A0A023IKK5_RAT Loading...

RT1-DOb isoform 1

Involved in the presentation of foreign antigens to the immune system.

AlphaFold DB , UniProt , Accession A0A023IKK5, Species RAT (Rattus norvegicus, Rat), Gene DOb, Length 246 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.1	Very low	38.3	Very low	250 Å²	250	141.3 Å²	141.3	100%	1.232	85%	0.849	S	S	*	*				0	132.6	0	-79.8	148	139	0	0	108.1
2	G	32.5	Very low	38.3	Very low	83 Å²	83	141.1 Å²	141.1	86%	0.856	84%	0.839	S	S	*	*			trans	105.3	96	168.3	0	0	0	0	0	114.8
3	A	37.8	Very low	39	Very low	112 Å²	112	143 Å²	143	93%	0.926	84%	0.842	S	S	*	*			trans	-68.3	156.9	168.9	0	0	0	0	0	112.1
4	G	34.2	Very low	39.3	Very low	70 Å²	70	142.6 Å²	142.6	72%	0.722	84%	0.841	S	S	*	*			trans	168.2	85.9	160.8	0	0	0	0	0	118.5
5	R	38.3	Very low	39.8	Very low	245 Å²	245	143.1 Å²	143.1	93%	0.925	84%	0.838	S	S	*	*			trans	77.9	117	144.2	-60	-179	178.4	-144.5	-2.2	118.8
6	A	32.8	Very low	40.3	Very low	79 Å²	79	144.8 Å²	144.8	65%	0.653	84%	0.841	S	S	*	*			trans	-65.9	138.3	167.9	0	0	0	0	0	111.8	W8	A6-W8 PolarHBondContact O-NE1 3.26Å
7	P	39.5	Very low	40.3	Very low	115 Å²	115	146.8 Å²	146.8	75%	0.747	84%	0.844	S	S	*	*			trans	-77	143.1	163.6	-7.6	25.2	0	0	0	110.8	V9	P7-V9 PolarHBondContact O-N 2.92Å; P7-V9 VanDerWaalsContact O-N 3.12Å
8	W	37.9	Very low	40.6	Very low	250 Å²	250	151.5 Å²	151.5	95%	0.947	85%	0.846	S	S	*	*			trans	-93.8	67.7	-160.8	-52.9	32	0	0	0	108.9	A6	A6-W8 PolarHBondContact O-NE1 3.26Å
9	V	45.2	Very low	40.9	Very low	124 Å²	124	149.3 Å²	149.3	75%	0.752	84%	0.839	S	S	*	*			trans	-143.4	112.3	-177.5	-164.2	0	0	0	0	111.6	P7	P7-V9 PolarHBondContact O-N 2.92Å; P7-V9 VanDerWaalsContact O-N 3.12Å
10	V	45.8	Very low	40.8	Very low	128 Å²	128	148.9 Å²	148.9	78%	0.776	83%	0.834	S	S	*	*			trans	73.6	96.4	164.6	-155	0	0	0	0	118.2
11	A	41.7	Very low	41	Very low	98 Å²	98	146 Å²	146	81%	0.81	82%	0.824	S	S	*	*			trans	-129.6	91.3	141.2	0	0	0	0	0	108.6
12	L	38.6	Very low	41.3	Very low	139 Å²	139	142.7 Å²	142.7	73%	0.728	80%	0.803	S	S	*	*			trans	45.7	108.9	135	-82.1	140.3	0	0	0	119	V14	L12-V14 PolarHBondContact O-N 3.46Å; L12-V14 VanDerWaalsContact O-N 3.12Å
13	L	47.5	Very low	41.7	Very low	166 Å²	166	145.6 Å²	145.6	87%	0.869	80%	0.796	S	S	*	*			trans	-2.2	94.6	142.8	-66.8	161.3	0	0	0	115.4
14	V	43.9	Very low	42.4	Very low	137 Å²	137	145.4 Å²	145.4	83%	0.83	78%	0.783	S	S	*	*			trans	-129.1	62.1	152.3	-166.6	0	0	0	0	108.1	L12	L12-V14 PolarHBondContact O-N 3.46Å; L12-V14 VanDerWaalsContact O-N 3.12Å
15	N	46.2	Very low	43.1	Very low	150 Å²	150	150 Å²	150	80%	0.802	79%	0.786	S	S	*	*			trans	-129	92.2	159	-90.3	-46.4	0	0	0	106
16	L	47.1	Very low	43.9	Very low	170 Å²	170	141 Å²	141	89%	0.89	77%	0.769	S	S	*	*	S	Bend	trans	164.1	79.4	151.6	-89.1	165.5	0	0	0	106.4
17	M	41.7	Very low	45.1	Very low	179 Å²	179	147.7 Å²	147.7	88%	0.882	78%	0.777	S	S	*	*			trans	159.4	58.1	156.2	-76.8	-129.4	-79.1	0	0	106	P19	M17-P19 WeakPolarHBondContact O-CD 3.42Å
18	R	45.2	Very low	46.4	Very low	232 Å²	232	150.4 Å²	150.4	88%	0.875	79%	0.785	S	S	*	*			trans	-62.6	118.4	139	-155.6	178.2	-171.7	106.3	-0.8	101.3	D20	R18-D20 PolarHBondContact O-N 3.17Å
19	P	46.1	Very low	48.2	Very low	110 Å²	110	142.8 Å²	142.8	71%	0.714	77%	0.77	S	S	*	*			trans	-54.6	114	160.6	-6.1	20.8	0	0	0	101.4	M17 S21	M17-P19 WeakPolarHBondContact O-CD 3.42Å; P19-S21 PolarHBondContact O-N 2.86Å
20	D	39.4	Very low	50	Low	141 Å²	141	142.6 Å²	142.6	75%	0.754	77%	0.771	S	S	*	*			trans	-43.9	117.1	147.8	-83.7	-34.6	0	0	0	101.8	R18 F22	R18-D20 PolarHBondContact O-N 3.17Å; D20-F22 PolarHBondContact O-N 2.74Å
21	S	44.2	Very low	52.1	Low	88 Å²	88	144.6 Å²	144.6	62%	0.615	77%	0.773	S	S	*	*			trans	-54.1	91.3	158.4	44.8	0	0	0	0	102.3	P19 M23	P19-S21 PolarHBondContact O-N 2.86Å; S21-M23 PolarHBondContact O-N 2.78Å
22	F	42.8	Very low	54.4	Low	181 Å²	181	146 Å²	146	79%	0.794	77%	0.766	S	S	*	*			trans	-62.2	69.1	148.2	-149.2	-87.6	0	0	0	101.7	D20 V24	D20-F22 PolarHBondContact O-N 2.74Å; F22-V24 HydrophobicContact CD1-CG2 3.61Å; F22-V24 HydrophobicContact CE1-CG2 3.83Å; F22-V24 PolarHBondContact O-N 3.4Å
23	M	39.8	Very low	57	Low	144 Å²	144	145.9 Å²	145.9	71%	0.709	76%	0.76	S	S	*	*			trans	-47.5	98	133.2	-63.4	-167.7	177.1	0	0	100.8	S21 E25	S21-M23 PolarHBondContact O-N 2.78Å; M23-E25 PolarHBondContact O-N 2.85Å
