Y238-R278 HydrophobicContact CG-CB 4.04Å; Y238-R278 VanDerWaalsContact O-CB 3.28Å; Y238-R278 WeakPolarHBondContact O-CB 3.25Å; Y238-R278 WeakPolarHBondContact OH-CD 3.46Å; Y238-L283 HydrophobicContact CD2-CB 4.15Å; Y238-L283 HydrophobicContact CD2-CD1 3.73Å; Y238-L283 HydrophobicContact CE2-CB 3.8Å; Y238-L283 HydrophobicContact CE2-CD1 4.26Å; Y238-L283 HydrophobicContact CG-CD1 4.31Å; Y238-C284 PolarHBondContact OH-O 2.9Å; Y238-L285 WeakPolarHBondContact OH-CA 3.39Å
239	T	98.8	Very high	98.4	Very high	2 Å²	2	14.7 Å²	14.7	1%	0.012	8%	0.084	C	C	.	.	S	Bend	trans	-129.7	-19.4	-173.5	60.3	0	0	0	0	113.9	T85 R86 F92 Q196 E241 L277 A281	T85-T239 HydrophobicContact CG2-CG2 4.44Å; R86-T239 PolarHBondContact NH1-O 3.42Å; F92-T239 HydrophobicContact CE2-CG2 4.26Å; F92-T239 HydrophobicContact CZ-CG2 4.42Å; Q196-T239 HydrophobicContact CB-CG2 3.72Å; Q196-T239 HydrophobicContact CG-CG2 3.8Å; Q196-T239 PolarHBondContact OE1-OG1 3.18Å; T239-E241 PolarHBondContact O-N 2.79Å; T239-E241 PolarHBondContact OG1-N 3.47Å; T239-L277 HydrophobicContact CG2-CB 4.26Å; T239-L277 HydrophobicContact CG2-CD1 4.01Å; T239-A281 WeakPolarHBondContact O-CB 3.42Å
240	G	98.4	Very high	98.5	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.084	C	C	.	.	S	Bend	trans	83	-10.4	-170.2	0	0	0	0	0	114.5	T410 N411	G240-T410 CarbonylContact O-C 3.57Å; G240-T410 WeakPolarHBondContact O-CA 3.48Å; G240-T410 VanDerWaalsContact O-CB 3.3Å; G240-T410 WeakPolarHBondContact O-CB 3.44Å; G240-N411 PolarHBondContact O-N 2.95Å
241	E	98.8	Very high	98.6	Very high	5 Å²	5	16.4 Å²	16.4	2%	0.023	9%	0.092	C	C	.	.	S	Bend	trans	-81.8	171.6	173.5	-62.7	-51.8	133.7	0	0	112	R86 T239 N411 Y412	R86-E241 WeakPolarHBondContact CD-OE1 3.45Å; R86-E241 IonicContact CZ-OE1 2.75Å; R86-E241 IonicContact NE-OE1 3.79Å; R86-E241 IonicContact NH1-OE1 3.63Å; R86-E241 PolarHBondContact NH1-OE1 2.92Å; T239-E241 PolarHBondContact O-N 2.79Å; T239-E241 PolarHBondContact OG1-N 3.47Å; E241-N411 PolarHBondContact OE2-ND2 3.17Å; E241-Y412 WeakPolarHBondContact O-CD1 3.25Å
242	D	98.7	Very high	98.6	Very high	16 Å²	16	19.9 Å²	19.9	9%	0.086	11%	0.106	C	C	.	.	S	Bend	trans	-61	150.2	156	-172.2	37.4	0	0	0	110.1	G197 R235 N411	G197-D242 PolarHBondContact N-O 2.85Å; R235-D242 IonicContact CZ-OD1 3.42Å; R235-D242 IonicContact CZ-OD2 3.65Å; R235-D242 IonicContact NE-OD1 2.69Å; R235-D242 PolarHBondContact NE-OD1 3.43Å; R235-D242 IonicContact NE-OD2 3.31Å; R235-D242 IonicContact NH2-OD1 3.15Å; R235-D242 PolarHBondContact NH2-OD1 3.39Å; R235-D242 IonicContact NH2-OD2 2.76Å; R235-D242 PolarHBondContact NH2-OD2 2.83Å; D242-N411 PolarHBondContact N-O 2.93Å
243	G	98.6	Very high	98.6	Very high	3 Å²	3	19.5 Å²	19.5	3%	0.031	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173	168.5	-174.9	0	0	0	0	0	113.2	L195 R235 C236	L195-G243 CarbonylContact O-C 3.57Å; L195-G243 VanDerWaalsContact O-CA 3.24Å; L195-G243 WeakPolarHBondContact O-CA 3.38Å; R235-G243 CarbonylContact C-O 3.56Å; R235-G243 WeakPolarHBondContact CA-O 3.33Å; R235-G243 WeakPolarHBondContact CG-O 3.35Å; C236-G243 PolarHBondContact N-O 3.01Å; C236-G243 CarbonylContact O-C 3.54Å
244	V	98.9	Very high	98.6	Very high	1 Å²	1	22 Å²	22	1%	0.006	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	155.7	169.8	-59.8	0	0	0	0	111.3	A194 L195 Q196 T200 L204 V233 T234 R235 C236 I246	A194-V244 CarbonylContact C-O 3.5Å; A194-V244 WeakPolarHBondContact CA-O 3.19Å; L195-V244 HydrophobicContact CB-CG2 4.11Å; L195-V244 PolarHBondContact N-O 2.97Å; L195-V244 PolarHBondContact O-N 3.28Å; L195-V244 VanDerWaalsContact O-O 3.06Å; Q196-V244 PolarHBondContact NE2-O 2.49Å; T200-V244 HydrophobicContact CG2-CG2 4.24Å; L204-V244 HydrophobicContact CD2-CB 4.37Å; L204-V244 HydrophobicContact CD2-CG1 3.92Å; L204-V244 HydrophobicContact CD2-CG2 3.66Å; V233-V244 HydrophobicContact CG1-CB 3.96Å; V233-V244 HydrophobicContact CG1-CG1 3.76Å; V233-V244 HydrophobicContact CG1-CG2 4.38Å; T234-V244 CarbonylContact O-C 3.52Å; T234-V244 WeakPolarHBondContact O-CA 3.48Å; T234-V244 WeakPolarHBondContact O-CB 3.43Å; R235-V244 HydrophobicContact CB-CG1 4.42Å; R235-V244 HydrophobicContact CG-CG1 4.24Å; C236-V244 CarbonylContact O-C 3.56Å; V244-I246 HydrophobicContact CG2-CD1 4.09Å; V244-I246 HydrophobicContact CG2-CG1 3.77Å
245	E	98.9	Very high	98.5	Very high	13 Å²	13	25.5 Å²	25.5	6%	0.061	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	141.6	152	-62.1	-166.8	156	0	0	109.1	L192 I193 A194 V233 T234	L192-E245 HydrophobicContact CD1-CB 4.42Å; I193-E245 CarbonylContact O-C 3.55Å; I193-E245 WeakPolarHBondContact O-CA 3.46Å; A194-E245 HydrophobicContact CB-CG 3.91Å; V233-E245 WeakPolarHBondContact CA-O 3.22Å; T234-E245 PolarHBondContact N-O 3.22Å; T234-E245 PolarHBondContact O-N 2.98Å
246	I	98.8	Very high	98.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	111.3	179.7	-43.2	178.4	0	0	0	107	L192 I193 L204 V225 C231 R232 V233 V244 V248 L256	L192-I246 WeakPolarHBondContact CA-O 3.44Å; I193-I246 HydrophobicContact CD1-CD1 4.46Å; I193-I246 HydrophobicContact CG1-CB 4.04Å; I193-I246 HydrophobicContact CG1-CG1 4.47Å; I193-I246 PolarHBondContact N-O 2.92Å; I193-I246 PolarHBondContact O-N 3.42Å; L204-I246 HydrophobicContact CD1-CD1 3.71Å; V225-I246 HydrophobicContact CG2-CG2 4.5Å; C231-I246 HydrophobicContact CB-CG2 3.82Å; R232-I246 WeakPolarHBondContact O-CA 3.47Å; V233-I246 HydrophobicContact CG2-CG1 4.41Å; V233-I246 HydrophobicContact CG2-CG2 4.11Å; V244-I246 HydrophobicContact CG2-CD1 4.09Å; V244-I246 HydrophobicContact CG2-CG1 3.77Å; I246-V248 HydrophobicContact CB-CG2 4.05Å; I246-V248 HydrophobicContact CG2-CG2 3.58Å; I246-V248 WeakPolarHBondContact O-CG2 3.41Å; I246-L256 HydrophobicContact CD1-CD2 4.38Å; I246-L256 HydrophobicContact CG2-CD2 4.22Å
247	S	98.8	Very high	98.5	Very high	7 Å²	7	25 Å²	25	5%	0.049	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	127.8	164.7	-178.3	0	0	0	0	107.5	Q99 Y154 A191 C231 R232	Q99-S247 PolarHBondContact OE1-OG 2.85Å; Y154-S247 WeakPolarHBondContact OH-CB 3.45Å; A191-S247 CarbonylContact O-C 3.29Å; A191-S247 WeakPolarHBondContact O-CA 3.46Å; C231-S247 CarbonylContact C-O 3.44Å; C231-S247 WeakPolarHBondContact CA-O 3.3Å; R232-S247 PolarHBondContact N-O 2.74Å; R232-S247 PolarHBondContact O-N 3.39Å
248	V	98.4	Very high	98.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	136.4	-163.4	-174.3	0	0	0	0	109.6	A191 I193 V228 I246 R250 V253 L256	A191-V248 PolarHBondContact N-O 2.9Å; A191-V248 PolarHBondContact O-N 2.8Å; I193-V248 HydrophobicContact CG1-CG2 4.44Å; V228-V248 HydrophobicContact CG1-CG1 3.99Å; I246-V248 HydrophobicContact CB-CG2 4.05Å; I246-V248 HydrophobicContact CG2-CG2 3.58Å; I246-V248 WeakPolarHBondContact O-CG2 3.41Å; V248-R250 PolarHBondContact O-N 3.01Å; V248-V253 HydrophobicContact CB-CB 4.31Å; V248-V253 HydrophobicContact CB-CG2 4.32Å; V248-V253 HydrophobicContact CG1-CB 4.09Å; V248-V253 HydrophobicContact CG1-CG2 4.44Å; V248-V253 HydrophobicContact CG2-CG2 4.46Å; V248-L256 HydrophobicContact CG1-CD2 4.08Å; V248-L256 HydrophobicContact CG2-CD2 3.51Å
249	P	98.3	Very high	98.5	Very high	22 Å²	22	32.8 Å²	32.8	14%	0.143	17%	0.165	C	C	.	.			trans	-39.6	115.3	166.4	-34.2	38.2	0	0	0	112.2	E190 V228 P229 D230 S251 R252 V253	E190-P249 WeakPolarHBondContact OE2-CA 3.46Å; V228-P249 HydrophobicContact CG1-CG 4.38Å; P229-P249 WeakPolarHBondContact O-CG 3.46Å; D230-P249 HydrophobicContact CB-CG 4.44Å; P249-S251 PolarHBondContact O-N 3.27Å; P249-R252 HydrophobicContact CB-CB 4.34Å; P249-R252 HydrophobicContact CB-CG 4.21Å; P249-R252 PolarHBondContact O-N 3.47Å; P249-V253 PolarHBondContact O-N 3.21Å
250	R	97.7	Very high	98.5	Very high	86 Å²	86	32.7 Å²	32.7	33%	0.325	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.9	-37.4	-171.7	-167.6	-172.6	169.2	88.9	2.8	114.1	P50 D189 E190 V248 R252	P50-R250 HydrophobicContact CB-CG 4.29Å; P50-R250 HydrophobicContact CG-CG 3.51Å; D189-R250 WeakPolarHBondContact O-CB 3.13Å; D189-R250 WeakPolarHBondContact O-CD 3.34Å; D189-R250 IonicContact OD1-CZ 2.68Å; D189-R250 IonicContact OD1-NH1 2.87Å; D189-R250 PolarHBondContact OD1-NH1 3.42Å; D189-R250 VanDerWaalsContact OD2-CD 3.22Å; D189-R250 WeakPolarHBondContact OD2-CD 3.38Å; D189-R250 IonicContact OD2-CZ 3.86Å; D189-R250 IonicContact OD2-NE 3.74Å; D189-R250 PolarHBondContact OD2-NE 2.78Å; D189-R250 IonicContact OD2-NH1 3.93Å; D189-R250 PolarHBondContact OD2-NH1 3.48Å; D189-R250 VanDerWaalsContact OD2-NH1 3.15Å; E190-R250 PolarHBondContact OE2-N 3.24Å; V248-R250 PolarHBondContact O-N 3.01Å; R250-R252 VanDerWaalsContact C-N 3.32Å; R250-R252 PolarHBondContact O-N 3.04Å
251	S	97.7	Very high	98.5	Very high	110 Å²	110	35 Å²	35	77%	0.769	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-11.1	-179.5	55.5	0	0	0	0	115.4	P249	P249-S251 PolarHBondContact O-N 3.27Å
252	R	98.3	Very high	98.4	Very high	73 Å²	73	38.8 Å²	38.8	28%	0.275	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.3	-3.7	-173.1	-57.1	-64.1	-64.3	-73.8	-3.1	114	V228 P249 R250 V254 E255 L256	V228-R252 HydrophobicContact CB-CB 4.45Å; V228-R252 HydrophobicContact CG1-CB 3.49Å; V228-R252 VanDerWaalsContact CG1-CB 3.49Å; V228-R252 HydrophobicContact CG1-CG 4.08Å; V228-R252 HydrophobicContact CG2-CB 4.09Å; P249-R252 HydrophobicContact CB-CB 4.34Å; P249-R252 HydrophobicContact CB-CG 4.21Å; P249-R252 PolarHBondContact O-N 3.47Å; R250-R252 VanDerWaalsContact C-N 3.32Å; R250-R252 PolarHBondContact O-N 3.04Å; R252-V254 VanDerWaalsContact C-N 3.32Å; R252-V254 PolarHBondContact O-N 2.86Å; R252-E255 IonicContact CZ-OE1 2.77Å; R252-E255 IonicContact CZ-OE2 2.85Å; R252-E255 IonicContact NE-OE2 3.24Å; R252-E255 PolarHBondContact NE-OE2 3.48Å; R252-E255 IonicContact NH2-OE1 2.74Å; R252-E255 PolarHBondContact NH2-OE1 2.84Å; R252-E255 IonicContact NH2-OE2 3.55Å; R252-E255 PolarHBondContact NH2-OE2 2.83Å; R252-E255 PolarHBondContact O-N 3.01Å; R252-L256 PolarHBondContact O-N 2.69Å; R252-L256 VanDerWaalsContact O-N 3.15Å
253	V	98.6	Very high	98.4	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-66	-30.5	-176.2	71	0	0	0	0	113.9	P50 L51 A191 I193 V248 P249 L256 A257	P50-V253 HydrophobicContact CB-CG1 3.65Å; P50-V253 HydrophobicContact CG-CG1 4.29Å; L51-V253 HydrophobicContact CD1-CG2 4.16Å; L51-V253 HydrophobicContact CD2-CG1 3.98Å; L51-V253 HydrophobicContact CD2-CG2 4.33Å; L51-V253 HydrophobicContact CG-CG1 4.06Å; L51-V253 HydrophobicContact CG-CG2 4.33Å; A191-V253 HydrophobicContact CB-CB 3.5Å; A191-V253 VanDerWaalsContact CB-CB 3.5Å; A191-V253 HydrophobicContact CB-CG1 3.55Å; A191-V253 HydrophobicContact CB-CG2 3.61Å; I193-V253 HydrophobicContact CG2-CG2 3.78Å; V248-V253 HydrophobicContact CB-CB 4.31Å; V248-V253 HydrophobicContact CB-CG2 4.32Å; V248-V253 HydrophobicContact CG1-CB 4.09Å; V248-V253 HydrophobicContact CG1-CG2 4.44Å; V248-V253 HydrophobicContact CG2-CG2 4.46Å; P249-V253 PolarHBondContact O-N 3.21Å; V253-L256 PolarHBondContact O-N 3.2Å; V253-A257 VanDerWaalsContact O-CB 3.27Å; V253-A257 WeakPolarHBondContact O-CB 3.4Å; V253-A257 PolarHBondContact O-N 3.23Å
254	V	98.6	Very high	98.4	Very high	53 Å²	53	46.6 Å²	46.6	32%	0.321	24%	0.244	S	C	.	.	H	α-helix	trans	-62.5	-48.7	175.3	178.8	0	0	0	0	110.3	L51 F54 R252 L256 A257 E258	L51-V254 HydrophobicContact CD2-CB 4.5Å; L51-V254 HydrophobicContact CD2-CG2 3.99Å; F54-V254 HydrophobicContact CD2-CG1 4.35Å; R252-V254 VanDerWaalsContact C-N 3.32Å; R252-V254 PolarHBondContact O-N 2.86Å; V254-L256 VanDerWaalsContact C-N 3.34Å; V254-L256 PolarHBondContact O-N 3.06Å; V254-A257 PolarHBondContact O-N 2.95Å; V254-E258 HydrophobicContact CG1-CG 4.36Å; V254-E258 WeakPolarHBondContact O-CB 3.45Å; V254-E258 WeakPolarHBondContact O-CG 3.28Å; V254-E258 PolarHBondContact O-N 3.4Å
255	E	98.3	Very high	98.3	Very high	79 Å²	79	48.4 Å²	48.4	37%	0.369	25%	0.253	S	S	.	.	H	α-helix	trans	-58.4	-44	176.6	178.7	-171.2	154.9	0	0	111.7	R252 K259	R252-E255 IonicContact CZ-OE1 2.77Å; R252-E255 IonicContact CZ-OE2 2.85Å; R252-E255 IonicContact NE-OE2 3.24Å; R252-E255 PolarHBondContact NE-OE2 3.48Å; R252-E255 IonicContact NH2-OE1 2.74Å; R252-E255 PolarHBondContact NH2-OE1 2.84Å; R252-E255 IonicContact NH2-OE2 3.55Å; R252-E255 PolarHBondContact NH2-OE2 2.83Å; R252-E255 PolarHBondContact O-N 3.01Å; E255-K259 VanDerWaalsContact O-CB 3.25Å; E255-K259 WeakPolarHBondContact O-CB 3.26Å; E255-K259 PolarHBondContact O-N 2.78Å
256	L	98.6	Very high	98.3	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-65.2	-43.1	177	-178.2	61.6	0	0	0	112	I193 V225 F226 V228 I246 V248 R252 V253 V254 K259 L260	I193-L256 HydrophobicContact CD1-CD2 3.84Å; I193-L256 HydrophobicContact CD1-CG 4.12Å; V225-L256 HydrophobicContact CB-CD1 4.28Å; V225-L256 HydrophobicContact CG1-CD1 3.7Å; F226-L256 HydrophobicContact CB-CD1 4.06Å; F226-L256 HydrophobicContact CD2-CD1 3.75Å; F226-L256 HydrophobicContact CG-CD1 4.38Å; V228-L256 HydrophobicContact CG2-CB 4.31Å; I246-L256 HydrophobicContact CD1-CD2 4.38Å; I246-L256 HydrophobicContact CG2-CD2 4.22Å; V248-L256 HydrophobicContact CG1-CD2 4.08Å; V248-L256 HydrophobicContact CG2-CD2 3.51Å; R252-L256 PolarHBondContact O-N 2.69Å; R252-L256 VanDerWaalsContact O-N 3.15Å; V253-L256 PolarHBondContact O-N 3.2Å; V254-L256 VanDerWaalsContact C-N 3.34Å; V254-L256 PolarHBondContact O-N 3.06Å; L256-K259 PolarHBondContact O-N 3.5Å; L256-L260 HydrophobicContact CD1-CD1 4.31Å; L256-L260 HydrophobicContact CD1-CG 4.37Å; L256-L260 HydrophobicContact CG-CD1 4.13Å; L256-L260 WeakPolarHBondContact O-CB 3.49Å; L256-L260 WeakPolarHBondContact O-CG 3.41Å; L256-L260 PolarHBondContact O-N 3.29Å
257	A	98.6	Very high	98.3	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-65.5	-43.6	179.1	0	0	0	0	0	111.7	L51 F54 V253 V254 L260 L261	L51-A257 HydrophobicContact CD2-CB 3.97Å; F54-A257 HydrophobicContact CE1-CB 4.12Å; F54-A257 HydrophobicContact CE2-CB 4.24Å; F54-A257 HydrophobicContact CZ-CB 3.85Å; V253-A257 VanDerWaalsContact O-CB 3.27Å; V253-A257 WeakPolarHBondContact O-CB 3.4Å; V253-A257 PolarHBondContact O-N 3.23Å; V254-A257 PolarHBondContact O-N 2.95Å; A257-L260 PolarHBondContact O-N 2.82Å; A257-L261 WeakPolarHBondContact O-CB 3.45Å; A257-L261 PolarHBondContact O-N 2.88Å