24	V	51.8	Low	59.3	Low	108 Å²	108	140.1 Å²	140.1	66%	0.655	73%	0.732	S	S	*	*			trans	-50.8	91.9	139.7	-177.7	0	0	0	0	100.8	F22 G26	F22-V24 HydrophobicContact CD1-CG2 3.61Å; F22-V24 HydrophobicContact CE1-CG2 3.83Å; F22-V24 PolarHBondContact O-N 3.4Å; V24-G26 PolarHBondContact O-N 3.46Å
25	E	50.7	Low	61.7	Low	167 Å²	167	139.6 Å²	139.6	78%	0.78	72%	0.723	S	S	*	*			trans	-57.6	86.1	156.2	-170	105.6	-150.5	0	0	100.9	M23 R27	M23-E25 PolarHBondContact O-N 2.85Å; E25-R27 PolarHBondContact O-N 2.93Å
26	G	54.4	Low	64.1	Low	54 Å²	54	136.1 Å²	136.1	56%	0.557	70%	0.702	S	S	*	*			trans	-58.2	102.9	171.4	0	0	0	0	0	101.3	V24 D28	V24-G26 PolarHBondContact O-N 3.46Å; G26-D28 PolarHBondContact O-N 2.91Å
27	R	57.5	Low	66.5	Low	220 Å²	220	131.4 Å²	131.4	83%	0.83	69%	0.687	S	S	*	*			trans	-50.8	116.2	173	-75.6	-179.4	-172.3	160.1	2.5	103.9	E25 S29	E25-R27 PolarHBondContact O-N 2.93Å; R27-S29 PolarHBondContact O-N 3.09Å; R27-S29 PolarHBondContact O-OG 3.47Å
28	D	66.1	Low	69.1	Low	172 Å²	172	127.6 Å²	127.6	92%	0.92	67%	0.666	S	S	*	*			trans	-56.6	88.7	171	-119.8	-5.6	0	0	0	105.4	G26	G26-D28 PolarHBondContact O-N 2.91Å
29	S	75.9	Confident	71.5	Confident	90 Å²	90	120 Å²	120	63%	0.629	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-87.7	125	179.7	-59.6	0	0	0	0	103.5	R27 E31	R27-S29 PolarHBondContact O-N 3.09Å; R27-S29 PolarHBondContact O-OG 3.47Å; S29-E31 PolarHBondContact O-N 3.19Å
30	P	84.2	Confident	73.8	Confident	120 Å²	120	117.1 Å²	117.1	78%	0.779	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-56.2	137.5	-177.8	23.1	-32.1	0	0	0	109.4	D32	P30-D32 PolarHBondContact O-N 3.11Å
31	E	88.6	Confident	76.5	Confident	171 Å²	171	112.3 Å²	112.3	80%	0.799	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-61.6	135	169.5	-62.8	-178.3	169.2	0	0	108.8	S29 F33	S29-E31 PolarHBondContact O-N 3.19Å; E31-F33 HydrophobicContact CB-CE2 4.02Å
32	D	91.3	Very high	78.8	Confident	126 Å²	126	113 Å²	113	67%	0.674	60%	0.596	S	S	*	*			trans	-119.7	129	-177.7	-169	22.4	0	0	0	110.2	P30 V34	P30-D32 PolarHBondContact O-N 3.11Å; D32-V34 WeakPolarHBondContact OD2-CG2 3.14Å
33	F	92.3	Very high	81.1	Confident	137 Å²	137	107.7 Å²	107.7	60%	0.601	57%	0.573	S	S	*	*			trans	-130.1	110.8	176.7	-63.6	-85.7	0	0	0	107.7	E31 F58	E31-F33 HydrophobicContact CB-CE2 4.02Å; F33-F58 HydrophobicContact CD1-CZ 4.06Å
34	V	95.6	Very high	83.5	Confident	45 Å²	45	104.8 Å²	104.8	27%	0.273	56%	0.564	S	S	.	*			trans	-108.7	127.3	-172.3	-174.1	0	0	0	0	109.6	D32 Q36 N59	D32-V34 WeakPolarHBondContact OD2-CG2 3.14Å; V34-Q36 HydrophobicContact CG1-CG 3.7Å; V34-N59 PolarHBondContact N-OD1 3.2Å; V34-N59 WeakPolarHBondContact O-CA 3.29Å; V34-N59 PolarHBondContact O-N 2.73Å
35	I	94.3	Very high	85.2	Confident	127 Å²	127	105.6 Å²	105.6	65%	0.651	57%	0.565	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-113.2	127.7	169.7	-57.1	-179.9	0	0	0	107.7	I57 F58	I35-I57 WeakPolarHBondContact CA-O 3.29Å; I35-F58 HydrophobicContact CD1-CD2 4.43Å; I35-F58 HydrophobicContact CD1-CE2 4.49Å; I35-F58 HydrophobicContact CG1-CD2 3.89Å; I35-F58 HydrophobicContact CG1-CE2 4.16Å
36	Q	97.4	Very high	86.8	Confident	77 Å²	77	99 Å²	99	36%	0.36	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	141.4	177.7	-46.3	-174.6	-59.9	0	0	110	V34 I57	V34-Q36 HydrophobicContact CG1-CG 3.7Å; Q36-I57 HydrophobicContact CB-CB 4.25Å; Q36-I57 PolarHBondContact N-O 3.14Å; Q36-I57 PolarHBondContact O-N 2.99Å
37	A	96.4	Very high	88.5	Confident	70 Å²	70	98.9 Å²	98.9	58%	0.579	53%	0.529	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.1	124.4	166.4	0	0	0	0	0	108.1	R55 F56	A37-R55 CarbonylContact C-O 3.55Å; A37-R55 VanDerWaalsContact CA-O 3.31Å; A37-R55 WeakPolarHBondContact CA-O 3.46Å; A37-F56 HydrophobicContact CB-CD1 4.23Å; A37-F56 HydrophobicContact CB-CE1 4.31Å
38	K	96.6	Very high	90.1	Very high	99 Å²	99	95.3 Å²	95.3	43%	0.43	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	114.6	177.9	-65.6	-175.2	-178.5	177.5	0	109.1	V54 R55 I57	K38-V54 CarbonylContact O-C 3.59Å; K38-V54 VanDerWaalsContact O-CA 3.3Å; K38-V54 WeakPolarHBondContact O-CA 3.47Å; K38-R55 HydrophobicContact CB-CB 4.43Å; K38-R55 PolarHBondContact N-O 3.22Å; K38-R55 PolarHBondContact O-N 3.39Å; K38-I57 HydrophobicContact CD-CD1 3.78Å; K38-I57 HydrophobicContact CG-CD1 4.1Å
39	A	95.9	Very high	91.5	Very high	72 Å²	72	93.2 Å²	93.2	60%	0.595	51%	0.505	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	113.3	174.6	0	0	0	0	0	109.2	F52 V54	A39-F52 HydrophobicContact CB-CE2 4.05Å; A39-F52 HydrophobicContact CB-CZ 4.37Å; A39-V54 HydrophobicContact CB-CG2 4.25Å
40	E	95.5	Very high	92.5	Very high	50 Å²	50	89.6 Å²	89.6	23%	0.234	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	133.4	-174	-62	173.4	169.5	0	0	109.5	Y42 F52 L53 R55	E40-Y42 HydrophobicContact CB-CD2 4.4Å; E40-Y42 HydrophobicContact CB-CE2 3.63Å; E40-Y42 PolarHBondContact OE2-OH 2.95Å; E40-F52 WeakPolarHBondContact O-CA 3.08Å; E40-L53 HydrophobicContact CB-CB 4.46Å; E40-L53 PolarHBondContact N-O 3.13Å; E40-L53 PolarHBondContact O-N 2.87Å; E40-R55 IonicContact OE1-NE 2.88Å; E40-R55 IonicContact OE2-CZ 4Å; E40-R55 IonicContact OE2-NE 3.81Å; E40-R55 PolarHBondContact OE2-NE 2.67Å; E40-R55 IonicContact OE2-NH2 2.91Å
41	C	95.3	Very high	93.1	Very high	41 Å²	41	88.1 Å²	88.1	28%	0.277	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	114.2	175	-66.7	0	0	0	0	109	F43 C105	C41-F43 HydrophobicContact CB-CD2 4.38Å; C41-F43 HydrophobicContact CB-CE2 3.47Å; C41-F43 VanDerWaalsContact CB-CE2 3.47Å; C41-F43 HydrophobicContact CB-CZ 3.57Å; C41-F43 WeakPolarHBondContact O-CD2 3.44Å; C41-F43 WeakPolarHBondContact O-CE2 3.48Å; C41-C105 HydrophobicContact CB-CB 3.65Å; C41-C105 WeakPolarHBondContact CB-SG 3.06Å; C41-C105 WeakPolarHBondContact SG-CA 3.42Å; C41-C105 WeakPolarHBondContact SG-CB 3.43Å; C41-C105 CovalentContact SG-SG 2.04Å; C41-C105 PolarHBondContact SG-SG 2.82Å
42	Y	93	Very high	93.5	Very high	101 Å²	101	80.6 Å²	80.6	40%	0.396	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	121.7	177.3	-61	-87.9	0	0	0	109.5	E40 V50 R51 L53	E40-Y42 HydrophobicContact CB-CD2 4.4Å; E40-Y42 HydrophobicContact CB-CE2 3.63Å; E40-Y42 PolarHBondContact OE2-OH 2.95Å; Y42-V50 WeakPolarHBondContact O-CA 3.45Å; Y42-R51 PolarHBondContact N-O 3.28Å; Y42-R51 PolarHBondContact O-N 3.49Å; Y42-L53 HydrophobicContact CE2-CB 4.13Å; Y42-L53 HydrophobicContact CE2-CD2 4.17Å
43	F	91.5	Very high	93.8	Very high	70 Å²	70	74.8 Å²	74.8	31%	0.307	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	128.4	-177.2	-62.1	-80.1	0	0	0	110.1	C41 G46 V50 C105 Y109	C41-F43 HydrophobicContact CB-CD2 4.38Å; C41-F43 HydrophobicContact CB-CE2 3.47Å; C41-F43 VanDerWaalsContact CB-CE2 3.47Å; C41-F43 HydrophobicContact CB-CZ 3.57Å; C41-F43 WeakPolarHBondContact O-CD2 3.44Å; C41-F43 WeakPolarHBondContact O-CE2 3.48Å; F43-G46 WeakPolarHBondContact CB-O 3.24Å; F43-V50 HydrophobicContact CD1-CG1 4.07Å; F43-V50 HydrophobicContact CD1-CG2 3.87Å; F43-V50 HydrophobicContact CE1-CG1 3.81Å; F43-V50 HydrophobicContact CE1-CG2 4.13Å; F43-C105 HydrophobicContact CE1-CB 4.02Å; F43-C105 WeakPolarHBondContact CE1-O 3.12Å; F43-C105 HydrophobicContact CZ-CB 3.83Å; F43-C105 VanDerWaalsContact CZ-O 3.22Å; F43-C105 WeakPolarHBondContact CZ-O 3.22Å; F43-Y109 HydrophobicContact CB-CD2 4.32Å; F43-Y109 HydrophobicContact CB-CE2 4.24Å; F43-Y109 AromaticContact CD1-CD2 3.53Å; F43-Y109 HydrophobicContact CD1-CD2 3.53Å; F43-Y109 HydrophobicContact CD1-CE2 4.21Å; F43-Y109 HydrophobicContact CD1-CG 4.13Å; F43-Y109 AromaticContact CD2-CD2 3.93Å; F43-Y109 HydrophobicContact CD2-CD2 3.93Å; F43-Y109 AromaticContact CE1-CD2 3.74Å; F43-Y109 HydrophobicContact CE1-CD2 3.74Å; F43-Y109 AromaticContact CE1-CG 4Å; F43-Y109 HydrophobicContact CE1-CG 4Å; F43-Y109 HydrophobicContact CE2-CD2 4.1Å; F43-Y109 AromaticContact CG-CD2 3.65Å; F43-Y109 HydrophobicContact CG-CD2 3.65Å; F43-Y109 HydrophobicContact CG-CE2 4.07Å; F43-Y109 HydrophobicContact CZ-CD2 4.01Å; F43-Y109 HydrophobicContact CZ-CG 4.38Å
44	T	88.4	Confident	94.1	Very high	84 Å²	84	69.3 Å²	69.3	52%	0.515	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	129.3	173.1	-50.6	0	0	0	0	109.3	K49	T44-K49 PolarHBondContact N-O 3.01Å; T44-K49 PolarHBondContact O-N 2.9Å
45	N	87.4	Confident	94.2	Very high	125 Å²	125	70.4 Å²	70.4	67%	0.668	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	59.5	-174.8	-162.3	22.3	0	0	0	112.3	T47 E48	N45-T47 PolarHBondContact O-N 2.83Å; N45-E48 HydrophobicContact CB-CB 4.35Å; N45-E48 PolarHBondContact ND2-OE2 2.91Å; N45-E48 PolarHBondContact O-N 2.83Å