258	E	98.4	Very high	98.3	Very high	111 Å²	111	52.4 Å²	52.4	52%	0.519	27%	0.271	S	S	.	.	H	α-helix	trans	-61	-43	172.5	-73.6	176.9	167.9	0	0	111.5	F54 V254 L261 S262	F54-E258 HydrophobicContact CD2-CG 4.09Å; F54-E258 HydrophobicContact CE2-CG 3.66Å; V254-E258 HydrophobicContact CG1-CG 4.36Å; V254-E258 WeakPolarHBondContact O-CB 3.45Å; V254-E258 WeakPolarHBondContact O-CG 3.28Å; V254-E258 PolarHBondContact O-N 3.4Å; E258-L261 PolarHBondContact O-N 3.28Å; E258-S262 PolarHBondContact O-N 3.2Å
259	K	98.4	Very high	98.3	Very high	106 Å²	106	52.6 Å²	52.6	46%	0.461	27%	0.272	S	S	.	.	H	α-helix	trans	-67	-40.3	-179.8	-172.7	55	175.6	172.7	0	112.4	F226 E255 L256 S262	F226-K259 HydrophobicContact CB-CB 4.43Å; F226-K259 HydrophobicContact CB-CG 3.83Å; F226-K259 HydrophobicContact CD1-CD 4.21Å; F226-K259 HydrophobicContact CD1-CG 3.42Å; F226-K259 VanDerWaalsContact CD1-CG 3.42Å; F226-K259 HydrophobicContact CD2-CG 4.14Å; F226-K259 HydrophobicContact CE1-CG 3.95Å; F226-K259 HydrophobicContact CG-CB 4.37Å; F226-K259 HydrophobicContact CG-CG 3.53Å; E255-K259 VanDerWaalsContact O-CB 3.25Å; E255-K259 WeakPolarHBondContact O-CB 3.26Å; E255-K259 PolarHBondContact O-N 2.78Å; L256-K259 PolarHBondContact O-N 3.5Å; K259-S262 PolarHBondContact O-N 3.43Å; K259-S262 PolarHBondContact O-OG 3.04Å
260	L	98.4	Very high	98.4	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-64.4	-47.5	172.3	-74.2	169.7	0	0	0	111.5	I91 I193 L195 V203 L204 F226 L256 A257 S262 N263 V266	I91-L260 HydrophobicContact CD1-CB 3.69Å; I91-L260 HydrophobicContact CD1-CD1 4.35Å; I91-L260 HydrophobicContact CG1-CB 4.48Å; I193-L260 HydrophobicContact CD1-CD1 3.81Å; L195-L260 HydrophobicContact CD2-CD2 3.88Å; V203-L260 HydrophobicContact CG1-CD2 3.85Å; L204-L260 HydrophobicContact CD1-CD2 4.48Å; F226-L260 HydrophobicContact CD2-CD2 4.29Å; F226-L260 HydrophobicContact CE2-CD2 3.61Å; F226-L260 HydrophobicContact CE2-CG 4.26Å; F226-L260 HydrophobicContact CZ-CD2 4.49Å; L256-L260 HydrophobicContact CD1-CD1 4.31Å; L256-L260 HydrophobicContact CD1-CG 4.37Å; L256-L260 HydrophobicContact CG-CD1 4.13Å; L256-L260 WeakPolarHBondContact O-CB 3.49Å; L256-L260 WeakPolarHBondContact O-CG 3.41Å; L256-L260 PolarHBondContact O-N 3.29Å; A257-L260 PolarHBondContact O-N 2.82Å; L260-S262 PolarHBondContact O-N 3.48Å; L260-S262 VanDerWaalsContact O-N 3.17Å; L260-N263 WeakPolarHBondContact O-CB 3.32Å; L260-N263 PolarHBondContact O-N 2.88Å; L260-V266 WeakPolarHBondContact O-CG2 3.05Å
261	L	98.2	Very high	98.4	Very high	48 Å²	48	48.8 Å²	48.8	25%	0.251	26%	0.258	S	S	.	.	H	α-helix	trans	-66.8	-14.1	-179.6	-167.2	64	0	0	0	113.5	F54 I91 A257 E258 N263 V266 L268	F54-L261 HydrophobicContact CE2-CD2 4.47Å; F54-L261 HydrophobicContact CZ-CD2 3.88Å; I91-L261 HydrophobicContact CD1-CB 4.47Å; A257-L261 WeakPolarHBondContact O-CB 3.45Å; A257-L261 PolarHBondContact O-N 2.88Å; E258-L261 PolarHBondContact O-N 3.28Å; L261-N263 PolarHBondContact O-N 2.94Å; L261-V266 HydrophobicContact CD1-CG1 4.35Å; L261-L268 HydrophobicContact CD1-CD2 4.08Å; L261-L268 HydrophobicContact CD1-CG 4.09Å; L261-L268 HydrophobicContact CD2-CD1 4.23Å; L261-L268 HydrophobicContact CD2-CD2 4.18Å; L261-L268 HydrophobicContact CD2-CG 4.12Å
262	S	97.9	Very high	98.4	Very high	85 Å²	85	44.6 Å²	44.6	59%	0.594	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-12.3	170.7	77.2	0	0	0	0	114.1	E258 K259 L260	E258-S262 PolarHBondContact O-N 3.2Å; K259-S262 PolarHBondContact O-N 3.43Å; K259-S262 PolarHBondContact O-OG 3.04Å; L260-S262 PolarHBondContact O-N 3.48Å; L260-S262 VanDerWaalsContact O-N 3.17Å
263	N	98.3	Very high	98.4	Very high	44 Å²	44	41.1 Å²	41.1	24%	0.235	22%	0.219	C	C	.	.	S	Bend	trans	-89.6	130.7	173.1	-172	-45.2	0	0	0	110.4	V203 L260 L261 E265 V266	V203-N263 HydrophobicContact CG1-CB 4.44Å; L260-N263 WeakPolarHBondContact O-CB 3.32Å; L260-N263 PolarHBondContact O-N 2.88Å; L261-N263 PolarHBondContact O-N 2.94Å; N263-E265 PolarHBondContact O-N 3.01Å; N263-E265 WeakPolarHBondContact OD1-CB 3.37Å; N263-E265 WeakPolarHBondContact OD1-CG 3.46Å; N263-E265 PolarHBondContact OD1-N 2.88Å; N263-V266 HydrophobicContact CB-CG2 3.98Å; N263-V266 WeakPolarHBondContact O-CB 3.42Å; N263-V266 PolarHBondContact O-N 3.27Å
264	N	97.5	Very high	98.4	Very high	139 Å²	139	42.6 Å²	42.6	74%	0.743	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-18.7	-175.9	64.4	-64.3	0	0	0	114.5	V266	N264-V266 PolarHBondContact O-N 3.5Å
265	E	98.3	Very high	98.4	Very high	39 Å²	39	42.9 Å²	42.9	18%	0.182	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-18.5	172.8	-64.9	-64.5	124.8	0	0	112.7	H84 H88 C89 T199 V203 N263	H84-E265 PolarHBondContact NE2-O 3.25Å; H88-E265 WeakPolarHBondContact CB-O 3.39Å; H88-E265 IonicContact CE1-OE2 2.79Å; H88-E265 IonicContact CG-OE2 2.67Å; H88-E265 IonicContact ND1-OE1 3.67Å; H88-E265 IonicContact ND1-OE2 2.74Å; H88-E265 PolarHBondContact ND1-OE2 3.21Å; C89-E265 PolarHBondContact N-O 3.07Å; C89-E265 VanDerWaalsContact O-O 3.06Å; T199-E265 WeakPolarHBondContact CG2-OE2 3.49Å; T199-E265 PolarHBondContact OG1-OE2 3.06Å; V203-E265 HydrophobicContact CG2-CB 3.98Å; N263-E265 PolarHBondContact O-N 3.01Å; N263-E265 WeakPolarHBondContact OD1-CB 3.37Å; N263-E265 WeakPolarHBondContact OD1-CG 3.46Å; N263-E265 PolarHBondContact OD1-N 2.88Å
266	V	98.8	Very high	98.4	Very high	7 Å²	7	39.3 Å²	39.3	4%	0.042	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	132.1	-168.9	-175.8	0	0	0	0	111.2	C89 I91 L195 V203 L260 L261 N263 N264	C89-V266 WeakPolarHBondContact O-CA 3.23Å; I91-V266 HydrophobicContact CD1-CG1 3.66Å; I91-V266 HydrophobicContact CG1-CG1 3.62Å; L195-V266 HydrophobicContact CD1-CG1 4.32Å; V203-V266 HydrophobicContact CB-CG2 4.38Å; V203-V266 HydrophobicContact CG1-CG2 3.58Å; V203-V266 HydrophobicContact CG2-CG2 3.96Å; L260-V266 WeakPolarHBondContact O-CG2 3.05Å; L261-V266 HydrophobicContact CD1-CG1 4.35Å; N263-V266 HydrophobicContact CB-CG2 3.98Å; N263-V266 WeakPolarHBondContact O-CB 3.42Å; N263-V266 PolarHBondContact O-N 3.27Å; N264-V266 PolarHBondContact O-N 3.5Å
267	K	98.8	Very high	98.4	Very high	77 Å²	77	39.2 Å²	39.2	34%	0.335	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	163.9	165.8	-73.5	-172.2	-173.2	175.3	0	112.1	D76 H84 C89 S90 I91	D76-K267 IonicContact OD2-NZ 2.86Å; D76-K267 PolarHBondContact OD2-NZ 2.96Å; H84-K267 HydrophobicContact CB-CD 4.46Å; H84-K267 WeakPolarHBondContact ND1-CD 3.36Å; H84-K267 WeakPolarHBondContact ND1-CE 3.47Å; C89-K267 PolarHBondContact O-N 2.96Å; S90-K267 CarbonylContact C-O 3.53Å; S90-K267 WeakPolarHBondContact CA-O 3.17Å; I91-K267 PolarHBondContact N-O 3.24Å
268	L	98.8	Very high	98.5	Very high	20 Å²	20	39.3 Å²	39.3	11%	0.105	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	136	167.1	-53.5	-177.5	0	0	0	110	F54 N58 Y74 I91 L261	F54-L268 HydrophobicContact CD1-CD1 4.46Å; F54-L268 HydrophobicContact CE1-CD1 3.65Å; F54-L268 HydrophobicContact CE1-CD2 3.85Å; F54-L268 HydrophobicContact CE1-CG 4.41Å; F54-L268 HydrophobicContact CZ-CD1 4.16Å; F54-L268 HydrophobicContact CZ-CD2 4.17Å; N58-L268 HydrophobicContact CB-CD1 3.54Å; Y74-L268 HydrophobicContact CD1-CB 4.21Å; Y74-L268 HydrophobicContact CD1-CD1 4.09Å; Y74-L268 HydrophobicContact CD2-CB 3.75Å; Y74-L268 WeakPolarHBondContact CD2-O 3.24Å; Y74-L268 HydrophobicContact CE1-CB 3.9Å; Y74-L268 HydrophobicContact CE1-CD1 3.49Å; Y74-L268 VanDerWaalsContact CE1-CD1 3.49Å; Y74-L268 HydrophobicContact CE1-CG 4.36Å; Y74-L268 HydrophobicContact CE2-CB 3.41Å; Y74-L268 VanDerWaalsContact CE2-CB 3.41Å; Y74-L268 HydrophobicContact CG-CB 4.14Å; Y74-L268 VanDerWaalsContact CZ-CB 3.48Å; I91-L268 HydrophobicContact CB-CD2 3.94Å; I91-L268 HydrophobicContact CD1-CD2 4.04Å; I91-L268 HydrophobicContact CG2-CD2 4.38Å; L261-L268 HydrophobicContact CD1-CD2 4.08Å; L261-L268 HydrophobicContact CD1-CG 4.09Å; L261-L268 HydrophobicContact CD2-CD1 4.23Å; L261-L268 HydrophobicContact CD2-CD2 4.18Å; L261-L268 HydrophobicContact CD2-CG 4.12Å
269	A	98.8	Very high	98.5	Very high	3 Å²	3	34 Å²	34	3%	0.025	18%	0.183	C	C	.	.			trans	-121	141.5	176.3	0	0	0	0	0	111.3	S81 I91 F92 A273	S81-A269 WeakPolarHBondContact OG-CA 3.25Å; S81-A269 WeakPolarHBondContact OG-CB 3.5Å; I91-A269 PolarHBondContact O-N 3.34Å; F92-A269 HydrophobicContact CD1-CB 3.78Å; F92-A269 HydrophobicContact CD2-CB 4.37Å; F92-A269 HydrophobicContact CE1-CB 3.29Å; F92-A269 HydrophobicContact CE2-CB 3.93Å; F92-A269 HydrophobicContact CG-CB 4.3Å; F92-A269 HydrophobicContact CZ-CB 3.36Å; A269-A273 HydrophobicContact CB-CB 4.3Å
270	G	98.5	Very high	98.5	Very high	4 Å²	4	29 Å²	29	4%	0.041	16%	0.161	C	C	.	.			trans	-104.3	178	-177.7	0	0	0	0	0	113.4	P71 V72 G272 A273 R274	P71-G270 CarbonylContact O-C 3.51Å; P71-G270 WeakPolarHBondContact O-CA 3.32Å; V72-G270 CarbonylContact O-C 3.55Å; G270-G272 PolarHBondContact O-N 2.94Å; G270-G272 VanDerWaalsContact O-N 3.15Å; G270-A273 PolarHBondContact O-N 3.07Å; G270-R274 PolarHBondContact O-N 2.79Å; G270-R274 VanDerWaalsContact O-N 3.1Å
271	L	98.4	Very high	98.5	Very high	25 Å²	25	29.2 Å²	29.2	13%	0.131	16%	0.163	C	C	.	.	H	α-helix	trans	-53.8	-36.2	-177.3	-61.4	171.7	0	0	0	113.8	V63 F65 M70 P71 V72 A273 R274 D275	V63-L271 HydrophobicContact CG2-CD1 4.23Å; F65-L271 HydrophobicContact CB-CD1 3.55Å; F65-L271 HydrophobicContact CD1-CD1 4.24Å; F65-L271 HydrophobicContact CD1-CD2 4.13Å; F65-L271 HydrophobicContact CD2-CD1 3.78Å; F65-L271 HydrophobicContact CD2-CD2 4.46Å; F65-L271 HydrophobicContact CE1-CD2 4.23Å; F65-L271 HydrophobicContact CG-CD1 3.59Å; F65-L271 HydrophobicContact CG-CD2 4.24Å; F65-L271 HydrophobicContact CZ-CD2 4.45Å; M70-L271 HydrophobicContact CB-CD1 3.87Å; M70-L271 HydrophobicContact CB-CG 4.41Å; P71-L271 PolarHBondContact O-N 3.18Å; V72-L271 HydrophobicContact CG2-CB 4.47Å; V72-L271 PolarHBondContact O-N 3.03Å; L271-A273 VanDerWaalsContact C-N 3.33Å; L271-A273 PolarHBondContact O-N 2.96Å; L271-R274 PolarHBondContact O-N 3.35Å; L271-D275 PolarHBondContact O-N 3.49Å
272	G	97.9	Very high	98.5	Very high	21 Å²	21	27.4 Å²	27.4	22%	0.216	16%	0.156	C	C	.	.	H	α-helix	trans	-67.5	-29.7	179.2	0	0	0	0	0	114.2	V72 G270 S276	V72-G272 PolarHBondContact O-N 2.95Å; G270-G272 PolarHBondContact O-N 2.94Å; G270-G272 VanDerWaalsContact O-N 3.15Å; G272-S276 PolarHBondContact O-OG 2.65Å
273	A	98.6	Very high	98.6	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.008	14%	0.138	C	C	.	.	H	α-helix	trans	-76.7	-42.9	170.9	0	0	0	0	0	110.3	S81 F92 A269 G270 L271 D275 S276 L277	S81-A273 WeakPolarHBondContact OG-CB 3.4Å; F92-A273 HydrophobicContact CE1-CB 4.43Å; A269-A273 HydrophobicContact CB-CB 4.3Å; G270-A273 PolarHBondContact O-N 3.07Å; L271-A273 VanDerWaalsContact C-N 3.33Å; L271-A273 PolarHBondContact O-N 2.96Å; A273-D275 PolarHBondContact O-N 2.85Å; A273-S276 PolarHBondContact O-N 2.81Å; A273-S276 PolarHBondContact O-OG 3.28Å; A273-S276 VanDerWaalsContact O-OG 3.07Å; A273-L277 WeakPolarHBondContact O-CB 3.49Å; A273-L277 WeakPolarHBondContact O-CD1 3.49Å; A273-L277 VanDerWaalsContact O-CG 3.25Å; A273-L277 WeakPolarHBondContact O-CG 3.41Å; A273-L277 PolarHBondContact O-N 3.49Å
274	R	98.8	Very high	98.6	Very high	31 Å²	31	23.7 Å²	23.7	12%	0.117	13%	0.13	C	C	.	.	H	α-helix	trans	-54.9	-48.5	177.6	-175.5	176.6	170.7	89.5	-6.9	112.2	F92 Y238 G270 L271 L277 R278	F92-R274 HydrophobicContact CD1-CB 3.99Å; F92-R274 HydrophobicContact CD1-CG 4.5Å; F92-R274 HydrophobicContact CE1-CB 3.84Å; Y238-R274 HydrophobicContact CD1-CG 3.97Å; Y238-R274 HydrophobicContact CE1-CG 4.42Å; G270-R274 PolarHBondContact O-N 2.79Å; G270-R274 VanDerWaalsContact O-N 3.1Å; L271-R274 PolarHBondContact O-N 3.35Å; R274-L277 PolarHBondContact O-N 2.79Å; R274-R278 WeakPolarHBondContact O-CB 3.42Å; R274-R278 VanDerWaalsContact O-CG 3.31Å; R274-R278 WeakPolarHBondContact O-CG 3.45Å; R274-R278 PolarHBondContact O-N 3.35Å
275	D	98.6	Very high	98.7	Very high	58 Å²	58	19 Å²	19	31%	0.31	11%	0.105	S	C	.	.	H	α-helix	trans	-68.3	-35.2	-178.6	-176.6	54.5	0	0	0	113.6	L271 A273 R278 L279	L271-D275 PolarHBondContact O-N 3.49Å; A273-D275 PolarHBondContact O-N 2.85Å; D275-R278 WeakPolarHBondContact O-CG 3.47Å; D275-R278 PolarHBondContact O-NE 3.08Å; D275-R278 IonicContact OD1-CZ 2.81Å; D275-R278 VanDerWaalsContact OD1-CZ 3.24Å; D275-R278 IonicContact OD1-NE 2.7Å; D275-R278 PolarHBondContact OD1-NE 2.8Å; D275-R278 IonicContact OD1-NH2 3.24Å; D275-R278 PolarHBondContact OD1-NH2 3.3Å; D275-L279 VanDerWaalsContact O-CB 3.22Å; D275-L279 WeakPolarHBondContact O-CB 3.37Å; D275-L279 PolarHBondContact O-N 2.73Å
276	S	98.6	Very high	98.7	Very high	4 Å²	4	19 Å²	19	3%	0.028	10%	0.103	C	C	.	.	H	α-helix	trans	-74.4	-37.8	176.6	50.2	0	0	0	0	112.6	H82 G272 A273 E280	H82-S276 WeakPolarHBondContact ND1-CB 3.18Å; H82-S276 PolarHBondContact ND1-OG 2.75Å; G272-S276 PolarHBondContact O-OG 2.65Å; A273-S276 PolarHBondContact O-N 2.81Å; A273-S276 PolarHBondContact O-OG 3.28Å; A273-S276 VanDerWaalsContact O-OG 3.07Å; S276-E280 PolarHBondContact O-N 2.62Å
277	L	98.9	Very high	98.6	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-64.6	-49.3	176.4	-72.4	162.7	0	0	0	112.1	H82 T85 R86 F92 T239 A273 R274 L279 E280 A281	H82-L277 PolarHBondContact ND1-N 3Å; T85-L277 HydrophobicContact CG2-CD1 3.65Å; T85-L277 HydrophobicContact CG2-CD2 4.39Å; R86-L277 HydrophobicContact CG-CD2 3.96Å; R86-L277 PolarHBondContact NH2-O 3.35Å; F92-L277 HydrophobicContact CE1-CD1 4.38Å; F92-L277 HydrophobicContact CZ-CD1 3.66Å; T239-L277 HydrophobicContact CG2-CB 4.26Å; T239-L277 HydrophobicContact CG2-CD1 4.01Å; A273-L277 WeakPolarHBondContact O-CB 3.49Å; A273-L277 WeakPolarHBondContact O-CD1 3.49Å; A273-L277 VanDerWaalsContact O-CG 3.25Å; A273-L277 WeakPolarHBondContact O-CG 3.41Å; A273-L277 PolarHBondContact O-N 3.49Å; R274-L277 PolarHBondContact O-N 2.79Å; L277-L279 VanDerWaalsContact C-N 3.31Å; L277-L279 PolarHBondContact O-N 2.76Å; L277-E280 PolarHBondContact O-N 2.93Å; L277-A281 WeakPolarHBondContact O-CB 3.41Å; L277-A281 PolarHBondContact O-N 3.08Å