46	G	84.4	Confident	94.3	Very high	28 Å²	28	66.2 Å²	66.2	29%	0.289	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	-117.6	-174.7	0	0	0	0	0	111.4	F43 Y109	F43-G46 WeakPolarHBondContact CB-O 3.24Å; G46-Y109 WeakPolarHBondContact CA-OH 3.39Å
47	T	91.1	Very high	94.3	Very high	51 Å²	51	63.2 Å²	63.2	31%	0.313	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	12.5	177.7	65.9	0	0	0	0	112.9	N45 R106 Y109	N45-T47 PolarHBondContact O-N 2.83Å; T47-R106 VanDerWaalsContact O-CZ 3.26Å; T47-R106 PolarHBondContact O-NH1 3.46Å; T47-R106 PolarHBondContact O-NH2 3.42Å; T47-R106 VanDerWaalsContact O-NH2 3.14Å; T47-Y109 HydrophobicContact CG2-CD1 3.27Å; T47-Y109 HydrophobicContact CG2-CD2 4.3Å; T47-Y109 HydrophobicContact CG2-CE1 3.71Å; T47-Y109 HydrophobicContact CG2-CG 3.61Å
48	E	91.2	Very high	94.3	Very high	146 Å²	146	63.3 Å²	63.3	68%	0.682	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-54.2	-179.5	-173.4	-178.9	173.1	0	0	111.1	N45	N45-E48 HydrophobicContact CB-CB 4.35Å; N45-E48 PolarHBondContact ND2-OE2 2.91Å; N45-E48 PolarHBondContact O-N 2.83Å
49	K	94.8	Very high	94.2	Very high	128 Å²	128	61.4 Å²	61.4	56%	0.557	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.6	124.5	174.1	-176	179	-178.3	-177.6	0	109.6	T44	T44-K49 PolarHBondContact N-O 3.01Å; T44-K49 PolarHBondContact O-N 2.9Å
50	V	96.4	Very high	94.1	Very high	14 Å²	14	66 Å²	66	9%	0.085	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	124.4	-179	-175.1	0	0	0	0	108.3	Y42 F43 V101 C105 R106	Y42-V50 WeakPolarHBondContact O-CA 3.45Å; F43-V50 HydrophobicContact CD1-CG1 4.07Å; F43-V50 HydrophobicContact CD1-CG2 3.87Å; F43-V50 HydrophobicContact CE1-CG1 3.81Å; F43-V50 HydrophobicContact CE1-CG2 4.13Å; V50-V101 HydrophobicContact CB-CG1 3.87Å; V50-V101 HydrophobicContact CG1-CG1 3.9Å; V50-C105 HydrophobicContact CG1-CB 3.56Å; V50-R106 HydrophobicContact CG2-CG 4.28Å
51	R	97.1	Very high	94.1	Very high	88 Å²	88	69.4 Å²	69.4	33%	0.332	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	126.8	173.2	180	-176.8	179.8	-162.5	0.5	109.1	Y42 D67 S68 D69	Y42-R51 PolarHBondContact N-O 3.28Å; Y42-R51 PolarHBondContact O-N 3.49Å; R51-D67 IonicContact CZ-OD1 2.99Å; R51-D67 IonicContact CZ-OD2 3.77Å; R51-D67 IonicContact NE-OD1 2.65Å; R51-D67 PolarHBondContact NE-OD1 2.83Å; R51-D67 IonicContact NE-OD2 3.83Å; R51-D67 PolarHBondContact NE-OD2 2.82Å; R51-D67 IonicContact NH2-OD1 2.7Å; R51-D67 IonicContact NH2-OD2 3.21Å; R51-D67 PolarHBondContact NH2-OD2 2.84Å; R51-S68 WeakPolarHBondContact CA-OG 3.2Å; R51-D69 WeakPolarHBondContact CD-OD2 3.33Å; R51-D69 IonicContact NE-OD2 3.52Å
52	F	97.5	Very high	94.2	Very high	14 Å²	14	69.2 Å²	69.2	6%	0.061	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	126.6	174.5	178.9	-117.3	0	0	0	109.3	A39 E40 V54 F66 S68 A100 V101 C105	A39-F52 HydrophobicContact CB-CE2 4.05Å; A39-F52 HydrophobicContact CB-CZ 4.37Å; E40-F52 WeakPolarHBondContact O-CA 3.08Å; F52-V54 HydrophobicContact CD1-CG2 4.1Å; F52-V54 HydrophobicContact CE1-CG2 3.23Å; F52-V54 HydrophobicContact CE2-CG2 3.83Å; F52-V54 HydrophobicContact CZ-CG2 3.08Å; F52-F66 HydrophobicContact CD1-CD1 4.05Å; F52-F66 HydrophobicContact CD1-CE1 4.14Å; F52-F66 HydrophobicContact CE1-CD1 4.39Å; F52-S68 PolarHBondContact N-OG 2.7Å; F52-S68 WeakPolarHBondContact O-CB 3.43Å; F52-S68 PolarHBondContact O-N 2.81Å; F52-S68 PolarHBondContact O-OG 3.28Å; F52-A100 HydrophobicContact CD1-CB 3.46Å; F52-A100 VanDerWaalsContact CD1-CB 3.46Å; F52-A100 HydrophobicContact CE1-CB 3.22Å; F52-A100 HydrophobicContact CE2-CB 4.4Å; F52-A100 HydrophobicContact CG-CB 4.14Å; F52-A100 HydrophobicContact CZ-CB 3.72Å; F52-V101 HydrophobicContact CB-CG2 3.79Å; F52-C105 WeakPolarHBondContact CD2-SG 3.38Å
53	L	97.8	Very high	94.4	Very high	4 Å²	4	65.7 Å²	65.7	2%	0.021	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	122.1	-179.6	-175.1	68.8	0	0	0	108.9	E40 Y42 R55 H65 F66 D67	E40-L53 HydrophobicContact CB-CB 4.46Å; E40-L53 PolarHBondContact N-O 3.13Å; E40-L53 PolarHBondContact O-N 2.87Å; Y42-L53 HydrophobicContact CE2-CB 4.13Å; Y42-L53 HydrophobicContact CE2-CD2 4.17Å; L53-R55 HydrophobicContact CD2-CG 4.28Å; L53-R55 HydrophobicContact CG-CG 4.17Å; L53-H65 HydrophobicContact CD1-CB 4.2Å; L53-F66 WeakPolarHBondContact CA-O 3.1Å; L53-F66 WeakPolarHBondContact CD1-O 3.39Å; L53-D67 HydrophobicContact CD1-CB 3.95Å