278	R	98.8	Very high	98.5	Very high	1 Å²	1	19.1 Å²	19.1	0%	0.004	12%	0.118	C	C	.	.	H	α-helix	trans	-63.1	-37.7	179.7	73.9	86.2	-167.9	-179.7	-6.7	112	Y238 R274 D275 A281 G282 L283 D289 S362	Y238-R278 HydrophobicContact CD1-CB 3.6Å; Y238-R278 HydrophobicContact CD1-CG 4.07Å; Y238-R278 HydrophobicContact CD2-CB 4.28Å; Y238-R278 HydrophobicContact CE1-CB 3.43Å; Y238-R278 VanDerWaalsContact CE1-CB 3.43Å; Y238-R278 HydrophobicContact CE1-CG 3.43Å; Y238-R278 VanDerWaalsContact CE1-CG 3.43Å; Y238-R278 HydrophobicContact CE2-CB 4.09Å; Y238-R278 HydrophobicContact CG-CB 4.04Å; Y238-R278 VanDerWaalsContact O-CB 3.28Å; Y238-R278 WeakPolarHBondContact O-CB 3.25Å; Y238-R278 WeakPolarHBondContact OH-CD 3.46Å; R274-R278 WeakPolarHBondContact O-CB 3.42Å; R274-R278 VanDerWaalsContact O-CG 3.31Å; R274-R278 WeakPolarHBondContact O-CG 3.45Å; R274-R278 PolarHBondContact O-N 3.35Å; D275-R278 WeakPolarHBondContact O-CG 3.47Å; D275-R278 PolarHBondContact O-NE 3.08Å; D275-R278 IonicContact OD1-CZ 2.81Å; D275-R278 VanDerWaalsContact OD1-CZ 3.24Å; D275-R278 IonicContact OD1-NE 2.7Å; D275-R278 PolarHBondContact OD1-NE 2.8Å; D275-R278 IonicContact OD1-NH2 3.24Å; D275-R278 PolarHBondContact OD1-NH2 3.3Å; R278-A281 CarbonylContact O-C 3.57Å; R278-A281 PolarHBondContact O-N 3.12Å; R278-G282 PolarHBondContact O-N 2.88Å; R278-G282 VanDerWaalsContact O-N 3.16Å; R278-L283 HydrophobicContact CB-CB 4.22Å; R278-L283 HydrophobicContact CB-CD1 4.43Å; R278-L283 WeakPolarHBondContact CD-O 3.17Å; R278-L283 PolarHBondContact NH1-O 3Å; R278-L283 PolarHBondContact O-N 3.22Å; R278-D289 IonicContact CZ-OD2 2.71Å; R278-D289 IonicContact NH1-OD2 3.44Å; R278-D289 PolarHBondContact NH1-OD2 2.9Å; R278-D289 IonicContact NH2-OD2 3.71Å; R278-S362 VanDerWaalsContact NH2-CB 3.33Å; R278-S362 PolarHBondContact NH2-OG 2.9Å
279	L	98.8	Very high	98.5	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-68.5	-45.3	-178	179	54.1	0	0	0	110.5	D275 L277 A281 G282 C364 V373 M375 F407	D275-L279 VanDerWaalsContact O-CB 3.22Å; D275-L279 WeakPolarHBondContact O-CB 3.37Å; D275-L279 PolarHBondContact O-N 2.73Å; L277-L279 VanDerWaalsContact C-N 3.31Å; L277-L279 PolarHBondContact O-N 2.76Å; L279-A281 VanDerWaalsContact C-N 3.27Å; L279-A281 PolarHBondContact O-N 2.84Å; L279-G282 PolarHBondContact O-N 2.85Å; L279-C364 HydrophobicContact CD2-CB 4.45Å; L279-V373 HydrophobicContact CD2-CG2 3.98Å; L279-V373 HydrophobicContact CG-CG2 3.94Å; L279-M375 HydrophobicContact CD1-CB 4.4Å; L279-M375 HydrophobicContact CD1-CE 3.64Å; L279-M375 HydrophobicContact CD1-CG 3.67Å; L279-M375 HydrophobicContact CD1-SD 4.36Å; L279-F407 WeakPolarHBondContact O-CD2 3.32Å; L279-F407 VanDerWaalsContact O-CE2 3.3Å; L279-F407 WeakPolarHBondContact O-CE2 3.48Å
280	E	98.8	Very high	98.5	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-59	-37.2	170.2	-77.7	-176.2	174	0	0	112.9	H82 R86 S276 L277 G282 S366 P367 C368 V373 F407 V408	H82-E280 IonicContact CE1-OE1 2.7Å; H82-E280 IonicContact CE1-OE2 3.8Å; H82-E280 PolarHBondContact CE1-OE2 3.21Å; H82-E280 IonicContact NE2-OE1 3.73Å; H82-E280 PolarHBondContact NE2-OE1 3.24Å; H82-E280 IonicContact NE2-OE2 2.73Å; H82-E280 PolarHBondContact NE2-OE2 3.35Å; R86-E280 IonicContact CZ-OE2 2.75Å; R86-E280 IonicContact NE-OE2 2.75Å; R86-E280 PolarHBondContact NE-OE2 2.7Å; R86-E280 IonicContact NH2-OE2 3.78Å; R86-E280 PolarHBondContact NH2-OE2 2.84Å; S276-E280 PolarHBondContact O-N 2.62Å; L277-E280 PolarHBondContact O-N 2.93Å; E280-G282 PolarHBondContact O-N 2.9Å; E280-S366 WeakPolarHBondContact OE1-CA 3.09Å; E280-S366 WeakPolarHBondContact OE1-CB 3.5Å; E280-S366 PolarHBondContact OE1-OG 3.33Å; E280-P367 WeakPolarHBondContact OE1-CD 3.49Å; E280-C368 PolarHBondContact OE1-N 3.32Å; E280-V373 HydrophobicContact CG-CG2 4.4Å; E280-F407 PolarHBondContact O-N 3.36Å; E280-V408 HydrophobicContact CB-CB 4.38Å; E280-V408 HydrophobicContact CB-CG2 3.99Å; E280-V408 HydrophobicContact CG-CG2 4.09Å; E280-V408 PolarHBondContact O-N 2.92Å
281	A	98.8	Very high	98.6	Very high	6 Å²	6	20.2 Å²	20.2	5%	0.05	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	1.6	175.4	0	0	0	0	0	114.3	T239 L277 R278 L279 L283 P406	T239-A281 WeakPolarHBondContact O-CB 3.42Å; L277-A281 WeakPolarHBondContact O-CB 3.41Å; L277-A281 PolarHBondContact O-N 3.08Å; R278-A281 CarbonylContact O-C 3.57Å; R278-A281 PolarHBondContact O-N 3.12Å; L279-A281 VanDerWaalsContact C-N 3.27Å; L279-A281 PolarHBondContact O-N 2.84Å; A281-L283 HydrophobicContact CB-CD1 4.05Å; A281-L283 HydrophobicContact CB-CG 3.91Å; A281-L283 PolarHBondContact O-N 2.68Å; A281-P406 WeakPolarHBondContact O-CB 2.92Å
282	G	98.6	Very high	98.6	Very high	11 Å²	11	23.1 Å²	23.1	11%	0.113	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	73	12.5	177.2	0	0	0	0	0	115.1	R278 L279 E280 R333	R278-G282 PolarHBondContact O-N 2.88Å; R278-G282 VanDerWaalsContact O-N 3.16Å; L279-G282 PolarHBondContact O-N 2.85Å; E280-G282 PolarHBondContact O-N 2.9Å; G282-R333 PolarHBondContact O-NH1 3.35Å
283	L	98.8	Very high	98.6	Very high	42 Å²	42	26.8 Å²	26.8	22%	0.22	15%	0.154	C	C	.	.	P	Polyproline II helix	trans	-83.9	135	-176.1	-53.2	178.4	0	0	0	111.5	Y238 R278 A281 M375	Y238-L283 HydrophobicContact CD2-CB 4.15Å; Y238-L283 HydrophobicContact CD2-CD1 3.73Å; Y238-L283 HydrophobicContact CE2-CB 3.8Å; Y238-L283 HydrophobicContact CE2-CD1 4.26Å; Y238-L283 HydrophobicContact CG-CD1 4.31Å; R278-L283 HydrophobicContact CB-CB 4.22Å; R278-L283 HydrophobicContact CB-CD1 4.43Å; R278-L283 WeakPolarHBondContact CD-O 3.17Å; R278-L283 PolarHBondContact NH1-O 3Å; R278-L283 PolarHBondContact O-N 3.22Å; A281-L283 HydrophobicContact CB-CD1 4.05Å; A281-L283 HydrophobicContact CB-CG 3.91Å; A281-L283 PolarHBondContact O-N 2.68Å; L283-M375 WeakPolarHBondContact O-CE 3.37Å
284	C	98.8	Very high	98.6	Very high	9 Å²	9	26.8 Å²	26.8	6%	0.061	15%	0.154	C	C	.	.	P	Polyproline II helix	trans	-75	141.5	-178.3	-54.9	0	0	0	0	110.4	Y238 D289 I290 R333	Y238-C284 PolarHBondContact OH-O 2.9Å; C284-D289 HydrophobicContact CB-CB 4.12Å; C284-I290 HydrophobicContact CB-CD1 3.81Å; C284-I290 HydrophobicContact CB-CG1 4.08Å; C284-I290 HydrophobicContact CB-CG2 4.36Å; C284-R333 PolarHBondContact SG-NE 2.92Å; C284-R333 PolarHBondContact SG-NH1 2.67Å; C284-R333 PolarHBondContact SG-NH2 3.44Å; C284-R333 VanDerWaalsContact SG-NH2 3.43Å
285	L	98.6	Very high	98.6	Very high	41 Å²	41	25.6 Å²	25.6	22%	0.215	15%	0.15	C	C	.	.	P	Polyproline II helix	trans	-101.7	118.9	164.2	175.5	62.6	0	0	0	108.7	Y238 N288 D289	Y238-L285 WeakPolarHBondContact OH-CA 3.39Å; L285-N288 HydrophobicContact CB-CB 4.21Å; L285-N288 HydrophobicContact CD2-CB 4.15Å; L285-N288 HydrophobicContact CG-CB 4.16Å; L285-N288 PolarHBondContact O-N 2.99Å; L285-N288 VanDerWaalsContact O-N 3.14Å; L285-D289 PolarHBondContact N-OD2 3.06Å; L285-D289 PolarHBondContact O-N 3.46Å
286	Y	98.5	Very high	98.6	Very high	37 Å²	37	22.8 Å²	22.8	15%	0.145	14%	0.135	C	C	.	.	B	Isolated β-bridge	trans	-60.2	142	174.4	-174	-86.6	0	0	0	111.7	I139 I140 D141 C161 K164 N288 I290	I139-Y286 HydrophobicContact CG2-CD2 4.27Å; I139-Y286 HydrophobicContact CG2-CE2 4.13Å; I139-Y286 WeakPolarHBondContact O-CE2 3.47Å; I139-Y286 PolarHBondContact O-OH 2.76Å; I140-Y286 VanDerWaalsContact O-CE2 3.23Å; I140-Y286 WeakPolarHBondContact O-CE2 3.38Å; I140-Y286 PolarHBondContact O-OH 2.75Å; I140-Y286 VanDerWaalsContact O-OH 3.11Å; D141-Y286 WeakPolarHBondContact OD1-CD1 3.42Å; C161-Y286 WeakPolarHBondContact SG-CD1 3.12Å; C161-Y286 WeakPolarHBondContact SG-CE1 3.17Å; K164-Y286 PolarHBondContact NZ-OH 2.94Å; K164-Y286 VanDerWaalsContact NZ-OH 3.07Å; Y286-N288 PolarHBondContact O-N 2.94Å; Y286-I290 HydrophobicContact CD2-CD1 4.35Å; Y286-I290 HydrophobicContact CD2-CG1 3.96Å
287	G	96.9	Very high	98.6	Very high	46 Å²	46	23.2 Å²	23.2	47%	0.474	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	-10.5	-173.1	0	0	0	0	0	114.1	I290	G287-I290 PolarHBondContact N-O 3.03Å
288	N	98.3	Very high	98.6	Very high	41 Å²	41	24.3 Å²	24.3	22%	0.219	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.1	-67.3	173.8	-87.5	42.7	0	0	0	111.3	L285 Y286 Q345 T361	L285-N288 HydrophobicContact CB-CB 4.21Å; L285-N288 HydrophobicContact CD2-CB 4.15Å; L285-N288 HydrophobicContact CG-CB 4.16Å; L285-N288 PolarHBondContact O-N 2.99Å; L285-N288 VanDerWaalsContact O-N 3.14Å; Y286-N288 PolarHBondContact O-N 2.94Å; N288-Q345 VanDerWaalsContact CG-NE2 3.3Å; N288-Q345 PolarHBondContact ND2-NE2 3.36Å; N288-Q345 PolarHBondContact ND2-OE1 3.4Å; N288-Q345 PolarHBondContact OD1-NE2 2.84Å; N288-T361 PolarHBondContact ND2-O 3.22Å; N288-T361 VanDerWaalsContact ND2-O 3.12Å; N288-T361 WeakPolarHBondContact O-CB 3.33Å; N288-T361 VanDerWaalsContact O-CG2 3.24Å; N288-T361 WeakPolarHBondContact O-CG2 3.47Å
289	D	98.8	Very high	98.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-17.5	-171.9	-52.2	-53.6	0	0	0	113.2	R278 C284 L285 T361 S362 M375 Y377	R278-D289 IonicContact CZ-OD2 2.71Å; R278-D289 IonicContact NH1-OD2 3.44Å; R278-D289 PolarHBondContact NH1-OD2 2.9Å; R278-D289 IonicContact NH2-OD2 3.71Å; C284-D289 HydrophobicContact CB-CB 4.12Å; L285-D289 PolarHBondContact N-OD2 3.06Å; L285-D289 PolarHBondContact O-N 3.46Å; D289-T361 WeakPolarHBondContact OD1-CB 3.18Å; D289-T361 PolarHBondContact OD1-OG1 3.49Å; D289-S362 VanDerWaalsContact OD1-CB 3.26Å; D289-S362 WeakPolarHBondContact OD1-CB 3.22Å; D289-S362 PolarHBondContact OD1-OG 2.87Å; D289-S362 PolarHBondContact OD2-OG 3.21Å; D289-S362 VanDerWaalsContact OD2-OG 3.11Å; D289-M375 HydrophobicContact CB-SD 4.4Å; D289-Y377 VanDerWaalsContact O-CE2 3.22Å; D289-Y377 WeakPolarHBondContact O-CE2 3.4Å; D289-Y377 PolarHBondContact O-OH 2.87Å
290	I	98.8	Very high	98.5	Very high	0 Å²	0	26 Å²	26	0%	0	16%	0.155	C	C	.	.	B	Isolated β-bridge	trans	-145.4	141.3	177.5	53.7	179.8	0	0	0	109.6	I139 D142 C284 Y286 G287 T294 A299 L301	I139-I290 HydrophobicContact CD1-CB 3.94Å; I139-I290 HydrophobicContact CD1-CD1 4.47Å; I139-I290 HydrophobicContact CD1-CG2 3.84Å; I139-I290 HydrophobicContact CG2-CD1 4.37Å; D142-I290 HydrophobicContact CB-CD1 3.99Å; C284-I290 HydrophobicContact CB-CD1 3.81Å; C284-I290 HydrophobicContact CB-CG1 4.08Å; C284-I290 HydrophobicContact CB-CG2 4.36Å; Y286-I290 HydrophobicContact CD2-CD1 4.35Å; Y286-I290 HydrophobicContact CD2-CG1 3.96Å; G287-I290 PolarHBondContact N-O 3.03Å; I290-T294 WeakPolarHBondContact CA-OG1 3.16Å; I290-A299 HydrophobicContact CG2-CB 3.55Å; I290-L301 HydrophobicContact CD1-CD1 4.29Å; I290-L301 HydrophobicContact CG2-CD1 4.17Å
291	D	98.6	Very high	98.5	Very high	50 Å²	50	26.4 Å²	26.4	27%	0.267	16%	0.157	S	C	.	.			trans	-155.6	-179.1	-179.6	64.2	49.6	0	0	0	111.4	I139 T293 T294	I139-D291 PolarHBondContact N-O 2.97Å; I139-D291 CarbonylContact O-C 3.43Å; D291-T293 PolarHBondContact O-N 3.24Å; D291-T293 VanDerWaalsContact OD1-CA 3.26Å; D291-T293 WeakPolarHBondContact OD1-CA 3.33Å; D291-T293 VanDerWaalsContact OD1-CB 3.23Å; D291-T293 WeakPolarHBondContact OD1-CB 3.4Å; D291-T293 PolarHBondContact OD1-N 3.03Å; D291-T293 PolarHBondContact OD1-OG1 3.15Å; D291-T294 PolarHBondContact N-OG1 3.23Å; D291-T294 PolarHBondContact O-N 3.42Å; D291-T294 PolarHBondContact O-OG1 2.8Å; D291-T294 PolarHBondContact OD1-N 2.95Å
292	E	98.6	Very high	98.5	Very high	87 Å²	87	27.8 Å²	27.8	41%	0.407	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-2.3	-177.6	-71.5	178.2	-135.8	0	0	115.1	N134 G138 I139 I140 K164	N134-E292 PolarHBondContact ND2-O 3.33Å; G138-E292 WeakPolarHBondContact CA-O 3.49Å; I139-E292 WeakPolarHBondContact O-CA 3.45Å; I139-E292 VanDerWaalsContact O-CG 3.23Å; I139-E292 WeakPolarHBondContact O-CG 3.4Å; I139-E292 PolarHBondContact O-N 2.91Å; I140-E292 HydrophobicContact CG1-CG 4.4Å; K164-E292 IonicContact NZ-OE1 3.28Å; K164-E292 PolarHBondContact NZ-OE1 3.1Å
293	T	98.1	Very high	98.5	Very high	97 Å²	97	34.6 Å²	34.6	60%	0.595	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-11.7	171.9	81	0	0	0	0	112.7	D291 R331	D291-T293 PolarHBondContact O-N 3.24Å; D291-T293 VanDerWaalsContact OD1-CA 3.26Å; D291-T293 WeakPolarHBondContact OD1-CA 3.33Å; D291-T293 VanDerWaalsContact OD1-CB 3.23Å; D291-T293 WeakPolarHBondContact OD1-CB 3.4Å; D291-T293 PolarHBondContact OD1-N 3.03Å; D291-T293 PolarHBondContact OD1-OG1 3.15Å; T293-R331 PolarHBondContact O-NH2 2.81Å
294	T	98.6	Very high	98.5	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.006	18%	0.178	C	C	.	.			trans	-100.6	127.5	179.1	63.4	0	0	0	0	111.2	G138 I139 I290 D291 Y377	G138-T294 WeakPolarHBondContact CA-O 3.22Å; I139-T294 WeakPolarHBondContact CG1-O 3.5Å; I139-T294 PolarHBondContact N-O 2.75Å; I139-T294 VanDerWaalsContact N-O 3.1Å; I290-T294 WeakPolarHBondContact CA-OG1 3.16Å; D291-T294 PolarHBondContact N-OG1 3.23Å; D291-T294 PolarHBondContact O-N 3.42Å; D291-T294 PolarHBondContact O-OG1 2.8Å; D291-T294 PolarHBondContact OD1-N 2.95Å; T294-Y377 HydrophobicContact CG2-CE1 4.34Å; T294-Y377 HydrophobicContact CG2-CE2 4.1Å
295	T	98.8	Very high	98.5	Very high	6 Å²	6	32.5 Å²	32.5	4%	0.037	18%	0.175	C	C	.	.			trans	-81.9	155.7	173.2	61.1	0	0	0	0	112	G137 V297 E298 A299 I320 Q324	G137-T295 WeakPolarHBondContact O-CA 3.46Å; G137-T295 WeakPolarHBondContact O-CG2 3.39Å; T295-V297 PolarHBondContact O-N 2.83Å; T295-E298 WeakPolarHBondContact CB-OE2 3.25Å; T295-E298 WeakPolarHBondContact CG2-OE2 3.42Å; T295-E298 PolarHBondContact N-OE2 2.83Å; T295-E298 PolarHBondContact O-N 2.94Å; T295-E298 VanDerWaalsContact OG1-CG 3.26Å; T295-E298 WeakPolarHBondContact OG1-CG 3.44Å; T295-E298 PolarHBondContact OG1-N 2.84Å; T295-E298 PolarHBondContact OG1-OE2 3.02Å; T295-A299 WeakPolarHBondContact O-CB 3.5Å; T295-A299 PolarHBondContact O-N 2.84Å; T295-I320 HydrophobicContact CG2-CG2 4.42Å; T295-Q324 PolarHBondContact OG1-OE1 3.3Å; T295-Q324 VanDerWaalsContact OG1-OE1 3.08Å