54	V	97.6	Very high	94.7	Very high	22 Å²	22	62.3 Å²	62.3	13%	0.133	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	114.8	173.2	-175.2	0	0	0	0	108.8	K38 A39 F52 F56 H65 F66	K38-V54 CarbonylContact O-C 3.59Å; K38-V54 VanDerWaalsContact O-CA 3.3Å; K38-V54 WeakPolarHBondContact O-CA 3.47Å; A39-V54 HydrophobicContact CB-CG2 4.25Å; F52-V54 HydrophobicContact CD1-CG2 4.1Å; F52-V54 HydrophobicContact CE1-CG2 3.23Å; F52-V54 HydrophobicContact CE2-CG2 3.83Å; F52-V54 HydrophobicContact CZ-CG2 3.08Å; V54-F56 HydrophobicContact CB-CE2 4.26Å; V54-F56 HydrophobicContact CG1-CD2 4.35Å; V54-F56 HydrophobicContact CG1-CE1 4.47Å; V54-F56 HydrophobicContact CG1-CE2 3.68Å; V54-F56 HydrophobicContact CG1-CZ 3.76Å; V54-H65 CarbonylContact O-C 3.55Å; V54-H65 WeakPolarHBondContact O-CA 3.28Å; V54-H65 WeakPolarHBondContact O-CB 3.19Å; V54-F66 HydrophobicContact CB-CB 4.43Å; V54-F66 PolarHBondContact N-O 3.47Å; V54-F66 PolarHBondContact O-N 2.78Å
55	R	98	Very high	95.1	Very high	67 Å²	67	59.5 Å²	59.5	25%	0.253	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	129	179.2	-58.3	174.7	-177	-88.1	4.3	109.8	A37 K38 E40 L53 I57 E62 H65	A37-R55 CarbonylContact C-O 3.55Å; A37-R55 VanDerWaalsContact CA-O 3.31Å; A37-R55 WeakPolarHBondContact CA-O 3.46Å; K38-R55 HydrophobicContact CB-CB 4.43Å; K38-R55 PolarHBondContact N-O 3.22Å; K38-R55 PolarHBondContact O-N 3.39Å; E40-R55 IonicContact OE1-NE 2.88Å; E40-R55 IonicContact OE2-CZ 4Å; E40-R55 IonicContact OE2-NE 3.81Å; E40-R55 PolarHBondContact OE2-NE 2.67Å; E40-R55 IonicContact OE2-NH2 2.91Å; L53-R55 HydrophobicContact CD2-CG 4.28Å; L53-R55 HydrophobicContact CG-CG 4.17Å; R55-I57 HydrophobicContact CB-CD1 4.46Å; R55-I57 HydrophobicContact CB-CG1 4.42Å; R55-E62 HydrophobicContact CB-CG 4.08Å; R55-E62 VanDerWaalsContact CD-OE2 3.31Å; R55-E62 WeakPolarHBondContact CD-OE2 3.47Å; R55-E62 IonicContact CZ-OE2 3.99Å; R55-E62 IonicContact NE-OE2 3.67Å; R55-E62 IonicContact NH1-OE1 3.64Å; R55-E62 PolarHBondContact NH1-OE1 2.79Å; R55-E62 IonicContact NH1-OE2 3.38Å; R55-E62 PolarHBondContact NH1-OE2 3.11Å; R55-H65 HydrophobicContact CG-CB 4.44Å
56	F	97.3	Very high	95.7	Very high	40 Å²	40	53.6 Å²	53.6	18%	0.175	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	122.2	172.5	-61.1	-94.2	0	0	0	108.6	A37 V54 E62 Y63 L64 F73 W87	A37-F56 HydrophobicContact CB-CD1 4.23Å; A37-F56 HydrophobicContact CB-CE1 4.31Å; V54-F56 HydrophobicContact CB-CE2 4.26Å; V54-F56 HydrophobicContact CG1-CD2 4.35Å; V54-F56 HydrophobicContact CG1-CE1 4.47Å; V54-F56 HydrophobicContact CG1-CE2 3.68Å; V54-F56 HydrophobicContact CG1-CZ 3.76Å; F56-E62 WeakPolarHBondContact O-CA 3.5Å; F56-Y63 HydrophobicContact CB-CD1 4.18Å; F56-Y63 HydrophobicContact CB-CE1 3.51Å; F56-Y63 WeakPolarHBondContact O-CD1 3.43Å; F56-Y63 PolarHBondContact O-N 3.13Å; F56-L64 HydrophobicContact CB-CD2 4.5Å; F56-L64 WeakPolarHBondContact CB-O 3.34Å; F56-L64 HydrophobicContact CD2-CD2 3.33Å; F56-L64 HydrophobicContact CE2-CD2 3.76Å; F56-L64 HydrophobicContact CG-CD2 4.12Å; F56-L64 PolarHBondContact N-O 2.84Å; F56-F73 HydrophobicContact CE2-CD1 4.43Å; F56-F73 HydrophobicContact CE2-CE1 4.08Å; F56-W87 HydrophobicContact CD1-CH2 4.23Å; F56-W87 HydrophobicContact CD1-CZ3 4.46Å; F56-W87 HydrophobicContact CD2-CZ3 4.21Å; F56-W87 AromaticContact CE1-CH2 3.91Å; F56-W87 HydrophobicContact CE1-CH2 3.91Å; F56-W87 AromaticContact CE1-CZ3 4Å; F56-W87 HydrophobicContact CE1-CZ3 4Å; F56-W87 HydrophobicContact CE2-CH2 4.4Å; F56-W87 AromaticContact CE2-CZ3 3.71Å; F56-W87 HydrophobicContact CE2-CZ3 3.71Å; F56-W87 AromaticContact CZ-CH2 4Å; F56-W87 HydrophobicContact CZ-CH2 4Å; F56-W87 AromaticContact CZ-CZ3 3.59Å; F56-W87 HydrophobicContact CZ-CZ3 3.59Å