296	P	98.8	Very high	98.5	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-23.3	171.2	-26.7	34.7	0	0	0	114.3	L131 T133 G137 I139 L301 V302 I305 I321	L131-P296 HydrophobicContact CD1-CB 3.77Å; L131-P296 HydrophobicContact CD1-CG 3.69Å; T133-P296 HydrophobicContact CG2-CG 4.1Å; G137-P296 WeakPolarHBondContact O-CD 3.48Å; I139-P296 HydrophobicContact CD1-CG 4.35Å; I139-P296 HydrophobicContact CG1-CG 4.11Å; P296-L301 HydrophobicContact CB-CB 4.49Å; P296-L301 CarbonylContact O-C 3.51Å; P296-L301 WeakPolarHBondContact O-CA 3.33Å; P296-L301 PolarHBondContact O-N 3.19Å; P296-V302 PolarHBondContact O-N 2.71Å; P296-I305 HydrophobicContact CB-CD1 4.23Å; P296-I305 HydrophobicContact CB-CG1 4.42Å; P296-I321 HydrophobicContact CG-CD1 4.09Å
297	V	98.6	Very high	98.5	Very high	13 Å²	13	37.1 Å²	37.1	8%	0.079	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-48.6	177	-168.2	0	0	0	0	111.4	T295 A299 S300 V302 I321 Q324 I325 T329	T295-V297 PolarHBondContact O-N 2.83Å; V297-A299 VanDerWaalsContact C-N 3.28Å; V297-A299 PolarHBondContact O-N 3.47Å; V297-S300 PolarHBondContact O-N 2.95Å; V297-S300 VanDerWaalsContact O-N 3.16Å; V297-V302 HydrophobicContact CB-CG2 4.14Å; V297-V302 HydrophobicContact CG1-CG2 3.89Å; V297-V302 HydrophobicContact CG2-CG2 4.14Å; V297-I321 HydrophobicContact CG2-CG2 4.02Å; V297-I321 WeakPolarHBondContact CG2-O 3.42Å; V297-Q324 HydrophobicContact CB-CB 3.92Å; V297-Q324 HydrophobicContact CG1-CB 4Å; V297-Q324 HydrophobicContact CG2-CB 3.74Å; V297-I325 HydrophobicContact CG2-CG1 3.86Å; V297-T329 HydrophobicContact CB-CG2 3.87Å; V297-T329 HydrophobicContact CG1-CG2 3.68Å
298	E	98.7	Very high	98.5	Very high	23 Å²	23	38 Å²	38	11%	0.107	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-42.6	173.9	-68.5	165.8	110.8	0	0	110.8	T295 S300 T329 R331 K332 R333 Y377	T295-E298 WeakPolarHBondContact CB-OE2 3.25Å; T295-E298 WeakPolarHBondContact CG2-OE2 3.42Å; T295-E298 PolarHBondContact N-OE2 2.83Å; T295-E298 PolarHBondContact O-N 2.94Å; T295-E298 VanDerWaalsContact OG1-CG 3.26Å; T295-E298 WeakPolarHBondContact OG1-CG 3.44Å; T295-E298 PolarHBondContact OG1-N 2.84Å; T295-E298 PolarHBondContact OG1-OE2 3.02Å; E298-S300 PolarHBondContact O-N 3.38Å; E298-T329 HydrophobicContact CG-CG2 3.68Å; E298-R331 HydrophobicContact CG-CG 4.21Å; E298-R331 VanDerWaalsContact OE1-CG 3.32Å; E298-R331 WeakPolarHBondContact OE1-CG 3.22Å; E298-R331 IonicContact OE1-CZ 3.18Å; E298-R331 IonicContact OE1-NE 3.57Å; E298-R331 PolarHBondContact OE1-NE 2.88Å; E298-R331 IonicContact OE1-NH2 2.71Å; E298-R331 PolarHBondContact OE1-NH2 3.1Å; E298-K332 CarbonylContact O-C 3.52Å; E298-K332 WeakPolarHBondContact O-CA 3.42Å; E298-R333 PolarHBondContact O-N 3.13Å; E298-Y377 HydrophobicContact CB-CE1 3.96Å
299	A	98.6	Very high	98.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-0.5	179.5	0	0	0	0	0	114.6	I139 I290 T295 V297 L301 R333 Y377	I139-A299 HydrophobicContact CD1-CB 4.23Å; I290-A299 HydrophobicContact CG2-CB 3.55Å; T295-A299 WeakPolarHBondContact O-CB 3.5Å; T295-A299 PolarHBondContact O-N 2.84Å; V297-A299 VanDerWaalsContact C-N 3.28Å; V297-A299 PolarHBondContact O-N 3.47Å; A299-L301 HydrophobicContact CB-CB 4.36Å; A299-L301 HydrophobicContact CB-CD1 3.96Å; A299-L301 HydrophobicContact CB-CG 3.92Å; A299-L301 PolarHBondContact O-N 3.05Å; A299-R333 VanDerWaalsContact O-CZ 3.28Å; A299-R333 PolarHBondContact O-NE 2.8Å; A299-R333 PolarHBondContact O-NH2 2.75Å; A299-Y377 WeakPolarHBondContact CA-OH 3.5Å
300	S	98.4	Very high	98.5	Very high	36 Å²	36	40.1 Å²	40.1	25%	0.252	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	28.2	-172	-61	0	0	0	0	113.7	V297 E298 K332 R333	V297-S300 PolarHBondContact O-N 2.95Å; V297-S300 VanDerWaalsContact O-N 3.16Å; E298-S300 PolarHBondContact O-N 3.38Å; S300-K332 WeakPolarHBondContact OG-CE 3.41Å; S300-K332 WeakPolarHBondContact OG-CG 3.37Å; S300-R333 PolarHBondContact OG-O 3.08Å
301	L	98.8	Very high	98.4	Very high	8 Å²	8	47 Å²	47	4%	0.042	22%	0.224	C	C	.	.			trans	-105.6	15.5	-178.4	-63.5	179.6	0	0	0	113.6	L131 I139 I290 P296 A299 W303 T304	L131-L301 HydrophobicContact CD1-CB 4.09Å; L131-L301 HydrophobicContact CD1-CD1 3.98Å; L131-L301 HydrophobicContact CD2-CD1 4.04Å; I139-L301 HydrophobicContact CD1-CD1 4.39Å; I290-L301 HydrophobicContact CD1-CD1 4.29Å; I290-L301 HydrophobicContact CG2-CD1 4.17Å; P296-L301 HydrophobicContact CB-CB 4.49Å; P296-L301 CarbonylContact O-C 3.51Å; P296-L301 WeakPolarHBondContact O-CA 3.33Å; P296-L301 PolarHBondContact O-N 3.19Å; A299-L301 HydrophobicContact CB-CB 4.36Å; A299-L301 HydrophobicContact CB-CD1 3.96Å; A299-L301 HydrophobicContact CB-CG 3.92Å; A299-L301 PolarHBondContact O-N 3.05Å; L301-W303 HydrophobicContact CD2-CZ2 4.36Å; L301-W303 PolarHBondContact O-N 3.14Å; L301-T304 HydrophobicContact CB-CG2 4.37Å; L301-T304 WeakPolarHBondContact O-CB 3.43Å; L301-T304 PolarHBondContact O-N 2.85Å; L301-T304 PolarHBondContact O-OG1 3.1Å
302	V	98.4	Very high	98.4	Very high	35 Å²	35	48 Å²	48	21%	0.212	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-47.9	-30.9	178	-178	0	0	0	0	113.2	P296 V297 T304 I305 R310 I325	P296-V302 PolarHBondContact O-N 2.71Å; V297-V302 HydrophobicContact CB-CG2 4.14Å; V297-V302 HydrophobicContact CG1-CG2 3.89Å; V297-V302 HydrophobicContact CG2-CG2 4.14Å; V302-T304 PolarHBondContact O-N 2.97Å; V302-I305 HydrophobicContact CG1-CD1 4.48Å; V302-I305 PolarHBondContact O-N 3.25Å; V302-I305 VanDerWaalsContact O-N 3.14Å; V302-R310 PolarHBondContact O-NH2 3.09Å; V302-I325 HydrophobicContact CG1-CD1 4.07Å; V302-I325 HydrophobicContact CG1-CG1 4.02Å; V302-I325 HydrophobicContact CG1-CG2 4.19Å
303	W	98.4	Very high	98.3	Very high	154 Å²	154	48.2 Å²	48.2	58%	0.583	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-62.5	-24.2	178.5	65.4	-94.1	0	0	0	114.1	L129 L301 I305	L129-W303 HydrophobicContact CB-CH2 3.84Å; L129-W303 HydrophobicContact CB-CZ3 4.33Å; L129-W303 HydrophobicContact CD2-CH2 3.56Å; L129-W303 HydrophobicContact CD2-CZ2 3.7Å; L129-W303 HydrophobicContact CG-CH2 4.31Å; L301-W303 HydrophobicContact CD2-CZ2 4.36Å; L301-W303 PolarHBondContact O-N 3.14Å; W303-I305 VanDerWaalsContact C-N 3.3Å; W303-I305 PolarHBondContact O-N 2.83Å
304	T	98.8	Very high	98.3	Very high	5 Å²	5	46.8 Å²	46.8	3%	0.031	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-72.1	-22	175	62.8	0	0	0	0	113	A117 L129 L301 V302 G306	A117-T304 WeakPolarHBondContact CA-O 3.44Å; L129-T304 HydrophobicContact CD2-CG2 4.09Å; L129-T304 HydrophobicContact CG-CG2 4.4Å; L301-T304 HydrophobicContact CB-CG2 4.37Å; L301-T304 WeakPolarHBondContact O-CB 3.43Å; L301-T304 PolarHBondContact O-N 2.85Å; L301-T304 PolarHBondContact O-OG1 3.1Å; V302-T304 PolarHBondContact O-N 2.97Å; T304-G306 PolarHBondContact O-N 2.97Å
305	I	98.7	Very high	98.3	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.01	22%	0.222	C	C	.	.	S	Bend	trans	-79.8	114.1	-176.1	-45.7	169.3	0	0	0	109.1	V116 P296 V302 W303 R310 F315 I321 I325	V116-I305 HydrophobicContact CB-CB 4.48Å; V116-I305 HydrophobicContact CB-CG1 4.18Å; V116-I305 HydrophobicContact CB-CG2 4.36Å; V116-I305 HydrophobicContact CG2-CG1 4.3Å; V116-I305 WeakPolarHBondContact O-CA 3.34Å; P296-I305 HydrophobicContact CB-CD1 4.23Å; P296-I305 HydrophobicContact CB-CG1 4.42Å; V302-I305 HydrophobicContact CG1-CD1 4.48Å; V302-I305 PolarHBondContact O-N 3.25Å; V302-I305 VanDerWaalsContact O-N 3.14Å; W303-I305 VanDerWaalsContact C-N 3.3Å; W303-I305 PolarHBondContact O-N 2.83Å; I305-R310 HydrophobicContact CB-CG 4.23Å; I305-R310 HydrophobicContact CG2-CG 3.55Å; I305-R310 VanDerWaalsContact O-CZ 3.31Å; I305-R310 PolarHBondContact O-NE 2.7Å; I305-R310 PolarHBondContact O-NH2 2.71Å; I305-F315 HydrophobicContact CG2-CE1 4.03Å; I305-F315 HydrophobicContact CG2-CZ 3.82Å; I305-I321 HydrophobicContact CD1-CG2 3.49Å; I305-I321 VanDerWaalsContact CD1-CG2 3.49Å; I305-I325 HydrophobicContact CD1-CD1 3.99Å
306	G	98.3	Very high	98.3	Very high	11 Å²	11	47.4 Å²	47.4	11%	0.113	22%	0.223	C	C	.	.			trans	-59.1	148.4	-175.6	0	0	0	0	0	113.5	V116 T304 R308 R309 R310	V116-G306 PolarHBondContact O-N 3.49Å; T304-G306 PolarHBondContact O-N 2.97Å; G306-R308 PolarHBondContact O-N 2.96Å; G306-R309 WeakPolarHBondContact O-CB 3.48Å; G306-R309 PolarHBondContact O-N 3.36Å; G306-R310 WeakPolarHBondContact O-CG 3.24Å; G306-R310 PolarHBondContact O-N 3.42Å
307	K	98.1	Very high	98.3	Very high	164 Å²	164	47.7 Å²	47.7	71%	0.713	23%	0.226	S	C	*	.	H	α-helix	trans	-63.2	-44.7	-173.9	-176.9	-175.1	174	-171.1	0	111.4	D118	D118-K307 PolarHBondContact OD2-N 3.2Å
308	R	98.3	Very high	98.3	Very high	66 Å²	66	47.3 Å²	47.3	25%	0.249	22%	0.224	C	C	.	.	H	α-helix	trans	-65.4	-45.7	175	175.2	-175.2	52.2	97	-5.1	109.9	E112 D118 G306 R310 Q311 T312 D314	E112-R308 IonicContact OE1-CZ 2.75Å; E112-R308 IonicContact OE1-NH2 4Å; E112-R308 PolarHBondContact OE1-NH2 3.43Å; E112-R308 IonicContact OE2-CZ 3.55Å; E112-R308 VanDerWaalsContact OE2-CZ 3.31Å; E112-R308 IonicContact OE2-NH1 2.7Å; E112-R308 PolarHBondContact OE2-NH1 3.4Å; E112-R308 IonicContact OE2-NH2 2.68Å; E112-R308 PolarHBondContact OE2-NH2 3.25Å; D118-R308 IonicContact OD1-CZ 3.54Å; D118-R308 VanDerWaalsContact OD1-CZ 3.24Å; D118-R308 IonicContact OD1-NE 3.47Å; D118-R308 PolarHBondContact OD1-NE 3.37Å; D118-R308 IonicContact OD1-NH2 3.52Å; D118-R308 PolarHBondContact OD1-NH2 3.06Å; D118-R308 VanDerWaalsContact OD2-CB 3.3Å; D118-R308 WeakPolarHBondContact OD2-CB 3.48Å; D118-R308 PolarHBondContact OD2-N 3.22Å; G306-R308 PolarHBondContact O-N 2.96Å; R308-R310 VanDerWaalsContact C-N 3.26Å; R308-R310 PolarHBondContact O-N 3Å; R308-Q311 WeakPolarHBondContact O-CA 3.4Å; R308-Q311 WeakPolarHBondContact O-CB 3.38Å; R308-Q311 PolarHBondContact O-N 3.29Å; R308-T312 HydrophobicContact CG-CG2 3.85Å; R308-T312 PolarHBondContact O-N 3.21Å; R308-T312 PolarHBondContact O-OG1 3.15Å; R308-T312 VanDerWaalsContact O-OG1 3.07Å; R308-D314 IonicContact NH1-OD2 3.48Å
309	R	98.4	Very high	98.3	Very high	1 Å²	1	51.7 Å²	51.7	0%	0.004	25%	0.248	C	C	.	.	H	α-helix	trans	-52.3	-41.8	-179.2	-45.1	-53.2	-51.1	-73.8	-1.1	112.4	E112 V115 V116 A117 D118 G306 Q311 K313 D314 F315	E112-R309 PolarHBondContact O-NH1 3.05Å; E112-R309 PolarHBondContact O-NH2 3.08Å; E112-R309 IonicContact OE2-NE 3.57Å; V115-R309 PolarHBondContact O-NH1 3.35Å; V116-R309 WeakPolarHBondContact O-CG 3.44Å; A117-R309 WeakPolarHBondContact O-CG 3.18Å; A117-R309 PolarHBondContact O-NH1 3.25Å; D118-R309 HydrophobicContact CB-CG 4.4Å; G306-R309 WeakPolarHBondContact O-CB 3.48Å; G306-R309 PolarHBondContact O-N 3.36Å; R309-Q311 VanDerWaalsContact C-N 3.27Å; R309-Q311 PolarHBondContact O-N 2.59Å; R309-K313 WeakPolarHBondContact O-CA 3.48Å; R309-K313 PolarHBondContact O-N 3.23Å; R309-D314 IonicContact CZ-OD1 2.79Å; R309-D314 IonicContact NE-OD1 2.73Å; R309-D314 PolarHBondContact NE-OD1 3.15Å; R309-D314 IonicContact NE-OD2 3.35Å; R309-D314 PolarHBondContact NH2-O 3.42Å; R309-D314 IonicContact NH2-OD1 3.64Å; R309-D314 PolarHBondContact NH2-OD1 2.69Å; R309-F315 HydrophobicContact CB-CD1 4Å; R309-F315 HydrophobicContact CB-CE1 4.15Å; R309-F315 WeakPolarHBondContact O-CE1 3.41Å
310	R	97.6	Very high	98.2	Very high	84 Å²	84	55.1 Å²	55.1	32%	0.317	27%	0.266	S	S	.	.	H	α-helix	trans	-64.2	-26.5	174.7	-65.5	177.4	-153	-167.4	7	114.4	V302 I305 G306 R308 I325	V302-R310 PolarHBondContact O-NH2 3.09Å; I305-R310 HydrophobicContact CB-CG 4.23Å; I305-R310 HydrophobicContact CG2-CG 3.55Å; I305-R310 VanDerWaalsContact O-CZ 3.31Å; I305-R310 PolarHBondContact O-NE 2.7Å; I305-R310 PolarHBondContact O-NH2 2.71Å; G306-R310 WeakPolarHBondContact O-CG 3.24Å; G306-R310 PolarHBondContact O-N 3.42Å; R308-R310 VanDerWaalsContact C-N 3.26Å; R308-R310 PolarHBondContact O-N 3Å; R310-I325 HydrophobicContact CG-CD1 4.22Å
311	Q	97.4	Very high	98.2	Very high	145 Å²	145	53.4 Å²	53.4	68%	0.678	25%	0.254	S	S	*	.	H	α-helix	trans	-88.6	-43.6	-179.4	-62.9	174.2	-33.1	0	0	111.1	R308 R309	R308-Q311 WeakPolarHBondContact O-CA 3.4Å; R308-Q311 WeakPolarHBondContact O-CB 3.38Å; R308-Q311 PolarHBondContact O-N 3.29Å; R309-Q311 VanDerWaalsContact C-N 3.27Å; R309-Q311 PolarHBondContact O-N 2.59Å
312	T	97.8	Very high	98.2	Very high	71 Å²	71	54.3 Å²	54.3	44%	0.436	26%	0.259	S	S	.	.	H	α-helix	trans	-78.9	-25.2	-179.6	51.6	0	0	0	0	113.2	R308 D314	R308-T312 HydrophobicContact CG-CG2 3.85Å; R308-T312 PolarHBondContact O-N 3.21Å; R308-T312 PolarHBondContact O-OG1 3.15Å; R308-T312 VanDerWaalsContact O-OG1 3.07Å; T312-D314 WeakPolarHBondContact CB-OD2 3.49Å; T312-D314 PolarHBondContact O-N 3.19Å; T312-D314 PolarHBondContact OG1-OD1 2.84Å; T312-D314 VanDerWaalsContact OG1-OD1 3.06Å; T312-D314 PolarHBondContact OG1-OD2 2.78Å
313	K	98.1	Very high	98.2	Very high	91 Å²	91	55.7 Å²	55.7	40%	0.396	27%	0.269	S	S	.	.			trans	55	30.2	-175.8	-62.8	179.6	161.3	-163.3	0	113.8	R309 F315 A318 D319 V322	R309-K313 WeakPolarHBondContact O-CA 3.48Å; R309-K313 PolarHBondContact O-N 3.23Å; K313-F315 VanDerWaalsContact C-N 3.27Å; K313-F315 PolarHBondContact O-N 3.47Å; K313-A318 HydrophobicContact CB-CB 3.81Å; K313-A318 HydrophobicContact CG-CB 4.38Å; K313-A318 WeakPolarHBondContact O-CB 3.2Å; K313-D319 IonicContact NZ-OD1 3.81Å; K313-D319 PolarHBondContact NZ-OD1 2.63Å; K313-V322 HydrophobicContact CG-CG2 4.34Å
314	D	97.6	Very high	98.2	Very high	66 Å²	66	50.2 Å²	50.2	35%	0.353	25%	0.25	S	C	.	.			trans	-89.7	34.2	-173.1	56.5	14.1	0	0	0	113.3	R308 R309 T312	R308-D314 IonicContact NH1-OD2 3.48Å; R309-D314 IonicContact CZ-OD1 2.79Å; R309-D314 IonicContact NE-OD1 2.73Å; R309-D314 PolarHBondContact NE-OD1 3.15Å; R309-D314 IonicContact NE-OD2 3.35Å; R309-D314 PolarHBondContact NH2-O 3.42Å; R309-D314 IonicContact NH2-OD1 3.64Å; R309-D314 PolarHBondContact NH2-OD1 2.69Å; T312-D314 WeakPolarHBondContact CB-OD2 3.49Å; T312-D314 PolarHBondContact O-N 3.19Å; T312-D314 PolarHBondContact OG1-OD1 2.84Å; T312-D314 VanDerWaalsContact OG1-OD1 3.06Å; T312-D314 PolarHBondContact OG1-OD2 2.78Å
315	F	98.6	Very high	98.1	Very high	12 Å²	12	52.5 Å²	52.5	5%	0.053	26%	0.262	C	S	.	.	S	Bend	trans	-132.8	154.4	177	62	-87.1	0	0	0	111.5	V116 I305 R309 K313 G317 A318 I321 V322	V116-F315 HydrophobicContact CB-CD2 4.48Å; V116-F315 HydrophobicContact CG1-CD2 3.81Å; V116-F315 HydrophobicContact CG1-CE2 3.99Å; I305-F315 HydrophobicContact CG2-CE1 4.03Å; I305-F315 HydrophobicContact CG2-CZ 3.82Å; R309-F315 HydrophobicContact CB-CD1 4Å; R309-F315 HydrophobicContact CB-CE1 4.15Å; R309-F315 WeakPolarHBondContact O-CE1 3.41Å; K313-F315 VanDerWaalsContact C-N 3.27Å; K313-F315 PolarHBondContact O-N 3.47Å; F315-G317 PolarHBondContact O-N 2.85Å; F315-A318 HydrophobicContact CD1-CB 3.85Å; F315-A318 HydrophobicContact CD2-CB 3.9Å; F315-A318 HydrophobicContact CE1-CB 3.66Å; F315-A318 HydrophobicContact CE2-CB 3.72Å; F315-A318 HydrophobicContact CG-CB 3.97Å; F315-A318 HydrophobicContact CZ-CB 3.6Å; F315-A318 VanDerWaalsContact O-CB 3.22Å; F315-A318 WeakPolarHBondContact O-CB 3.48Å; F315-A318 PolarHBondContact O-N 2.96Å; F315-A318 VanDerWaalsContact O-N 3.15Å; F315-I321 HydrophobicContact CD2-CD1 4.44Å; F315-I321 HydrophobicContact CE2-CB 4.16Å; F315-I321 HydrophobicContact CE2-CD1 3.8Å; F315-I321 HydrophobicContact CE2-CG2 4.18Å; F315-I321 HydrophobicContact CZ-CG2 4.33Å; F315-V322 HydrophobicContact CE1-CG2 4.22Å; F315-V322 HydrophobicContact CZ-CG2 3.86Å
316	P	98.6	Very high	97.8	Very high	9 Å²	9	61.6 Å²	61.6	6%	0.058	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	133.6	-178.4	-27.1	36.2	0	0	0	112.7	S113 T133 N134 A318	S113-P316 WeakPolarHBondContact O-CD 3.12Å; S113-P316 VanDerWaalsContact O-CG 3.31Å; S113-P316 WeakPolarHBondContact O-CG 3.27Å; T133-P316 WeakPolarHBondContact O-CB 3.19Å; T133-P316 PolarHBondContact OG1-O 2.6Å; N134-P316 CarbonylContact O-C 3.16Å; P316-A318 PolarHBondContact O-N 3.05Å
317	G	98.4	Very high	97.6	Very high	6 Å²	6	65 Å²	65	6%	0.062	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.2	12.8	179.2	0	0	0	0	0	115.8	N134 E135 F315 D319 I320 I321	N134-G317 PolarHBondContact O-N 3.39Å; E135-G317 PolarHBondContact OE2-N 3.22Å; E135-G317 VanDerWaalsContact OE2-N 3.14Å; F315-G317 PolarHBondContact O-N 2.85Å; G317-D319 PolarHBondContact O-N 2.92Å; G317-D319 VanDerWaalsContact O-N 3.15Å; G317-I320 PolarHBondContact O-N 2.91Å; G317-I321 WeakPolarHBondContact O-CG1 3.28Å; G317-I321 PolarHBondContact O-N 2.95Å
318	A	98.5	Very high	97.3	Very high	4 Å²	4	65.3 Å²	65.3	3%	0.033	33%	0.329	C	S	.	.	H	α-helix	trans	-55.1	-31.9	177.9	0	0	0	0	0	113.8	K313 F315 P316 I320 I321 V322	K313-A318 HydrophobicContact CB-CB 3.81Å; K313-A318 HydrophobicContact CG-CB 4.38Å; K313-A318 WeakPolarHBondContact O-CB 3.2Å; F315-A318 HydrophobicContact CD1-CB 3.85Å; F315-A318 HydrophobicContact CD2-CB 3.9Å; F315-A318 HydrophobicContact CE1-CB 3.66Å; F315-A318 HydrophobicContact CE2-CB 3.72Å; F315-A318 HydrophobicContact CG-CB 3.97Å; F315-A318 HydrophobicContact CZ-CB 3.6Å; F315-A318 VanDerWaalsContact O-CB 3.22Å; F315-A318 WeakPolarHBondContact O-CB 3.48Å; F315-A318 PolarHBondContact O-N 2.96Å; F315-A318 VanDerWaalsContact O-N 3.15Å; P316-A318 PolarHBondContact O-N 3.05Å; A318-I320 PolarHBondContact O-N 2.84Å; A318-I321 PolarHBondContact O-N 3.2Å; A318-V322 HydrophobicContact CB-CG2 4.42Å; A318-V322 VanDerWaalsContact O-CB 3.26Å; A318-V322 WeakPolarHBondContact O-CB 3.1Å; A318-V322 WeakPolarHBondContact O-CG2 3.5Å; A318-V322 PolarHBondContact O-N 3.01Å
319	D	98	Very high	97.2	Very high	116 Å²	116	63.1 Å²	63.1	62%	0.62	32%	0.323	S	S	*	.	H	α-helix	trans	-70.3	-15.1	177.1	-79.1	-38.5	0	0	0	114.5	K313 G317 P323	K313-D319 IonicContact NZ-OD1 3.81Å; K313-D319 PolarHBondContact NZ-OD1 2.63Å; G317-D319 PolarHBondContact O-N 2.92Å; G317-D319 VanDerWaalsContact O-N 3.15Å; D319-P323 VanDerWaalsContact O-CD 3.3Å; D319-P323 WeakPolarHBondContact O-CD 3.41Å; D319-P323 VanDerWaalsContact O-CG 3.25Å; D319-P323 WeakPolarHBondContact O-CG 3.46Å
320	I	98.1	Very high	97.1	Very high	72 Å²	72	67.2 Å²	67.2	37%	0.369	36%	0.357	S	S	.	.	H	α-helix	trans	-96.1	-47.7	170.2	-66.4	165.6	0	0	0	109.9	K136 T295 G317 A318 P323 Q324	K136-I320 WeakPolarHBondContact O-CD1 3.42Å; T295-I320 HydrophobicContact CG2-CG2 4.42Å; G317-I320 PolarHBondContact O-N 2.91Å; A318-I320 PolarHBondContact O-N 2.84Å; I320-P323 WeakPolarHBondContact O-CD 3.2Å; I320-Q324 VanDerWaalsContact O-CG 3.32Å; I320-Q324 WeakPolarHBondContact O-CG 3.48Å
321	I	98.6	Very high	97.1	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-67.4	-44.8	-173.4	-64.6	168.2	0	0	0	111.8	T133 P296 V297 I305 F315 G317 A318 Q324 I325	T133-I321 HydrophobicContact CG2-CD1 4.09Å; P296-I321 HydrophobicContact CG-CD1 4.09Å; V297-I321 HydrophobicContact CG2-CG2 4.02Å; V297-I321 WeakPolarHBondContact CG2-O 3.42Å; I305-I321 HydrophobicContact CD1-CG2 3.49Å; I305-I321 VanDerWaalsContact CD1-CG2 3.49Å; F315-I321 HydrophobicContact CD2-CD1 4.44Å; F315-I321 HydrophobicContact CE2-CB 4.16Å; F315-I321 HydrophobicContact CE2-CD1 3.8Å; F315-I321 HydrophobicContact CE2-CG2 4.18Å; F315-I321 HydrophobicContact CZ-CG2 4.33Å; G317-I321 WeakPolarHBondContact O-CG1 3.28Å; G317-I321 PolarHBondContact O-N 2.95Å; A318-I321 PolarHBondContact O-N 3.2Å; I321-Q324 PolarHBondContact O-N 3.47Å; I321-I325 PolarHBondContact O-N 3.03Å
322	V	98.3	Very high	97.1	Very high	26 Å²	26	64 Å²	64	16%	0.158	34%	0.341	C	S	.	.	H	α-helix	trans	-68.1	-42.7	-174.2	175.9	0	0	0	0	112.8	K313 F315 A318 Q324 I325	K313-V322 HydrophobicContact CG-CG2 4.34Å; F315-V322 HydrophobicContact CE1-CG2 4.22Å; F315-V322 HydrophobicContact CZ-CG2 3.86Å; A318-V322 HydrophobicContact CB-CG2 4.42Å; A318-V322 VanDerWaalsContact O-CB 3.26Å; A318-V322 WeakPolarHBondContact O-CB 3.1Å; A318-V322 WeakPolarHBondContact O-CG2 3.5Å; A318-V322 PolarHBondContact O-N 3.01Å; V322-Q324 PolarHBondContact O-N 2.95Å; V322-I325 WeakPolarHBondContact O-CB 3.46Å; V322-I325 PolarHBondContact O-N 2.75Å
323	P	98	Very high	97.2	Very high	64 Å²	64	61.1 Å²	61.1	42%	0.416	32%	0.322	S	S	.	.	H	α-helix	trans	-59	-40.9	172.6	-29.3	38.6	0	0	0	114.1	D319 I320 I325 K326 A327	D319-P323 VanDerWaalsContact O-CD 3.3Å; D319-P323 WeakPolarHBondContact O-CD 3.41Å; D319-P323 VanDerWaalsContact O-CG 3.25Å; D319-P323 WeakPolarHBondContact O-CG 3.46Å; I320-P323 WeakPolarHBondContact O-CD 3.2Å; P323-I325 PolarHBondContact O-N 2.85Å; P323-K326 PolarHBondContact O-N 3.01Å; P323-A327 WeakPolarHBondContact O-CB 3.39Å; P323-A327 PolarHBondContact O-N 2.91Å
324	Q	97.9	Very high	97.2	Very high	39 Å²	39	57.1 Å²	57.1	18%	0.182	31%	0.306	C	S	.	.	H	α-helix	trans	-58.1	-31.5	178.7	-74.4	173.1	-16	0	0	113	T295 V297 I320 I321 V322 K326 K328 T329	T295-Q324 PolarHBondContact OG1-OE1 3.3Å; T295-Q324 VanDerWaalsContact OG1-OE1 3.08Å; V297-Q324 HydrophobicContact CB-CB 3.92Å; V297-Q324 HydrophobicContact CG1-CB 4Å; V297-Q324 HydrophobicContact CG2-CB 3.74Å; I320-Q324 VanDerWaalsContact O-CG 3.32Å; I320-Q324 WeakPolarHBondContact O-CG 3.48Å; I321-Q324 PolarHBondContact O-N 3.47Å; V322-Q324 PolarHBondContact O-N 2.95Å; Q324-K326 PolarHBondContact O-N 2.96Å; Q324-K328 WeakPolarHBondContact O-CA 3.25Å; Q324-K328 PolarHBondContact O-N 2.83Å; Q324-T329 HydrophobicContact CB-CG2 3.94Å; Q324-T329 HydrophobicContact CG-CG2 4.01Å
325	I	96.6	Very high	97.3	Very high	54 Å²	54	54 Å²	54	28%	0.277	29%	0.289	S	S	.	.	H	α-helix	trans	-58.6	-35.7	177	-60.5	172.4	0	0	0	111.5	V297 V302 I305 R310 I321 V322 P323	V297-I325 HydrophobicContact CG2-CG1 3.86Å; V302-I325 HydrophobicContact CG1-CD1 4.07Å; V302-I325 HydrophobicContact CG1-CG1 4.02Å; V302-I325 HydrophobicContact CG1-CG2 4.19Å; I305-I325 HydrophobicContact CD1-CD1 3.99Å; R310-I325 HydrophobicContact CG-CD1 4.22Å; I321-I325 PolarHBondContact O-N 3.03Å; V322-I325 WeakPolarHBondContact O-CB 3.46Å; V322-I325 PolarHBondContact O-N 2.75Å; P323-I325 PolarHBondContact O-N 2.85Å
326	K	92.4	Very high	97.3	Very high	193 Å²	193	53.6 Å²	53.6	84%	0.839	29%	0.287	S	S	*	.	H	α-helix	trans	-91.4	-45.7	178.3	-68.2	-176.5	178.7	179.7	0	112.5	P323 Q324 K328	P323-K326 PolarHBondContact O-N 3.01Å; Q324-K326 PolarHBondContact O-N 2.96Å; K326-K328 PolarHBondContact O-N 2.9Å
327	A	93.6	Very high	97.3	Very high	81 Å²	81	54.3 Å²	54.3	67%	0.669	29%	0.29	S	S	*	.	H	α-helix	trans	-72	-19.1	-176.2	0	0	0	0	0	113.4	P323	P323-A327 WeakPolarHBondContact O-CB 3.39Å; P323-A327 PolarHBondContact O-N 2.91Å
328	K	92.1	Very high	97.3	Very high	171 Å²	171	54.4 Å²	54.4	74%	0.743	29%	0.29	S	S	*	.			trans	65.2	176.5	-162.6	-50.5	171.4	-175.4	169.8	0	111.2	Q324 K326	Q324-K328 WeakPolarHBondContact O-CA 3.25Å; Q324-K328 PolarHBondContact O-N 2.83Å; K326-K328 PolarHBondContact O-N 2.9Å
329	T	96	Very high	97.2	Very high	21 Å²	21	58.6 Å²	58.6	13%	0.129	32%	0.315	C	S	.	.			trans	-115.8	157.3	-176.4	52	0	0	0	0	110.4	V297 E298 Q324 R331 A380	V297-T329 HydrophobicContact CB-CG2 3.87Å; V297-T329 HydrophobicContact CG1-CG2 3.68Å; E298-T329 HydrophobicContact CG-CG2 3.68Å; Q324-T329 HydrophobicContact CB-CG2 3.94Å; Q324-T329 HydrophobicContact CG-CG2 4.01Å; T329-R331 VanDerWaalsContact CB-O 3.32Å; T329-R331 WeakPolarHBondContact CB-O 3.46Å; T329-R331 PolarHBondContact OG1-O 3.2Å; T329-A380 VanDerWaalsContact O-CB 3.26Å; T329-A380 WeakPolarHBondContact O-CB 3.33Å
330	A	96.3	Very high	97.1	Very high	86 Å²	86	55.9 Å²	55.9	71%	0.711	32%	0.315	S	S	*	.	S	Bend	trans	-67.8	-42.1	178.2	0	0	0	0	0	112	A380	A330-A380 WeakPolarHBondContact O-CB 3.35Å; A330-A380 PolarHBondContact O-N 3.46Å
331	R	97.6	Very high	96.9	Very high	77 Å²	77	55.9 Å²	55.9	29%	0.291	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	161.2	173.4	64.7	178	178.2	165.9	1.8	111.7	T293 E298 T329 Y377 V378	T293-R331 PolarHBondContact O-NH2 2.81Å; E298-R331 HydrophobicContact CG-CG 4.21Å; E298-R331 VanDerWaalsContact OE1-CG 3.32Å; E298-R331 WeakPolarHBondContact OE1-CG 3.22Å; E298-R331 IonicContact OE1-CZ 3.18Å; E298-R331 IonicContact OE1-NE 3.57Å; E298-R331 PolarHBondContact OE1-NE 2.88Å; E298-R331 IonicContact OE1-NH2 2.71Å; E298-R331 PolarHBondContact OE1-NH2 3.1Å; T329-R331 VanDerWaalsContact CB-O 3.32Å; T329-R331 WeakPolarHBondContact CB-O 3.46Å; T329-R331 PolarHBondContact OG1-O 3.2Å; R331-Y377 HydrophobicContact CG-CD1 4.13Å; R331-V378 CarbonylContact C-O 3.59Å; R331-V378 VanDerWaalsContact CA-O 3.28Å; R331-V378 WeakPolarHBondContact CA-O 3.26Å
332	K	98.4	Very high	96.8	Very high	84 Å²	84	58.3 Å²	58.3	37%	0.365	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	138.4	176.1	-173	175.4	178.7	-177.1	0	112	E298 S300 V334 Y377 V378 A383	E298-K332 CarbonylContact O-C 3.52Å; E298-K332 WeakPolarHBondContact O-CA 3.42Å; S300-K332 WeakPolarHBondContact OG-CE 3.41Å; S300-K332 WeakPolarHBondContact OG-CG 3.37Å; K332-V334 PolarHBondContact O-N 2.9Å; K332-Y377 WeakPolarHBondContact O-CA 3.49Å; K332-V378 PolarHBondContact N-O 2.87Å; K332-V378 PolarHBondContact O-N 3.4Å; K332-V378 VanDerWaalsContact O-N 3.07Å; K332-A383 HydrophobicContact CB-CB 3.95Å; K332-A383 HydrophobicContact CD-CB 4.13Å; K332-A383 HydrophobicContact CG-CB 4.46Å
333	R	98.8	Very high	96.6	Very high	12 Å²	12	57.1 Å²	57.1	5%	0.045	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	126.6	170.8	-171.1	-177.1	59	102.8	0.1	110.1	G282 C284 E298 A299 S300 M375 G376 Y377	G282-R333 PolarHBondContact O-NH1 3.35Å; C284-R333 PolarHBondContact SG-NE 2.92Å; C284-R333 PolarHBondContact SG-NH1 2.67Å; C284-R333 PolarHBondContact SG-NH2 3.44Å; C284-R333 VanDerWaalsContact SG-NH2 3.43Å; E298-R333 PolarHBondContact O-N 3.13Å; A299-R333 VanDerWaalsContact O-CZ 3.28Å; A299-R333 PolarHBondContact O-NE 2.8Å; A299-R333 PolarHBondContact O-NH2 2.75Å; S300-R333 PolarHBondContact OG-O 3.08Å; R333-M375 PolarHBondContact NH1-SD 3.48Å; R333-G376 CarbonylContact C-O 3.59Å; R333-G376 WeakPolarHBondContact CA-O 3.39Å; R333-Y377 HydrophobicContact CB-CD1 4.18Å; R333-Y377 HydrophobicContact CB-CE1 3.73Å; R333-Y377 HydrophobicContact CB-CE2 4.28Å; R333-Y377 HydrophobicContact CG-CE2 4.44Å
334	V	98.9	Very high	96.5	Very high	7 Å²	7	60.4 Å²	60.4	4%	0.042	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	161.6	178.5	-64	0	0	0	0	111.5	K332 L336 M375 G376 V378 A383 V402	K332-V334 PolarHBondContact O-N 2.9Å; V334-L336 HydrophobicContact CG2-CD2 4.15Å; V334-M375 WeakPolarHBondContact O-CA 3.43Å; V334-G376 PolarHBondContact N-O 2.99Å; V334-G376 PolarHBondContact O-N 3.21Å; V334-G376 VanDerWaalsContact O-N 3.16Å; V334-V378 HydrophobicContact CG1-CG2 3.97Å; V334-V378 HydrophobicContact CG2-CG1 4.02Å; V334-V378 HydrophobicContact CG2-CG2 3.76Å; V334-A383 HydrophobicContact CG1-CB 3.81Å; V334-V402 HydrophobicContact CB-CG1 3.94Å; V334-V402 HydrophobicContact CG1-CG1 4.08Å; V334-V402 HydrophobicContact CG2-CG1 4.35Å
335	G	98.8	Very high	96.4	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	149.6	165.3	0	0	0	0	0	110.6	A374 V402 S403 F407	G335-A374 CarbonylContact C-O 3.54Å; G335-A374 WeakPolarHBondContact CA-O 3.21Å; G335-V402 CarbonylContact O-C 3.36Å; G335-V402 WeakPolarHBondContact O-CA 3.41Å; G335-S403 PolarHBondContact O-N 3.4Å; G335-F407 VanDerWaalsContact CA-CZ 3.45Å
336	L	98.8	Very high	96.5	Very high	3 Å²	3	65.4 Å²	65.4	2%	0.016	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	140.5	177.7	-59.1	176	0	0	0	110.2	V334 I349 V360 A374 V389 V391 I401 V402 F407	V334-L336 HydrophobicContact CG2-CD2 4.15Å; L336-I349 HydrophobicContact CD1-CD1 3.79Å; L336-I349 HydrophobicContact CD1-CG1 4.1Å; L336-V360 HydrophobicContact CD1-CG2 3.97Å; L336-A374 HydrophobicContact CB-CB 4.22Å; L336-A374 PolarHBondContact N-O 3.31Å; L336-A374 PolarHBondContact O-N 3.21Å; L336-V389 HydrophobicContact CD2-CG2 3.92Å; L336-V391 HydrophobicContact CD1-CG1 4.26Å; L336-I401 WeakPolarHBondContact CA-O 3.22Å; L336-V402 HydrophobicContact CD2-CG2 4.01Å; L336-F407 WeakPolarHBondContact O-CE1 3.38Å