57	I	97.7	Very high	96.3	Very high	14 Å²	14	52.8 Å²	52.8	7%	0.072	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	126.6	-168.6	-57	163.6	0	0	0	108.4	I35 Q36 K38 R55 E61 E62	I35-I57 WeakPolarHBondContact CA-O 3.29Å; Q36-I57 HydrophobicContact CB-CB 4.25Å; Q36-I57 PolarHBondContact N-O 3.14Å; Q36-I57 PolarHBondContact O-N 2.99Å; K38-I57 HydrophobicContact CD-CD1 3.78Å; K38-I57 HydrophobicContact CG-CD1 4.1Å; R55-I57 HydrophobicContact CB-CD1 4.46Å; R55-I57 HydrophobicContact CB-CG1 4.42Å; I57-E61 CarbonylContact C-O 3.53Å; I57-E61 WeakPolarHBondContact CA-O 3.32Å; I57-E62 HydrophobicContact CG1-CB 4.14Å; I57-E62 HydrophobicContact CG1-CG 4.32Å
58	F	96	Very high	96.6	Very high	71 Å²	71	51.5 Å²	51.5	31%	0.311	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	120.1	172.3	-173.2	-102.1	0	0	0	108.7	F33 I35 L60 E61 Y63	F33-F58 HydrophobicContact CD1-CZ 4.06Å; I35-F58 HydrophobicContact CD1-CD2 4.43Å; I35-F58 HydrophobicContact CD1-CE2 4.49Å; I35-F58 HydrophobicContact CG1-CD2 3.89Å; I35-F58 HydrophobicContact CG1-CE2 4.16Å; F58-L60 PolarHBondContact O-N 2.91Å; F58-E61 PolarHBondContact N-O 3.01Å; F58-E61 PolarHBondContact O-N 3.19Å; F58-Y63 HydrophobicContact CB-CD1 4.03Å; F58-Y63 HydrophobicContact CB-CE1 4.46Å
59	N	93.5	Very high	96.9	Very high	59 Å²	59	48.9 Å²	48.9	32%	0.316	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	-92.2	-164.8	-61.4	-38.2	0	0	0	111.8	V34	V34-N59 PolarHBondContact N-OD1 3.2Å; V34-N59 WeakPolarHBondContact O-CA 3.29Å; V34-N59 PolarHBondContact O-N 2.73Å
60	L	93.8	Very high	97	Very high	169 Å²	169	47.8 Å²	47.8	89%	0.885	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-127.8	3.5	178	-62	175.3	0	0	0	112.5	F58	F58-L60 PolarHBondContact O-N 2.91Å
61	E	95.9	Very high	97	Very high	122 Å²	122	47.5 Å²	47.5	57%	0.57	23%	0.232	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	117.8	-176.6	-173.2	171.5	-165.4	0	0	109.9	I57 F58 Y63 T77	I57-E61 CarbonylContact C-O 3.53Å; I57-E61 WeakPolarHBondContact CA-O 3.32Å; F58-E61 PolarHBondContact N-O 3.01Å; F58-E61 PolarHBondContact O-N 3.19Å; E61-Y63 PolarHBondContact O-N 2.87Å; E61-T77 HydrophobicContact CG-CG2 4.06Å; E61-T77 VanDerWaalsContact OE1-CG2 3.25Å; E61-T77 WeakPolarHBondContact OE1-CG2 3.42Å
62	E	97.2	Very high	97	Very high	37 Å²	37	46.6 Å²	46.6	17%	0.173	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	115.8	169.9	-172.2	-174.1	146.8	0	0	108.9	R55 F56 I57 H65 L76	R55-E62 HydrophobicContact CB-CG 4.08Å; R55-E62 VanDerWaalsContact CD-OE2 3.31Å; R55-E62 WeakPolarHBondContact CD-OE2 3.47Å; R55-E62 IonicContact CZ-OE2 3.99Å; R55-E62 IonicContact NE-OE2 3.67Å; R55-E62 IonicContact NH1-OE1 3.64Å; R55-E62 PolarHBondContact NH1-OE1 2.79Å; R55-E62 IonicContact NH1-OE2 3.38Å; R55-E62 PolarHBondContact NH1-OE2 3.11Å; F56-E62 WeakPolarHBondContact O-CA 3.5Å; I57-E62 HydrophobicContact CG1-CB 4.14Å; I57-E62 HydrophobicContact CG1-CG 4.32Å; E62-H65 WeakPolarHBondContact OE1-CB 3.34Å; E62-H65 IonicContact OE1-CG 3.65Å; E62-H65 IonicContact OE1-ND1 3.84Å; E62-H65 PolarHBondContact OE1-ND1 2.78Å; E62-L76 HydrophobicContact CB-CD1 4.02Å; E62-L76 HydrophobicContact CG-CD1 3.69Å; E62-L76 VanDerWaalsContact OE1-CD1 3.32Å; E62-L76 WeakPolarHBondContact OE1-CD1 3.24Å
63	Y	97.4	Very high	97	Very high	26 Å²	26	46.4 Å²	46.4	10%	0.102	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	-23.9	-174.3	74.6	-90.1	0	0	0	112.5	F56 F58 E61 L76 T77 L79 D83	F56-Y63 HydrophobicContact CB-CD1 4.18Å; F56-Y63 HydrophobicContact CB-CE1 3.51Å; F56-Y63 WeakPolarHBondContact O-CD1 3.43Å; F56-Y63 PolarHBondContact O-N 3.13Å; F58-Y63 HydrophobicContact CB-CD1 4.03Å; F58-Y63 HydrophobicContact CB-CE1 4.46Å; E61-Y63 PolarHBondContact O-N 2.87Å; Y63-L76 PolarHBondContact O-N 2.9Å; Y63-T77 WeakPolarHBondContact CB-OG1 3.46Å; Y63-T77 PolarHBondContact O-N 2.89Å; Y63-L79 HydrophobicContact CD2-CD2 4.3Å; Y63-L79 HydrophobicContact CD2-CG 4.21Å; Y63-L79 HydrophobicContact CG-CD2 4.21Å; Y63-D83 WeakPolarHBondContact CE2-OD2 3.45Å
64	L	97.8	Very high	97	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	147.4	-177.9	177	151.3	0	0	0	110.3	F56 F73 V74 G80 D83 A84 W87	F56-L64 HydrophobicContact CB-CD2 4.5Å; F56-L64 WeakPolarHBondContact CB-O 3.34Å; F56-L64 HydrophobicContact CD2-CD2 3.33Å; F56-L64 HydrophobicContact CE2-CD2 3.76Å; F56-L64 HydrophobicContact CG-CD2 4.12Å; F56-L64 PolarHBondContact N-O 2.84Å; L64-F73 HydrophobicContact CD2-CB 4.37Å; L64-F73 HydrophobicContact CD2-CD1 3.69Å; L64-F73 HydrophobicContact CD2-CE1 4.49Å; L64-F73 HydrophobicContact CD2-CG 4.45Å; L64-V74 WeakPolarHBondContact CA-O 3.45Å; L64-G80 WeakPolarHBondContact CD1-O 3.4Å; L64-D83 HydrophobicContact CD1-CB 3.58Å; L64-A84 HydrophobicContact CD1-CB 3.78Å; L64-W87 HydrophobicContact CD2-CE3 4.09Å; L64-W87 HydrophobicContact CD2-CZ3 3.7Å