337	L	98.7	Very high	96.7	Very high	25 Å²	25	56.9 Å²	56.9	13%	0.131	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	134.9	168	-73.9	170.9	0	0	0	110.2	L369 K371 N372 V373 A400 I401 F407	L337-L369 HydrophobicContact CD2-CD1 4.16Å; L337-K371 HydrophobicContact CD2-CB 4.49Å; L337-N372 WeakPolarHBondContact CA-O 3.39Å; L337-V373 HydrophobicContact CD2-CG1 3.67Å; L337-A400 CarbonylContact O-C 3.26Å; L337-A400 VanDerWaalsContact O-CA 3.3Å; L337-A400 WeakPolarHBondContact O-CA 3.41Å; L337-I401 HydrophobicContact CB-CD1 4.42Å; L337-I401 HydrophobicContact CB-CG1 3.9Å; L337-I401 PolarHBondContact N-O 3.09Å; L337-I401 PolarHBondContact O-N 2.65Å; L337-F407 HydrophobicContact CD2-CD1 3.92Å; L337-F407 HydrophobicContact CD2-CE1 4.32Å; L337-F407 HydrophobicContact CG-CD1 4.04Å; L337-F407 HydrophobicContact CG-CE1 4.22Å
338	S	98.1	Very high	97	Very high	8 Å²	8	55 Å²	55	6%	0.056	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	174.1	171.7	74.5	0	0	0	0	112.1	V343 N372	S338-V343 WeakPolarHBondContact OG-CG2 3.14Å; S338-N372 PolarHBondContact N-O 3.49Å; S338-N372 VanDerWaalsContact N-O 3.12Å; S338-N372 PolarHBondContact O-N 3.12Å
339	T	96.9	Very high	97.3	Very high	92 Å²	92	46.8 Å²	46.8	56%	0.564	26%	0.263	S	S	*	.			trans	-126.8	167.5	176.5	57.2	0	0	0	0	110.6	K371	T339-K371 HydrophobicContact CG2-CG 4.37Å
340	G	95.2	Very high	97.4	Very high	59 Å²	59	46.2 Å²	46.2	61%	0.608	26%	0.259	S	S	*	.	S	Bend	trans	77.9	-136.7	-176.8	0	0	0	0	0	112.2	N372	G340-N372 PolarHBondContact O-ND2 2.92Å
341	P	95.9	Very high	97.5	Very high	71 Å²	71	42.2 Å²	42.2	46%	0.461	23%	0.226	S	C	.	.	S	Bend	trans	-55.8	137.2	-176.1	-26.2	35.6	0	0	0	113.4	V343 N372 I393	P341-V343 PolarHBondContact O-N 3.15Å; P341-N372 PolarHBondContact O-ND2 3.28Å; P341-N372 VanDerWaalsContact O-ND2 3.09Å; P341-I393 HydrophobicContact CB-CD1 4.07Å; P341-I393 HydrophobicContact CB-CG2 3.89Å; P341-I393 VanDerWaalsContact O-CD1 3.25Å; P341-I393 WeakPolarHBondContact O-CD1 3.44Å
342	P	94.4	Very high	97.4	Very high	51 Å²	51	41.6 Å²	41.6	33%	0.331	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-64.1	129.3	177.7	-23.7	34.9	0	0	0	112.9	P365 N372	P342-P365 HydrophobicContact CB-CG 4.05Å; P342-P365 HydrophobicContact CG-CG 3.86Å; P342-N372 WeakPolarHBondContact CA-OD1 3.43Å
343	V	95	Very high	97.3	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.012	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-68.7	144.6	170.7	-157.6	0	0	0	0	109.2	S338 P341 T347 V360 G363 N372 A374 V391 I393	S338-V343 WeakPolarHBondContact OG-CG2 3.14Å; P341-V343 PolarHBondContact O-N 3.15Å; V343-T347 HydrophobicContact CG1-CG2 4.04Å; V343-V360 HydrophobicContact CG1-CB 4.36Å; V343-V360 HydrophobicContact CG1-CG1 4.03Å; V343-V360 HydrophobicContact CG1-CG2 3.74Å; V343-G363 CarbonylContact O-C 3.58Å; V343-G363 WeakPolarHBondContact O-CA 3.34Å; V343-G363 VanDerWaalsContact O-O 3.1Å; V343-N372 HydrophobicContact CG2-CB 4.21Å; V343-A374 HydrophobicContact CB-CB 4.1Å; V343-A374 HydrophobicContact CG1-CB 4.18Å; V343-V391 HydrophobicContact CG1-CB 4.33Å; V343-V391 HydrophobicContact CG1-CG1 4.26Å; V343-V391 HydrophobicContact CG1-CG2 4.31Å; V343-V391 HydrophobicContact CG2-CG2 4.14Å; V343-I393 HydrophobicContact CG2-CD1 4.2Å
344	R	95.4	Very high	97.2	Very high	132 Å²	132	45.4 Å²	45.4	50%	0.498	27%	0.267	S	S	.	.			trans	-130.8	162.9	-179.5	-62.9	-59.8	-177	-166.6	8.2	111.5	T347 V360 G363	R344-T347 PolarHBondContact N-OG1 3.43Å; R344-T347 WeakPolarHBondContact O-CB 3.38Å; R344-T347 PolarHBondContact O-N 2.9Å; R344-T347 VanDerWaalsContact O-N 3.16Å; R344-T347 PolarHBondContact O-OG1 3.34Å; R344-V360 WeakPolarHBondContact O-CB 3.48Å; R344-V360 WeakPolarHBondContact O-CG1 3.27Å; R344-G363 PolarHBondContact NH1-O 3.4Å
345	Q	96.7	Very high	97.1	Very high	71 Å²	71	51.5 Å²	51.5	33%	0.332	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	145.7	167.6	-175.1	172.7	8.7	0	0	110.9	N288 T347 V360 T361	N288-Q345 VanDerWaalsContact CG-NE2 3.3Å; N288-Q345 PolarHBondContact ND2-NE2 3.36Å; N288-Q345 PolarHBondContact ND2-OE1 3.4Å; N288-Q345 PolarHBondContact OD1-NE2 2.84Å; Q345-T347 PolarHBondContact O-N 3.49Å; Q345-V360 CarbonylContact C-O 3.55Å; Q345-V360 WeakPolarHBondContact CA-O 3.33Å; Q345-T361 VanDerWaalsContact CG-O 3.23Å; Q345-T361 WeakPolarHBondContact CG-O 3.47Å
346	H	97.6	Very high	97.1	Very high	128 Å²	128	56.4 Å²	56.4	59%	0.593	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	18.2	-172.7	-48.3	-55.2	0	0	0	115.5	P348 E359 V360	H346-P348 WeakPolarHBondContact O-CD 3.19Å; H346-E359 WeakPolarHBondContact CA-OE1 3.39Å; H346-E359 IonicContact CE1-OE1 3Å; H346-E359 IonicContact CG-OE1 3.67Å; H346-E359 IonicContact ND1-OE1 3.49Å; H346-E359 PolarHBondContact ND1-OE1 2.97Å; H346-V360 PolarHBondContact N-O 3.11Å
347	T	98.2	Very high	97.1	Very high	13 Å²	13	56.7 Å²	56.7	8%	0.08	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-76.7	124.6	168.5	-58.1	0	0	0	0	109.3	V343 R344 Q345 V360 V391 E392 I393	V343-T347 HydrophobicContact CG1-CG2 4.04Å; R344-T347 PolarHBondContact N-OG1 3.43Å; R344-T347 WeakPolarHBondContact O-CB 3.38Å; R344-T347 PolarHBondContact O-N 2.9Å; R344-T347 VanDerWaalsContact O-N 3.16Å; R344-T347 PolarHBondContact O-OG1 3.34Å; Q345-T347 PolarHBondContact O-N 3.49Å; T347-V360 WeakPolarHBondContact O-CB 3.44Å; T347-V360 WeakPolarHBondContact O-CG2 3.36Å; T347-V360 PolarHBondContact O-N 3.22Å; T347-V391 HydrophobicContact CG2-CB 3.87Å; T347-E392 WeakPolarHBondContact CG2-O 3.46Å; T347-I393 HydrophobicContact CG2-CG1 4.23Å
348	P	98.5	Very high	97.1	Very high	41 Å²	41	56.4 Å²	56.4	27%	0.266	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	137.7	174.1	-23.1	34.1	0	0	0	111.8	H346 L350 V391 E392	H346-P348 WeakPolarHBondContact O-CD 3.19Å; P348-L350 HydrophobicContact CB-CD2 4.13Å; P348-V391 WeakPolarHBondContact O-CA 3.36Å; P348-E392 HydrophobicContact CB-CB 4.41Å; P348-E392 HydrophobicContact CG-CB 4.45Å; P348-E392 PolarHBondContact O-N 2.84Å; P348-E392 VanDerWaalsContact O-N 3.08Å
349	I	98.7	Very high	97.1	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	126.4	171	-52.2	168	0	0	0	107.6	L336 I357 G358 V360 V378 V389 Q390 V391	L336-I349 HydrophobicContact CD1-CD1 3.79Å; L336-I349 HydrophobicContact CD1-CG1 4.1Å; I349-I357 HydrophobicContact CG2-CD1 4.33Å; I349-I357 HydrophobicContact CG2-CG1 4.19Å; I349-I357 WeakPolarHBondContact O-CG1 3.16Å; I349-I357 PolarHBondContact O-N 3.06Å; I349-G358 PolarHBondContact N-O 3.35Å; I349-G358 PolarHBondContact O-N 3.45Å; I349-V360 HydrophobicContact CD1-CG2 4.05Å; I349-V360 HydrophobicContact CG1-CG2 3.75Å; I349-V378 HydrophobicContact CB-CG1 4.29Å; I349-V378 HydrophobicContact CD1-CG1 3.63Å; I349-V378 HydrophobicContact CG2-CG1 3.81Å; I349-V389 HydrophobicContact CG2-CB 4.16Å; I349-V389 HydrophobicContact CG2-CG2 4.29Å; I349-Q390 CarbonylContact C-O 3.44Å; I349-Q390 WeakPolarHBondContact CA-O 3.41Å; I349-V391 HydrophobicContact CG1-CG1 4.41Å
350	L	98.6	Very high	97.2	Very high	9 Å²	9	56 Å²	56	5%	0.047	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	151.1	-178	-38.6	176.8	0	0	0	111.8	P348 Q355 V356 Q390 E392	P348-L350 HydrophobicContact CB-CD2 4.13Å; L350-Q355 CarbonylContact C-O 3.5Å; L350-Q355 WeakPolarHBondContact CA-O 3.21Å; L350-V356 HydrophobicContact CD2-CB 4.24Å; L350-V356 HydrophobicContact CD2-CG2 3.62Å; L350-Q390 HydrophobicContact CB-CB 4.17Å; L350-Q390 PolarHBondContact N-O 2.79Å; L350-Q390 PolarHBondContact O-N 3.02Å; L350-E392 HydrophobicContact CD1-CB 4.43Å
351	S	98.1	Very high	97.4	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.007	30%	0.295	C	S	.	.			trans	-65	167.2	166	76.6	0	0	0	0	110.7	D353 G354 Q355 Q390	S351-D353 PolarHBondContact O-N 3.19Å; S351-D353 VanDerWaalsContact O-N 3.14Å; S351-D353 PolarHBondContact OG-N 3.02Å; S351-G354 PolarHBondContact O-N 3.44Å; S351-G354 PolarHBondContact OG-N 3.3Å; S351-Q355 PolarHBondContact N-O 3.13Å; S351-Q355 PolarHBondContact OG-N 2.73Å; S351-Q390 PolarHBondContact O-OE1 3.26Å
352	P	96.3	Very high	97.5	Very high	65 Å²	65	50.6 Å²	50.6	42%	0.422	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-30.4	169.5	-28.8	37.8	0	0	0	113.9	G354 A388 Q390	P352-G354 VanDerWaalsContact C-N 3.32Å; P352-A388 WeakPolarHBondContact CG-O 3.37Å; P352-Q390 PolarHBondContact O-NE2 2.95Å
353	D	95.9	Very high	97.7	Very high	136 Å²	136	48.6 Å²	48.6	73%	0.727	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	2.5	-179	-42.4	-50.8	0	0	0	113.2	S351	S351-D353 PolarHBondContact O-N 3.19Å; S351-D353 VanDerWaalsContact O-N 3.14Å; S351-D353 PolarHBondContact OG-N 3.02Å
354	G	96.1	Very high	97.8	Very high	40 Å²	40	49.1 Å²	49.1	41%	0.412	27%	0.267	S	S	.	.	S	Bend	trans	85	8.2	176.3	0	0	0	0	0	116	S351 P352	S351-G354 PolarHBondContact O-N 3.44Å; S351-G354 PolarHBondContact OG-N 3.3Å; P352-G354 VanDerWaalsContact C-N 3.32Å
355	Q	97.8	Very high	97.9	Very high	134 Å²	134	45.4 Å²	45.4	63%	0.626	26%	0.26	S	S	*	.			trans	-78.4	139.8	174.7	-62	-176.5	2.3	0	0	110.7	L350 S351 I357	L350-Q355 CarbonylContact C-O 3.5Å; L350-Q355 WeakPolarHBondContact CA-O 3.21Å; S351-Q355 PolarHBondContact N-O 3.13Å; S351-Q355 PolarHBondContact OG-N 2.73Å; Q355-I357 PolarHBondContact O-N 3.27Å
356	V	98.4	Very high	98	Very high	104 Å²	104	42.2 Å²	42.2	63%	0.63	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-68.2	123.6	172.9	-176.8	0	0	0	0	109.5	L350	L350-V356 HydrophobicContact CD2-CB 4.24Å; L350-V356 HydrophobicContact CD2-CG2 3.62Å
357	I	98.5	Very high	98	Very high	8 Å²	8	37.2 Å²	37.2	4%	0.041	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	6.7	-177.7	58.2	166.5	0	0	0	112.5	I349 Q355 V378 D379 F382 V389	I349-I357 HydrophobicContact CG2-CD1 4.33Å; I349-I357 HydrophobicContact CG2-CG1 4.19Å; I349-I357 WeakPolarHBondContact O-CG1 3.16Å; I349-I357 PolarHBondContact O-N 3.06Å; Q355-I357 PolarHBondContact O-N 3.27Å; I357-V378 CarbonylContact O-C 3.46Å; I357-V378 VanDerWaalsContact O-CA 3.28Å; I357-V378 WeakPolarHBondContact O-CA 3.4Å; I357-D379 PolarHBondContact O-N 3.31Å; I357-F382 HydrophobicContact CB-CD2 4.15Å; I357-F382 HydrophobicContact CB-CE2 4.29Å; I357-F382 HydrophobicContact CD1-CB 3.79Å; I357-F382 HydrophobicContact CD1-CD1 3.83Å; I357-F382 HydrophobicContact CD1-CD2 3.64Å; I357-F382 HydrophobicContact CD1-CE1 4.34Å; I357-F382 HydrophobicContact CD1-CE2 4.17Å; I357-F382 HydrophobicContact CD1-CG 3.46Å; I357-F382 VanDerWaalsContact CD1-CG 3.46Å; I357-F382 HydrophobicContact CD1-CZ 4.49Å; I357-F382 HydrophobicContact CG1-CD2 4.5Å; I357-F382 HydrophobicContact CG2-CD2 4.03Å; I357-F382 HydrophobicContact CG2-CE2 3.65Å; I357-F382 HydrophobicContact CG2-CZ 4.18Å; I357-V389 HydrophobicContact CD1-CG1 3.98Å
358	G	98.4	Very high	98	Very high	20 Å²	20	38.6 Å²	38.6	21%	0.206	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.8	-180	-170.5	0	0	0	0	0	115	I349 Y377	I349-G358 PolarHBondContact N-O 3.35Å; I349-G358 PolarHBondContact O-N 3.45Å; G358-Y377 CarbonylContact C-O 3.45Å; G358-Y377 WeakPolarHBondContact CA-O 3.48Å
359	E	98.7	Very high	97.9	Very high	90 Å²	90	39.4 Å²	39.4	42%	0.421	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	144.7	179.2	-169.4	177.5	115.9	0	0	111.3	H346 G376 Y377	H346-E359 WeakPolarHBondContact CA-OE1 3.39Å; H346-E359 IonicContact CE1-OE1 3Å; H346-E359 IonicContact CG-OE1 3.67Å; H346-E359 IonicContact ND1-OE1 3.49Å; H346-E359 PolarHBondContact ND1-OE1 2.97Å; E359-G376 CarbonylContact O-C 3.52Å; E359-G376 WeakPolarHBondContact O-CA 3.39Å; E359-Y377 PolarHBondContact N-O 3.46Å; E359-Y377 PolarHBondContact O-N 2.81Å
360	V	98.8	Very high	97.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	127.2	174.6	174	0	0	0	0	111	L336 V343 R344 Q345 H346 T347 I349 S362 A374 M375 V391	L336-V360 HydrophobicContact CD1-CG2 3.97Å; V343-V360 HydrophobicContact CG1-CB 4.36Å; V343-V360 HydrophobicContact CG1-CG1 4.03Å; V343-V360 HydrophobicContact CG1-CG2 3.74Å; R344-V360 WeakPolarHBondContact O-CB 3.48Å; R344-V360 WeakPolarHBondContact O-CG1 3.27Å; Q345-V360 CarbonylContact C-O 3.55Å; Q345-V360 WeakPolarHBondContact CA-O 3.33Å; H346-V360 PolarHBondContact N-O 3.11Å; T347-V360 WeakPolarHBondContact O-CB 3.44Å; T347-V360 WeakPolarHBondContact O-CG2 3.36Å; T347-V360 PolarHBondContact O-N 3.22Å; I349-V360 HydrophobicContact CD1-CG2 4.05Å; I349-V360 HydrophobicContact CG1-CG2 3.75Å; V360-S362 WeakPolarHBondContact CG1-O 3.48Å; V360-A374 HydrophobicContact CG1-CB 3.98Å; V360-M375 CarbonylContact C-O 3.55Å; V360-M375 WeakPolarHBondContact CA-O 3.5Å; V360-M375 WeakPolarHBondContact CG1-O 3.47Å; V360-V391 HydrophobicContact CG2-CG1 4.38Å
361	T	98.8	Very high	97.8	Very high	15 Å²	15	53 Å²	53	9%	0.092	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-31.8	179	51.8	0	0	0	0	113.4	N288 D289 Q345 M375 Y377	N288-T361 PolarHBondContact ND2-O 3.22Å; N288-T361 VanDerWaalsContact ND2-O 3.12Å; N288-T361 WeakPolarHBondContact O-CB 3.33Å; N288-T361 VanDerWaalsContact O-CG2 3.24Å; N288-T361 WeakPolarHBondContact O-CG2 3.47Å; D289-T361 WeakPolarHBondContact OD1-CB 3.18Å; D289-T361 PolarHBondContact OD1-OG1 3.49Å; Q345-T361 VanDerWaalsContact CG-O 3.23Å; Q345-T361 WeakPolarHBondContact CG-O 3.47Å; T361-M375 PolarHBondContact N-O 2.83Å; T361-M375 PolarHBondContact OG1-O 3.21Å; T361-Y377 HydrophobicContact CG2-CD2 3.8Å; T361-Y377 HydrophobicContact CG2-CE2 3.99Å
362	S	98.7	Very high	97.8	Very high	2 Å²	2	53.4 Å²	53.4	1%	0.014	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	144	178.2	-67.1	0	0	0	0	110.2	R278 D289 V360 A374 M375	R278-S362 VanDerWaalsContact NH2-CB 3.33Å; R278-S362 PolarHBondContact NH2-OG 2.9Å; D289-S362 VanDerWaalsContact OD1-CB 3.26Å; D289-S362 WeakPolarHBondContact OD1-CB 3.22Å; D289-S362 PolarHBondContact OD1-OG 2.87Å; D289-S362 PolarHBondContact OD2-OG 3.21Å; D289-S362 VanDerWaalsContact OD2-OG 3.11Å; V360-S362 WeakPolarHBondContact CG1-O 3.48Å; S362-A374 CarbonylContact O-C 3.49Å; S362-A374 WeakPolarHBondContact O-CA 3.47Å; S362-A374 WeakPolarHBondContact O-CB 3.38Å; S362-M375 PolarHBondContact N-O 2.79Å; S362-M375 PolarHBondContact O-N 3.02Å
363	G	98.1	Very high	98	Very high	10 Å²	10	50.3 Å²	50.3	10%	0.103	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	126.4	-179.3	0	0	0	0	0	115.5	V343 R344 V373	V343-G363 CarbonylContact O-C 3.58Å; V343-G363 WeakPolarHBondContact O-CA 3.34Å; V343-G363 VanDerWaalsContact O-O 3.1Å; R344-G363 PolarHBondContact NH1-O 3.4Å; G363-V373 WeakPolarHBondContact CA-O 3.48Å
364	C	97.1	Very high	98.1	Very high	12 Å²	12	43.9 Å²	43.9	8%	0.081	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	164.9	174.2	80	0	0	0	0	113	L279 V373	L279-C364 HydrophobicContact CD2-CB 4.45Å; C364-V373 PolarHBondContact N-O 2.86Å; C364-V373 WeakPolarHBondContact O-CG2 3.33Å; C364-V373 PolarHBondContact O-N 3.21Å
365	P	98	Very high	98.2	Very high	55 Å²	55	42 Å²	42	36%	0.357	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	136.5	162.6	-19	33.1	0	0	0	110.5	P342 P367	P342-P365 HydrophobicContact CB-CG 4.05Å; P342-P365 HydrophobicContact CG-CG 3.86Å; P365-P367 WeakPolarHBondContact O-CD 3.49Å
366	S	98.3	Very high	98.3	Very high	4 Å²	4	35.6 Å²	35.6	3%	0.028	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	115.9	170.9	158.8	0	0	0	0	109.4	E280 L369 K370 K371	E280-S366 WeakPolarHBondContact OE1-CA 3.09Å; E280-S366 WeakPolarHBondContact OE1-CB 3.5Å; E280-S366 PolarHBondContact OE1-OG 3.33Å; S366-L369 VanDerWaalsContact OG-CB 3.23Å; S366-L369 WeakPolarHBondContact OG-CB 3.46Å; S366-L369 WeakPolarHBondContact OG-CG 3.38Å; S366-L369 PolarHBondContact OG-N 3.27Å; S366-K370 PolarHBondContact O-N 2.92Å; S366-K370 VanDerWaalsContact O-N 3.08Å; S366-K371 WeakPolarHBondContact CB-O 3.14Å; S366-K371 PolarHBondContact N-O 3.23Å
367	P	97.5	Very high	98.3	Very high	22 Å²	22	31.3 Å²	31.3	14%	0.143	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-44.6	172.6	-27.6	39.5	0	0	0	112.6	I79 H82 M83 E280 P365	I79-P367 HydrophobicContact CG2-CB 4.08Å; I79-P367 HydrophobicContact CG2-CG 4.19Å; H82-P367 HydrophobicContact CB-CG 4.04Å; M83-P367 HydrophobicContact CG-CB 4.14Å; M83-P367 HydrophobicContact SD-CB 3.7Å; E280-P367 WeakPolarHBondContact OE1-CD 3.49Å; P365-P367 WeakPolarHBondContact O-CD 3.49Å
368	C	98	Very high	98.3	Very high	42 Å²	42	31 Å²	31	28%	0.284	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-42.7	-177	-68.2	0	0	0	0	112.9	E280 V408	E280-C368 PolarHBondContact OE1-N 3.32Å; C368-V408 HydrophobicContact CB-CG2 3.85Å
369	L	97.9	Very high	98.3	Very high	59 Å²	59	33.5 Å²	33.5	31%	0.309	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-10.7	-173.2	-55.8	177	0	0	0	113.8	L337 S366 K371 V373 F407 V408	L337-L369 HydrophobicContact CD2-CD1 4.16Å; S366-L369 VanDerWaalsContact OG-CB 3.23Å; S366-L369 WeakPolarHBondContact OG-CB 3.46Å; S366-L369 WeakPolarHBondContact OG-CG 3.38Å; S366-L369 PolarHBondContact OG-N 3.27Å; L369-K371 HydrophobicContact CB-CB 4.34Å; L369-K371 WeakPolarHBondContact O-CG 3.41Å; L369-K371 PolarHBondContact O-N 2.77Å; L369-V373 HydrophobicContact CD1-CG1 4.07Å; L369-F407 HydrophobicContact CD1-CB 3.81Å; L369-V408 HydrophobicContact CD1-CG2 4.3Å; L369-V408 HydrophobicContact CD2-CG2 4.09Å; L369-V408 HydrophobicContact CG-CG2 4.02Å
370	K	97.3	Very high	98.2	Very high	193 Å²	193	31.6 Å²	31.6	84%	0.839	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.6	36.3	-174.2	-57.2	177.4	-177	174.6	0	112.4	S366	S366-K370 PolarHBondContact O-N 2.92Å; S366-K370 VanDerWaalsContact O-N 3.08Å
371	K	97.9	Very high	98.1	Very high	100 Å²	100	36 Å²	36	44%	0.435	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	173.8	-178.5	-72.4	176.2	-175.2	178	0	109.3	L337 T339 S366 L369	L337-K371 HydrophobicContact CD2-CB 4.49Å; T339-K371 HydrophobicContact CG2-CG 4.37Å; S366-K371 WeakPolarHBondContact CB-O 3.14Å; S366-K371 PolarHBondContact N-O 3.23Å; L369-K371 HydrophobicContact CB-CB 4.34Å; L369-K371 WeakPolarHBondContact O-CG 3.41Å; L369-K371 PolarHBondContact O-N 2.77Å
372	N	98.3	Very high	98.1	Very high	10 Å²	10	38 Å²	38	5%	0.053	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	134.1	167	-56.8	-53.7	0	0	0	109.4	L337 S338 G340 P341 P342 V343	L337-N372 WeakPolarHBondContact CA-O 3.39Å; S338-N372 PolarHBondContact N-O 3.49Å; S338-N372 VanDerWaalsContact N-O 3.12Å; S338-N372 PolarHBondContact O-N 3.12Å; G340-N372 PolarHBondContact O-ND2 2.92Å; P341-N372 PolarHBondContact O-ND2 3.28Å; P341-N372 VanDerWaalsContact O-ND2 3.09Å; P342-N372 WeakPolarHBondContact CA-OD1 3.43Å; V343-N372 HydrophobicContact CG2-CB 4.21Å
373	V	98.8	Very high	98	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	142.8	171.5	-71.9	0	0	0	0	109.1	L279 E280 L337 G363 C364 L369 F407	L279-V373 HydrophobicContact CD2-CG2 3.98Å; L279-V373 HydrophobicContact CG-CG2 3.94Å; E280-V373 HydrophobicContact CG-CG2 4.4Å; L337-V373 HydrophobicContact CD2-CG1 3.67Å; G363-V373 WeakPolarHBondContact CA-O 3.48Å; C364-V373 PolarHBondContact N-O 2.86Å; C364-V373 WeakPolarHBondContact O-CG2 3.33Å; C364-V373 PolarHBondContact O-N 3.21Å; L369-V373 HydrophobicContact CD1-CG1 4.07Å; V373-F407 HydrophobicContact CB-CD1 4.47Å; V373-F407 HydrophobicContact CB-CD2 4.37Å; V373-F407 HydrophobicContact CB-CE1 4.38Å; V373-F407 HydrophobicContact CB-CE2 4.29Å; V373-F407 HydrophobicContact CB-CG 4.45Å; V373-F407 HydrophobicContact CB-CZ 4.29Å; V373-F407 HydrophobicContact CG1-CB 4.14Å; V373-F407 HydrophobicContact CG1-CD1 3.85Å; V373-F407 HydrophobicContact CG1-CD2 4.2Å; V373-F407 HydrophobicContact CG1-CE1 4.2Å; V373-F407 HydrophobicContact CG1-CG 3.83Å
374	A	98.8	Very high	98	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	153.9	175.8	0	0	0	0	0	111.6	G335 L336 V343 V360 S362 F407	G335-A374 CarbonylContact C-O 3.54Å; G335-A374 WeakPolarHBondContact CA-O 3.21Å; L336-A374 HydrophobicContact CB-CB 4.22Å; L336-A374 PolarHBondContact N-O 3.31Å; L336-A374 PolarHBondContact O-N 3.21Å; V343-A374 HydrophobicContact CB-CB 4.1Å; V343-A374 HydrophobicContact CG1-CB 4.18Å; V360-A374 HydrophobicContact CG1-CB 3.98Å; S362-A374 CarbonylContact O-C 3.49Å; S362-A374 WeakPolarHBondContact O-CA 3.47Å; S362-A374 WeakPolarHBondContact O-CB 3.38Å; A374-F407 WeakPolarHBondContact O-CZ 3.35Å
375	M	98.9	Very high	98.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	153.1	163.4	-69.7	-170.4	-151.3	0	0	109.8	L279 L283 D289 R333 V334 V360 T361 S362 M405	L279-M375 HydrophobicContact CD1-CB 4.4Å; L279-M375 HydrophobicContact CD1-CE 3.64Å; L279-M375 HydrophobicContact CD1-CG 3.67Å; L279-M375 HydrophobicContact CD1-SD 4.36Å; L283-M375 WeakPolarHBondContact O-CE 3.37Å; D289-M375 HydrophobicContact CB-SD 4.4Å; R333-M375 PolarHBondContact NH1-SD 3.48Å; V334-M375 WeakPolarHBondContact O-CA 3.43Å; V360-M375 CarbonylContact C-O 3.55Å; V360-M375 WeakPolarHBondContact CA-O 3.5Å; V360-M375 WeakPolarHBondContact CG1-O 3.47Å; T361-M375 PolarHBondContact N-O 2.83Å; T361-M375 PolarHBondContact OG1-O 3.21Å; S362-M375 PolarHBondContact N-O 2.79Å; S362-M375 PolarHBondContact O-N 3.02Å; M375-M405 HydrophobicContact CE-SD 3.89Å; M375-M405 HydrophobicContact CG-SD 3.75Å; M375-M405 HydrophobicContact SD-SD 3.93Å
376	G	98.8	Very high	98.1	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.3	170.6	171	0	0	0	0	0	111.5	R333 V334 E359	R333-G376 CarbonylContact C-O 3.59Å; R333-G376 WeakPolarHBondContact CA-O 3.39Å; V334-G376 PolarHBondContact N-O 2.99Å; V334-G376 PolarHBondContact O-N 3.21Å; V334-G376 VanDerWaalsContact O-N 3.16Å; E359-G376 CarbonylContact O-C 3.52Å; E359-G376 WeakPolarHBondContact O-CA 3.39Å
377	Y	98.9	Very high	98.1	Very high	15 Å²	15	51.1 Å²	51.1	6%	0.059	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	132.5	170.5	-73	-95.3	0	0	0	109.2	D289 T294 E298 A299 R331 K332 R333 G358 E359 T361	D289-Y377 VanDerWaalsContact O-CE2 3.22Å; D289-Y377 WeakPolarHBondContact O-CE2 3.4Å; D289-Y377 PolarHBondContact O-OH 2.87Å; T294-Y377 HydrophobicContact CG2-CE1 4.34Å; T294-Y377 HydrophobicContact CG2-CE2 4.1Å; E298-Y377 HydrophobicContact CB-CE1 3.96Å; A299-Y377 WeakPolarHBondContact CA-OH 3.5Å; R331-Y377 HydrophobicContact CG-CD1 4.13Å; K332-Y377 WeakPolarHBondContact O-CA 3.49Å; R333-Y377 HydrophobicContact CB-CD1 4.18Å; R333-Y377 HydrophobicContact CB-CE1 3.73Å; R333-Y377 HydrophobicContact CB-CE2 4.28Å; R333-Y377 HydrophobicContact CG-CE2 4.44Å; G358-Y377 CarbonylContact C-O 3.45Å; G358-Y377 WeakPolarHBondContact CA-O 3.48Å; E359-Y377 PolarHBondContact N-O 3.46Å; E359-Y377 PolarHBondContact O-N 2.81Å; T361-Y377 HydrophobicContact CG2-CD2 3.8Å; T361-Y377 HydrophobicContact CG2-CE2 3.99Å
378	V	98.8	Very high	98.1	Very high	1 Å²	1	53 Å²	53	1%	0.006	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	155.5	169.9	-60.2	0	0	0	0	110.5	R331 K332 V334 I349 I357 F382 A383	R331-V378 CarbonylContact C-O 3.59Å; R331-V378 VanDerWaalsContact CA-O 3.28Å; R331-V378 WeakPolarHBondContact CA-O 3.26Å; K332-V378 PolarHBondContact N-O 2.87Å; K332-V378 PolarHBondContact O-N 3.4Å; K332-V378 VanDerWaalsContact O-N 3.07Å; V334-V378 HydrophobicContact CG1-CG2 3.97Å; V334-V378 HydrophobicContact CG2-CG1 4.02Å; V334-V378 HydrophobicContact CG2-CG2 3.76Å; I349-V378 HydrophobicContact CB-CG1 4.29Å; I349-V378 HydrophobicContact CD1-CG1 3.63Å; I349-V378 HydrophobicContact CG2-CG1 3.81Å; I357-V378 CarbonylContact O-C 3.46Å; I357-V378 VanDerWaalsContact O-CA 3.28Å; I357-V378 WeakPolarHBondContact O-CA 3.4Å; V378-F382 HydrophobicContact CG2-CB 4.37Å; V378-A383 HydrophobicContact CG2-CB 3.86Å
379	D	98.3	Very high	98.1	Very high	73 Å²	73	51.1 Å²	51.1	39%	0.39	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.3	138.7	167.2	-69.2	-31.4	0	0	0	110.8	I357 A381 F382 A383	I357-D379 PolarHBondContact O-N 3.31Å; D379-A381 PolarHBondContact O-N 3.35Å; D379-F382 HydrophobicContact CB-CD2 4.16Å; D379-F382 PolarHBondContact O-N 2.91Å; D379-A383 PolarHBondContact O-N 3.3Å
380	A	96.1	Very high	98.1	Very high	49 Å²	49	50.3 Å²	50.3	41%	0.405	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-22	-168.9	0	0	0	0	0	114.1	T329 A330 F382 A383	T329-A380 VanDerWaalsContact O-CB 3.26Å; T329-A380 WeakPolarHBondContact O-CB 3.33Å; A330-A380 WeakPolarHBondContact O-CB 3.35Å; A330-A380 PolarHBondContact O-N 3.46Å; A380-F382 VanDerWaalsContact C-N 3.27Å; A380-F382 PolarHBondContact O-N 2.7Å; A380-A383 PolarHBondContact O-N 3.06Å
381	A	96.8	Very high	98.2	Very high	93 Å²	93	41.1 Å²	41.1	77%	0.769	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-32.9	172	0	0	0	0	0	113	D379	D379-A381 PolarHBondContact O-N 3.35Å
382	F	98.1	Very high	98.1	Very high	56 Å²	56	40 Å²	40	25%	0.246	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-7.8	-179.3	-60	-86	0	0	0	113	I357 V378 D379 A380 K384 A387 V389	I357-F382 HydrophobicContact CB-CD2 4.15Å; I357-F382 HydrophobicContact CB-CE2 4.29Å; I357-F382 HydrophobicContact CD1-CB 3.79Å; I357-F382 HydrophobicContact CD1-CD1 3.83Å; I357-F382 HydrophobicContact CD1-CD2 3.64Å; I357-F382 HydrophobicContact CD1-CE1 4.34Å; I357-F382 HydrophobicContact CD1-CE2 4.17Å; I357-F382 HydrophobicContact CD1-CG 3.46Å; I357-F382 VanDerWaalsContact CD1-CG 3.46Å; I357-F382 HydrophobicContact CD1-CZ 4.49Å; I357-F382 HydrophobicContact CG1-CD2 4.5Å; I357-F382 HydrophobicContact CG2-CD2 4.03Å; I357-F382 HydrophobicContact CG2-CE2 3.65Å; I357-F382 HydrophobicContact CG2-CZ 4.18Å; V378-F382 HydrophobicContact CG2-CB 4.37Å; D379-F382 HydrophobicContact CB-CD2 4.16Å; D379-F382 PolarHBondContact O-N 2.91Å; A380-F382 VanDerWaalsContact C-N 3.27Å; A380-F382 PolarHBondContact O-N 2.7Å; F382-K384 PolarHBondContact O-N 3.35Å; F382-A387 WeakPolarHBondContact O-CB 3.34Å; F382-V389 HydrophobicContact CB-CG1 4.41Å
383	A	97.7	Very high	98	Very high	14 Å²	14	40.4 Å²	40.4	12%	0.116	25%	0.249	C	C	.	.			trans	-73.9	13.9	-172.6	0	0	0	0	0	116.1	K332 V334 V378 D379 A380	K332-A383 HydrophobicContact CB-CB 3.95Å; K332-A383 HydrophobicContact CD-CB 4.13Å; K332-A383 HydrophobicContact CG-CB 4.46Å; V334-A383 HydrophobicContact CG1-CB 3.81Å; V378-A383 HydrophobicContact CG2-CB 3.86Å; D379-A383 PolarHBondContact O-N 3.3Å; A380-A383 PolarHBondContact O-N 3.06Å
384	K	97.7	Very high	97.6	Very high	166 Å²	166	51.6 Å²	51.6	72%	0.722	29%	0.291	S	S	*	.	S	Bend	trans	-87.3	131.4	179.9	-172.7	-174.4	176.1	-174.8	0	110.3	F382 G386 A387 V402	F382-K384 PolarHBondContact O-N 3.35Å; K384-G386 PolarHBondContact O-N 3.36Å; K384-A387 WeakPolarHBondContact O-CB 3.27Å; K384-A387 PolarHBondContact O-N 3.47Å; K384-V402 WeakPolarHBondContact O-CB 3.35Å; K384-V402 WeakPolarHBondContact O-CG1 3.36Å
385	N	98.3	Very high	97.1	Very high	92 Å²	92	60.4 Å²	60.4	49%	0.492	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	131.7	171.3	-63.1	-18.6	0	0	0	111
386	G	98.3	Very high	96.9	Very high	62 Å²	62	67.9 Å²	67.9	64%	0.639	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	87	-3.6	-174	0	0	0	0	0	115	K384 A388 V402	K384-G386 PolarHBondContact O-N 3.36Å; G386-A388 PolarHBondContact O-N 2.84Å; G386-V402 PolarHBondContact N-O 3.45Å
387	A	98.3	Very high	96.8	Very high	25 Å²	25	71.7 Å²	71.7	21%	0.207	39%	0.385	C	S	.	.			trans	-64.5	133.3	173.3	0	0	0	0	0	110.9	F382 K384 I401 V402	F382-A387 WeakPolarHBondContact O-CB 3.34Å; K384-A387 WeakPolarHBondContact O-CB 3.27Å; K384-A387 PolarHBondContact O-N 3.47Å; A387-I401 WeakPolarHBondContact O-CA 3.36Å; A387-V402 HydrophobicContact CB-CB 4.22Å; A387-V402 HydrophobicContact CB-CG2 4.13Å; A387-V402 PolarHBondContact O-N 3.47Å
388	A	98.3	Very high	96.7	Very high	61 Å²	61	71.8 Å²	71.8	50%	0.504	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	130.4	172.1	0	0	0	0	0	109.7	P352 G386	P352-A388 WeakPolarHBondContact CG-O 3.37Å; G386-A388 PolarHBondContact O-N 2.84Å
389	V	98.6	Very high	96.7	Very high	4 Å²	4	76.5 Å²	76.5	2%	0.024	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	177.4	175.5	-64.9	0	0	0	0	108.7	L336 I349 I357 F382 A400 V402	L336-V389 HydrophobicContact CD2-CG2 3.92Å; I349-V389 HydrophobicContact CG2-CB 4.16Å; I349-V389 HydrophobicContact CG2-CG2 4.29Å; I357-V389 HydrophobicContact CD1-CG1 3.98Å; F382-V389 HydrophobicContact CB-CG1 4.41Å; V389-A400 CarbonylContact C-O 3.55Å; V389-A400 HydrophobicContact CG2-CB 4.06Å; V389-A400 PolarHBondContact N-O 3.01Å; V389-A400 CarbonylContact O-C 3.56Å; V389-A400 PolarHBondContact O-N 2.86Å; V389-V402 HydrophobicContact CG1-CG2 4.08Å; V389-V402 HydrophobicContact CG2-CG2 4.18Å