65	H	98.2	Very high	97	Very high	25 Å²	25	48.7 Å²	48.7	12%	0.116	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	157.4	167.3	61.1	-112.3	0	0	0	113.5	L53 V54 R55 E62 F73 V74	L53-H65 HydrophobicContact CD1-CB 4.2Å; V54-H65 CarbonylContact O-C 3.55Å; V54-H65 WeakPolarHBondContact O-CA 3.28Å; V54-H65 WeakPolarHBondContact O-CB 3.19Å; R55-H65 HydrophobicContact CG-CB 4.44Å; E62-H65 WeakPolarHBondContact OE1-CB 3.34Å; E62-H65 IonicContact OE1-CG 3.65Å; E62-H65 IonicContact OE1-ND1 3.84Å; E62-H65 PolarHBondContact OE1-ND1 2.78Å; H65-F73 CarbonylContact O-C 3.47Å; H65-F73 VanDerWaalsContact O-CA 3.26Å; H65-F73 WeakPolarHBondContact O-CA 3.31Å; H65-V74 PolarHBondContact N-O 3.22Å; H65-V74 PolarHBondContact O-N 3.14Å
66	F	98.3	Very high	97	Very high	1 Å²	1	49.8 Å²	49.8	0%	0.004	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	127.7	161.8	177.5	-95.8	0	0	0	109.8	F52 L53 V54 F73 L94 S97 R98	F52-F66 HydrophobicContact CD1-CD1 4.05Å; F52-F66 HydrophobicContact CD1-CE1 4.14Å; F52-F66 HydrophobicContact CE1-CD1 4.39Å; L53-F66 WeakPolarHBondContact CA-O 3.1Å; L53-F66 WeakPolarHBondContact CD1-O 3.39Å; V54-F66 HydrophobicContact CB-CB 4.43Å; V54-F66 PolarHBondContact N-O 3.47Å; V54-F66 PolarHBondContact O-N 2.78Å; F66-F73 HydrophobicContact CB-CD1 3.6Å; F66-F73 HydrophobicContact CB-CE1 3.55Å; F66-F73 HydrophobicContact CB-CG 4.31Å; F66-F73 HydrophobicContact CB-CZ 4.19Å; F66-F73 HydrophobicContact CD2-CD1 4.24Å; F66-F73 HydrophobicContact CD2-CD2 4.09Å; F66-F73 HydrophobicContact CD2-CE1 4.21Å; F66-F73 HydrophobicContact CD2-CE2 4.01Å; F66-F73 HydrophobicContact CD2-CG 4.21Å; F66-F73 HydrophobicContact CD2-CZ 4.08Å; F66-F73 HydrophobicContact CG-CD1 4.41Å; F66-F73 HydrophobicContact CG-CE1 4.25Å; F66-F73 HydrophobicContact CG-CZ 4.42Å; F66-L94 HydrophobicContact CE2-CD2 4.31Å; F66-S97 VanDerWaalsContact CE1-O 3.26Å; F66-S97 WeakPolarHBondContact CE1-O 3.31Å; F66-S97 VanDerWaalsContact CE2-CB 3.49Å; F66-S97 VanDerWaalsContact CZ-C 3.48Å; F66-R98 HydrophobicContact CZ-CG 3.97Å
67	D	97.9	Very high	96.9	Very high	10 Å²	10	49.2 Å²	49.2	5%	0.053	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	122.6	173.6	-170.6	-14	0	0	0	110.3	R51 L53 D69 L70 G71 L72	R51-D67 IonicContact CZ-OD1 2.99Å; R51-D67 IonicContact CZ-OD2 3.77Å; R51-D67 IonicContact NE-OD1 2.65Å; R51-D67 PolarHBondContact NE-OD1 2.83Å; R51-D67 IonicContact NE-OD2 3.83Å; R51-D67 PolarHBondContact NE-OD2 2.82Å; R51-D67 IonicContact NH2-OD1 2.7Å; R51-D67 IonicContact NH2-OD2 3.21Å; R51-D67 PolarHBondContact NH2-OD2 2.84Å; L53-D67 HydrophobicContact CD1-CB 3.95Å; D67-D69 PolarHBondContact O-N 2.91Å; D67-D69 WeakPolarHBondContact OD1-CB 3.4Å; D67-D69 PolarHBondContact OD1-N 2.8Å; D67-L70 HydrophobicContact CB-CB 4.28Å; D67-L70 HydrophobicContact CB-CD1 4.14Å; D67-L70 HydrophobicContact CB-CG 4.14Å; D67-L70 CarbonylContact O-C 3.6Å; D67-L70 PolarHBondContact O-N 3.04Å; D67-L70 VanDerWaalsContact O-N 3.15Å; D67-G71 PolarHBondContact O-N 2.84Å; D67-L72 PolarHBondContact N-O 3.09Å
68	S	97.3	Very high	96.7	Very high	24 Å²	24	56.6 Å²	56.6	17%	0.168	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-28	178.2	65.6	0	0	0	0	113.7	R51 F52 L70 G71	R51-S68 WeakPolarHBondContact CA-OG 3.2Å; F52-S68 PolarHBondContact N-OG 2.7Å; F52-S68 WeakPolarHBondContact O-CB 3.43Å; F52-S68 PolarHBondContact O-N 2.81Å; F52-S68 PolarHBondContact O-OG 3.28Å; S68-L70 VanDerWaalsContact C-N 3.25Å; S68-L70 PolarHBondContact O-N 3.18Å; S68-G71 PolarHBondContact O-N 3.34Å
69	D	96.7	Very high	96.5	Very high	91 Å²	91	57.9 Å²	57.9	49%	0.487	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-29.3	178.4	-73.6	-2.6	0	0	0	110.9	R51 D67	R51-D69 WeakPolarHBondContact CD-OD2 3.33Å; R51-D69 IonicContact NE-OD2 3.52Å; D67-D69 PolarHBondContact O-N 2.91Å; D67-D69 WeakPolarHBondContact OD1-CB 3.4Å; D67-D69 PolarHBondContact OD1-N 2.8Å