390	Q	98.4	Very high	96.7	Very high	42 Å²	42	73.3 Å²	73.3	20%	0.196	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	159	175.5	-59.7	161.6	11.4	0	0	109	I349 L350 S351 P352 T397 V398	I349-Q390 CarbonylContact C-O 3.44Å; I349-Q390 WeakPolarHBondContact CA-O 3.41Å; L350-Q390 HydrophobicContact CB-CB 4.17Å; L350-Q390 PolarHBondContact N-O 2.79Å; L350-Q390 PolarHBondContact O-N 3.02Å; S351-Q390 PolarHBondContact O-OE1 3.26Å; P352-Q390 PolarHBondContact O-NE2 2.95Å; Q390-T397 HydrophobicContact CB-CG2 3.65Å; Q390-T397 VanDerWaalsContact CD-CG2 3.44Å; Q390-T397 HydrophobicContact CG-CG2 3.74Å; Q390-V398 CarbonylContact C-O 3.55Å; Q390-V398 WeakPolarHBondContact CA-O 3.46Å
391	V	98	Very high	96.8	Very high	0 Å²	0	75.1 Å²	75.1	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	136	172.3	-68.7	0	0	0	0	110.1	L336 V343 T347 P348 I349 V360 I393 V398 A400	L336-V391 HydrophobicContact CD1-CG1 4.26Å; V343-V391 HydrophobicContact CG1-CB 4.33Å; V343-V391 HydrophobicContact CG1-CG1 4.26Å; V343-V391 HydrophobicContact CG1-CG2 4.31Å; V343-V391 HydrophobicContact CG2-CG2 4.14Å; T347-V391 HydrophobicContact CG2-CB 3.87Å; P348-V391 WeakPolarHBondContact O-CA 3.36Å; I349-V391 HydrophobicContact CG1-CG1 4.41Å; V360-V391 HydrophobicContact CG2-CG1 4.38Å; V391-I393 HydrophobicContact CG2-CD1 4.05Å; V391-I393 HydrophobicContact CG2-CG1 4.14Å; V391-I393 PolarHBondContact O-N 3.17Å; V391-V398 HydrophobicContact CG2-CB 4.08Å; V391-V398 PolarHBondContact N-O 2.89Å; V391-V398 PolarHBondContact O-N 2.91Å; V391-A400 HydrophobicContact CG1-CB 4.3Å; V391-A400 HydrophobicContact CG2-CB 4.42Å
392	E	96.6	Very high	96.9	Very high	76 Å²	76	70.8 Å²	70.8	36%	0.355	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	94.1	-177.4	-163.9	-164.6	98.5	0	0	112	T347 P348 L350	T347-E392 WeakPolarHBondContact CG2-O 3.46Å; P348-E392 HydrophobicContact CB-CB 4.41Å; P348-E392 HydrophobicContact CG-CB 4.45Å; P348-E392 PolarHBondContact O-N 2.84Å; P348-E392 VanDerWaalsContact O-N 3.08Å; L350-E392 HydrophobicContact CD1-CB 4.43Å
393	I	94.8	Very high	96.9	Very high	18 Å²	18	69.2 Å²	69.2	9%	0.092	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	110.7	-179.8	-53.4	178.5	0	0	0	109.4	P341 V343 T347 V391 K395 K396 V398	P341-I393 HydrophobicContact CB-CD1 4.07Å; P341-I393 HydrophobicContact CB-CG2 3.89Å; P341-I393 VanDerWaalsContact O-CD1 3.25Å; P341-I393 WeakPolarHBondContact O-CD1 3.44Å; V343-I393 HydrophobicContact CG2-CD1 4.2Å; T347-I393 HydrophobicContact CG2-CG1 4.23Å; V391-I393 HydrophobicContact CG2-CD1 4.05Å; V391-I393 HydrophobicContact CG2-CG1 4.14Å; V391-I393 PolarHBondContact O-N 3.17Å; I393-K395 PolarHBondContact O-N 3.4Å; I393-K396 PolarHBondContact N-O 3.15Å; I393-K396 WeakPolarHBondContact O-CB 3.5Å; I393-K396 PolarHBondContact O-N 3.3Å; I393-V398 HydrophobicContact CB-CG2 4.33Å; I393-V398 HydrophobicContact CD1-CB 4.32Å; I393-V398 HydrophobicContact CD1-CG2 4.1Å; I393-V398 HydrophobicContact CG1-CG2 4.33Å
394	R	90.4	Very high	97	Very high	236 Å²	236	75.3 Å²	75.3	89%	0.891	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	48.2	179.5	-56.9	175.6	177	178.9	-2.4	112.5	K396	R394-K396 PolarHBondContact O-N 2.85Å
395	K	89.9	Confident	97	Very high	186 Å²	186	69.4 Å²	69.4	81%	0.809	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	22	-175.1	-49.9	-174.6	180	-172.5	0	114.6	I393	I393-K395 PolarHBondContact O-N 3.4Å
396	K	94.1	Very high	97	Very high	156 Å²	156	67.2 Å²	67.2	68%	0.678	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.6	124.9	171.6	-65.5	-169.7	177.3	-171.6	0	110	I393 R394 V398	I393-K396 PolarHBondContact N-O 3.15Å; I393-K396 WeakPolarHBondContact O-CB 3.5Å; I393-K396 PolarHBondContact O-N 3.3Å; R394-K396 PolarHBondContact O-N 2.85Å; K396-V398 PolarHBondContact O-N 3.47Å
397	T	96.4	Very high	97	Very high	80 Å²	80	65.3 Å²	65.3	49%	0.491	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	122.9	170.5	-51.4	0	0	0	0	110.5	Q390	Q390-T397 HydrophobicContact CB-CG2 3.65Å; Q390-T397 VanDerWaalsContact CD-CG2 3.44Å; Q390-T397 HydrophobicContact CG-CG2 3.74Å
398	V	97.8	Very high	97.1	Very high	18 Å²	18	65 Å²	65	11%	0.109	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	126.7	173	178.4	0	0	0	0	108.6	Q390 V391 I393 K396	Q390-V398 CarbonylContact C-O 3.55Å; Q390-V398 WeakPolarHBondContact CA-O 3.46Å; V391-V398 HydrophobicContact CG2-CB 4.08Å; V391-V398 PolarHBondContact N-O 2.89Å; V391-V398 PolarHBondContact O-N 2.91Å; I393-V398 HydrophobicContact CB-CG2 4.33Å; I393-V398 HydrophobicContact CD1-CB 4.32Å; I393-V398 HydrophobicContact CD1-CG2 4.1Å; I393-V398 HydrophobicContact CG1-CG2 4.33Å; K396-V398 PolarHBondContact O-N 3.47Å
399	P	98.1	Very high	97.1	Very high	100 Å²	100	67 Å²	67	65%	0.649	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.3	138.8	175.6	-24.4	34.6	0	0	0	112.4
400	A	98.5	Very high	97.1	Very high	6 Å²	6	69.3 Å²	69.3	5%	0.05	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	162.8	175	0	0	0	0	0	110.4	L337 V389 V391	L337-A400 CarbonylContact O-C 3.26Å; L337-A400 VanDerWaalsContact O-CA 3.3Å; L337-A400 WeakPolarHBondContact O-CA 3.41Å; V389-A400 CarbonylContact C-O 3.55Å; V389-A400 HydrophobicContact CG2-CB 4.06Å; V389-A400 PolarHBondContact N-O 3.01Å; V389-A400 CarbonylContact O-C 3.56Å; V389-A400 PolarHBondContact O-N 2.86Å; V391-A400 HydrophobicContact CG1-CB 4.3Å; V391-A400 HydrophobicContact CG2-CB 4.42Å
401	I	98.6	Very high	97.1	Very high	86 Å²	86	71.7 Å²	71.7	44%	0.441	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	141.1	174.5	59	175.7	0	0	0	110.4	L336 L337 A387 S403	L336-I401 WeakPolarHBondContact CA-O 3.22Å; L337-I401 HydrophobicContact CB-CD1 4.42Å; L337-I401 HydrophobicContact CB-CG1 3.9Å; L337-I401 PolarHBondContact N-O 3.09Å; L337-I401 PolarHBondContact O-N 2.65Å; A387-I401 WeakPolarHBondContact O-CA 3.36Å; I401-S403 PolarHBondContact O-N 2.99Å
402	V	98.8	Very high	97.1	Very high	2 Å²	2	74.4 Å²	74.4	1%	0.012	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	119.5	170.1	177	0	0	0	0	108.7	V334 G335 L336 K384 G386 A387 V389	V334-V402 HydrophobicContact CB-CG1 3.94Å; V334-V402 HydrophobicContact CG1-CG1 4.08Å; V334-V402 HydrophobicContact CG2-CG1 4.35Å; G335-V402 CarbonylContact O-C 3.36Å; G335-V402 WeakPolarHBondContact O-CA 3.41Å; L336-V402 HydrophobicContact CD2-CG2 4.01Å; K384-V402 WeakPolarHBondContact O-CB 3.35Å; K384-V402 WeakPolarHBondContact O-CG1 3.36Å; G386-V402 PolarHBondContact N-O 3.45Å; A387-V402 HydrophobicContact CB-CB 4.22Å; A387-V402 HydrophobicContact CB-CG2 4.13Å; A387-V402 PolarHBondContact O-N 3.47Å; V389-V402 HydrophobicContact CG1-CG2 4.08Å; V389-V402 HydrophobicContact CG2-CG2 4.18Å
403	S	98.5	Very high	97.2	Very high	23 Å²	23	73.7 Å²	73.7	16%	0.161	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	148.7	-176	-174.9	0	0	0	0	111.4	G335 I401	G335-S403 PolarHBondContact O-N 3.4Å; I401-S403 PolarHBondContact O-N 2.99Å
404	K	98.3	Very high	97.2	Very high	143 Å²	143	78.3 Å²	78.3	62%	0.622	39%	0.394	S	S	*	.			trans	-60.2	141.4	162.6	-173.7	179.4	175.9	-170.3	0	108.7
405	M	98.4	Very high	97.1	Very high	41 Å²	41	71.4 Å²	71.4	20%	0.202	40%	0.397	C	S	.	.	S	Bend	trans	-105.5	146.9	164.1	-69.2	-176	-66.9	0	0	109.5	M375 F407	M375-M405 HydrophobicContact CE-SD 3.89Å; M375-M405 HydrophobicContact CG-SD 3.75Å; M375-M405 HydrophobicContact SD-SD 3.93Å; M405-F407 HydrophobicContact CG-CD2 4.18Å; M405-F407 HydrophobicContact CG-CE1 4.49Å; M405-F407 HydrophobicContact CG-CE2 3.74Å; M405-F407 HydrophobicContact CG-CZ 3.92Å; M405-F407 HydrophobicContact SD-CE2 3.97Å; M405-F407 HydrophobicContact SD-CZ 4.22Å
406	P	98.6	Very high	97.4	Very high	47 Å²	47	65.7 Å²	65.7	31%	0.305	38%	0.376	S	S	.	.			cis	-65.9	155.5	-4.3	34.9	-40.5	0	0	0	111.7	A281 V408 T410	A281-P406 WeakPolarHBondContact O-CB 2.92Å; P406-V408 VanDerWaalsContact CB-O 3.3Å; P406-V408 WeakPolarHBondContact CB-O 3.45Å; P406-T410 HydrophobicContact CB-CG2 4.23Å; P406-T410 HydrophobicContact CG-CG2 4.05Å
407	F	98.7	Very high	97.6	Very high	21 Å²	21	60.9 Å²	60.9	9%	0.092	36%	0.36	C	S	.	.	S	Bend	trans	-79	-34	179.3	-57.7	-91.2	0	0	0	111.8	L279 E280 G335 L336 L337 L369 V373 A374 M405	L279-F407 WeakPolarHBondContact O-CD2 3.32Å; L279-F407 VanDerWaalsContact O-CE2 3.3Å; L279-F407 WeakPolarHBondContact O-CE2 3.48Å; E280-F407 PolarHBondContact O-N 3.36Å; G335-F407 VanDerWaalsContact CA-CZ 3.45Å; L336-F407 WeakPolarHBondContact O-CE1 3.38Å; L337-F407 HydrophobicContact CD2-CD1 3.92Å; L337-F407 HydrophobicContact CD2-CE1 4.32Å; L337-F407 HydrophobicContact CG-CD1 4.04Å; L337-F407 HydrophobicContact CG-CE1 4.22Å; L369-F407 HydrophobicContact CD1-CB 3.81Å; V373-F407 HydrophobicContact CB-CD1 4.47Å; V373-F407 HydrophobicContact CB-CD2 4.37Å; V373-F407 HydrophobicContact CB-CE1 4.38Å; V373-F407 HydrophobicContact CB-CE2 4.29Å; V373-F407 HydrophobicContact CB-CG 4.45Å; V373-F407 HydrophobicContact CB-CZ 4.29Å; V373-F407 HydrophobicContact CG1-CB 4.14Å; V373-F407 HydrophobicContact CG1-CD1 3.85Å; V373-F407 HydrophobicContact CG1-CD2 4.2Å; V373-F407 HydrophobicContact CG1-CE1 4.2Å; V373-F407 HydrophobicContact CG1-CG 3.83Å; A374-F407 WeakPolarHBondContact O-CZ 3.35Å; M405-F407 HydrophobicContact CG-CD2 4.18Å; M405-F407 HydrophobicContact CG-CE1 4.49Å; M405-F407 HydrophobicContact CG-CE2 3.74Å; M405-F407 HydrophobicContact CG-CZ 3.92Å; M405-F407 HydrophobicContact SD-CE2 3.97Å; M405-F407 HydrophobicContact SD-CZ 4.22Å
408	V	98.6	Very high	97.7	Very high	20 Å²	20	59.9 Å²	59.9	12%	0.121	35%	0.353	C	S	.	.	S	Bend	trans	-109.2	133.8	170.1	178.4	0	0	0	0	107.5	E280 C368 L369 P406	E280-V408 HydrophobicContact CB-CB 4.38Å; E280-V408 HydrophobicContact CB-CG2 3.99Å; E280-V408 HydrophobicContact CG-CG2 4.09Å; E280-V408 PolarHBondContact O-N 2.92Å; C368-V408 HydrophobicContact CB-CG2 3.85Å; L369-V408 HydrophobicContact CD1-CG2 4.3Å; L369-V408 HydrophobicContact CD2-CG2 4.09Å; L369-V408 HydrophobicContact CG-CG2 4.02Å; P406-V408 VanDerWaalsContact CB-O 3.3Å; P406-V408 WeakPolarHBondContact CB-O 3.45Å
409	P	98.5	Very high	97.7	Very high	101 Å²	101	62.4 Å²	62.4	66%	0.656	37%	0.367	S	S	*	.			trans	-55.2	139.5	177.3	-25.8	35.3	0	0	0	112.4
410	T	98.6	Very high	97.6	Very high	54 Å²	54	60 Å²	60	33%	0.331	35%	0.35	S	S	.	.			trans	-86	140.8	178.7	50.8	0	0	0	0	111.7	G240 P406 Y412	G240-T410 CarbonylContact O-C 3.57Å; G240-T410 WeakPolarHBondContact O-CA 3.48Å; G240-T410 VanDerWaalsContact O-CB 3.3Å; G240-T410 WeakPolarHBondContact O-CB 3.44Å; P406-T410 HydrophobicContact CB-CG2 4.23Å; P406-T410 HydrophobicContact CG-CG2 4.05Å; T410-Y412 HydrophobicContact CG2-CD2 4.36Å; T410-Y412 HydrophobicContact CG2-CE2 3.7Å
411	N	98.4	Very high	97.6	Very high	92 Å²	92	63.6 Å²	63.6	49%	0.492	37%	0.37	S	S	.	.			trans	-107	32.6	-178.2	-63.2	-44	0	0	0	113.1	G240 E241 D242 Y413	G240-N411 PolarHBondContact O-N 2.95Å; E241-N411 PolarHBondContact OE2-ND2 3.17Å; D242-N411 PolarHBondContact N-O 2.93Å; N411-Y413 PolarHBondContact O-N 2.9Å
412	Y	98.4	Very high	97.5	Very high	57 Å²	57	62 Å²	62	22%	0.224	37%	0.365	C	S	.	.			trans	-59.3	124.8	179.3	-56.8	-44.8	0	0	0	112.2	F217 E241 T410 T414	F217-Y412 HydrophobicContact CD1-CD2 4.43Å; F217-Y412 HydrophobicContact CD1-CG 4.25Å; F217-Y412 AromaticContact CD2-CD1 3.87Å; F217-Y412 HydrophobicContact CD2-CD1 3.87Å; F217-Y412 HydrophobicContact CD2-CG 4.01Å; F217-Y412 HydrophobicContact CE1-CD1 4.49Å; F217-Y412 AromaticContact CE1-CD2 3.99Å; F217-Y412 HydrophobicContact CE1-CD2 3.99Å; F217-Y412 HydrophobicContact CE1-CE2 4.32Å; F217-Y412 HydrophobicContact CE1-CG 4.09Å; F217-Y412 AromaticContact CE2-CD1 3.49Å; F217-Y412 HydrophobicContact CE2-CD1 3.49Å; F217-Y412 VanDerWaalsContact CE2-CD1 3.49Å; F217-Y412 HydrophobicContact CE2-CD2 4.41Å; F217-Y412 AromaticContact CE2-CE1 3.75Å; F217-Y412 HydrophobicContact CE2-CE1 3.75Å; F217-Y412 AromaticContact CE2-CG 3.85Å; F217-Y412 HydrophobicContact CE2-CG 3.85Å; F217-Y412 HydrophobicContact CG-CG 4.22Å; F217-Y412 AromaticContact CZ-CD1 3.84Å; F217-Y412 HydrophobicContact CZ-CD1 3.84Å; F217-Y412 AromaticContact CZ-CD2 3.98Å; F217-Y412 HydrophobicContact CZ-CD2 3.98Å; F217-Y412 AromaticContact CZ-CE1 3.88Å; F217-Y412 HydrophobicContact CZ-CE1 3.88Å; F217-Y412 HydrophobicContact CZ-CE2 4.03Å; F217-Y412 AromaticContact CZ-CG 3.89Å; F217-Y412 HydrophobicContact CZ-CG 3.89Å; F217-Y412 AromaticContact CZ-CZ 3.97Å; E241-Y412 WeakPolarHBondContact O-CD1 3.25Å; T410-Y412 HydrophobicContact CG2-CD2 4.36Å; T410-Y412 HydrophobicContact CG2-CE2 3.7Å; Y412-T414 PolarHBondContact O-N 3.34Å
413	Y	98.1	Very high	97.4	Very high	60 Å²	60	66.6 Å²	66.6	24%	0.235	39%	0.392	C	S	.	.			trans	-77.4	117.1	179.1	176	-95.7	0	0	0	112.3	S213 T216 F217 R235 N411 G415	S213-Y413 VanDerWaalsContact O-CE1 3.22Å; S213-Y413 WeakPolarHBondContact O-CE1 3.49Å; S213-Y413 PolarHBondContact O-OH 2.94Å; S213-Y413 VanDerWaalsContact O-OH 3.08Å; T216-Y413 HydrophobicContact CG2-CE1 4.09Å; F217-Y413 VanDerWaalsContact CB-O 3.22Å; F217-Y413 WeakPolarHBondContact CB-O 3.38Å; F217-Y413 PolarHBondContact N-O 3.34Å; R235-Y413 VanDerWaalsContact CZ-CG 3.47Å; N411-Y413 PolarHBondContact O-N 2.9Å; Y413-G415 WeakPolarHBondContact CE2-OXT 3.41Å; Y413-G415 VanDerWaalsContact CZ-OXT 3.23Å; Y413-G415 WeakPolarHBondContact OH-CA 3.44Å; Y413-G415 PolarHBondContact OH-OXT 3.07Å
414	T	94.6	Very high	97.3	Very high	115 Å²	115	70.3 Å²	70.3	71%	0.706	41%	0.411	S	S	*	.			trans	-108.7	-1.6	-175.2	50.9	0	0	0	0	115.5	T216 Y412	T216-T414 WeakPolarHBondContact CG2-O 3.2Å; Y412-T414 PolarHBondContact O-N 3.34Å
415	G	88.6	Confident	97.2	Very high	92 Å²	92	63.6 Å²	63.6	95%	0.948	39%	0.392	S	S	*	.			trans	131	0	-172.9	0	0	0	0	0	111.5	Y413	Y413-G415 WeakPolarHBondContact CE2-OXT 3.41Å; Y413-G415 VanDerWaalsContact CZ-OXT 3.23Å; Y413-G415 WeakPolarHBondContact OH-CA 3.44Å; Y413-G415 PolarHBondContact OH-OXT 3.07Å

Retrieved 415 of 415 residues in 656.2 ms (Link to these results)

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