70	L	96.9	Very high	96.6	Very high	105 Å²	105	55.1 Å²	55.1	55%	0.55	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-28.9	173.6	-58	179	0	0	0	112.1	D67 S68 L72 V74	D67-L70 HydrophobicContact CB-CB 4.28Å; D67-L70 HydrophobicContact CB-CD1 4.14Å; D67-L70 HydrophobicContact CB-CG 4.14Å; D67-L70 CarbonylContact O-C 3.6Å; D67-L70 PolarHBondContact O-N 3.04Å; D67-L70 VanDerWaalsContact O-N 3.15Å; S68-L70 VanDerWaalsContact C-N 3.25Å; S68-L70 PolarHBondContact O-N 3.18Å; L70-L72 VanDerWaalsContact C-N 3.32Å; L70-L72 HydrophobicContact CB-CG 4.31Å; L70-L72 PolarHBondContact O-N 3.4Å; L70-V74 HydrophobicContact CD1-CG2 3.62Å
71	G	96.7	Very high	96.8	Very high	9 Å²	9	53 Å²	53	9%	0.093	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.6	23.1	-178.1	0	0	0	0	0	114.2	D67 S68 R98	D67-G71 PolarHBondContact O-N 2.84Å; S68-G71 PolarHBondContact O-N 3.34Å; G71-R98 VanDerWaalsContact O-CZ 3.27Å; G71-R98 PolarHBondContact O-NE 2.96Å; G71-R98 PolarHBondContact O-NH2 2.96Å
72	L	97.6	Very high	96.8	Very high	69 Å²	69	52 Å²	52	36%	0.361	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	166.2	-179.1	60.5	82.8	0	0	0	112.3	D67 L70 V74 N88 L94	D67-L72 PolarHBondContact N-O 3.09Å; L70-L72 VanDerWaalsContact C-N 3.32Å; L70-L72 HydrophobicContact CB-CG 4.31Å; L70-L72 PolarHBondContact O-N 3.4Å; L72-V74 HydrophobicContact CD1-CG2 3.64Å; L72-N88 WeakPolarHBondContact CB-OD1 3.35Å; L72-L94 HydrophobicContact CB-CD2 4.26Å
73	F	98	Very high	96.7	Very high	10 Å²	10	52.2 Å²	52.2	4%	0.044	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	131.9	174.3	-63.6	-89.1	0	0	0	110.7	F56 L64 H65 F66 A84 W87 N88 L94 S97	F56-F73 HydrophobicContact CE2-CD1 4.43Å; F56-F73 HydrophobicContact CE2-CE1 4.08Å; L64-F73 HydrophobicContact CD2-CB 4.37Å; L64-F73 HydrophobicContact CD2-CD1 3.69Å; L64-F73 HydrophobicContact CD2-CE1 4.49Å; L64-F73 HydrophobicContact CD2-CG 4.45Å; H65-F73 CarbonylContact O-C 3.47Å; H65-F73 VanDerWaalsContact O-CA 3.26Å; H65-F73 WeakPolarHBondContact O-CA 3.31Å; F66-F73 HydrophobicContact CB-CD1 3.6Å; F66-F73 HydrophobicContact CB-CE1 3.55Å; F66-F73 HydrophobicContact CB-CG 4.31Å; F66-F73 HydrophobicContact CB-CZ 4.19Å; F66-F73 HydrophobicContact CD2-CD1 4.24Å; F66-F73 HydrophobicContact CD2-CD2 4.09Å; F66-F73 HydrophobicContact CD2-CE1 4.21Å; F66-F73 HydrophobicContact CD2-CE2 4.01Å; F66-F73 HydrophobicContact CD2-CG 4.21Å; F66-F73 HydrophobicContact CD2-CZ 4.08Å; F66-F73 HydrophobicContact CG-CD1 4.41Å; F66-F73 HydrophobicContact CG-CE1 4.25Å; F66-F73 HydrophobicContact CG-CZ 4.42Å; F73-A84 HydrophobicContact CB-CB 4.48Å; F73-W87 AromaticContact CD1-CE3 3.6Å; F73-W87 HydrophobicContact CD1-CE3 3.6Å; F73-W87 HydrophobicContact CD1-CZ3 4.08Å; F73-W87 HydrophobicContact CD2-CB 3.85Å; F73-W87 HydrophobicContact CD2-CE3 4.41Å; F73-W87 AromaticContact CE1-CE3 3.47Å; F73-W87 HydrophobicContact CE1-CE3 3.47Å; F73-W87 VanDerWaalsContact CE1-CE3 3.47Å; F73-W87 AromaticContact CE1-CZ3 3.83Å; F73-W87 HydrophobicContact CE1-CZ3 3.83Å; F73-W87 HydrophobicContact CE2-CB 4.1Å; F73-W87 HydrophobicContact CE2-CE3 4.34Å; F73-W87 HydrophobicContact CG-CB 4.29Å; F73-W87 HydrophobicContact CG-CE3 4.07Å; F73-W87 AromaticContact CZ-CE3 3.88Å; F73-W87 HydrophobicContact CZ-CE3 3.88Å; F73-N88 PolarHBondContact N-OD1 3.1Å; F73-N88 PolarHBondContact O-ND2 3.27Å; F73-L94 HydrophobicContact CD2-CD2 3.92Å; F73-L94 HydrophobicContact CE2-CD2 4.07Å; F73-S97 WeakPolarHBondContact CZ-OG 3.46Å
74	V	98.1	Very high	96.7	Very high	42 Å²	42	51.4 Å²	51.4	26%	0.255	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	126.2	-180	-176.8	0	0	0	0	108.6	L64 H65 L70 L72	L64-V74 WeakPolarHBondContact CA-O 3.45Å; H65-V74 PolarHBondContact N-O 3.22Å; H65-V74 PolarHBondContact O-N 3.14Å; L70-V74 HydrophobicContact CD1-CG2 3.62Å; L72-V74 HydrophobicContact CD1-CG2 3.64Å
75	A	97.7	Very high	96.6	Very high	31 Å²	31	55.6 Å²	55.6	26%	0.256	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	137.7	171.4	0	0	0	0	0	110.4	G80 E81 A84	A75-G80 WeakPolarHBondContact CB-O 3.37Å; A75-E81 HydrophobicContact CB-CB 4.48Å; A75-E81 HydrophobicContact CB-CG 4.05Å; A75-A84 HydrophobicContact CB-CB 3.98Å
76	L	97.1	Very high	96.5	Very high	90 Å²	90	59.3 Å²	59.3	47%	0.471	32%	0.318	S	S	.	.	S	Bend	trans	-104.2	-21.7	173	-65.6	-177.9	0	0	0	112.5	E62 Y63	E62-L76 HydrophobicContact CB-CD1 4.02Å; E62-L76 HydrophobicContact CG-CD1 3.69Å; E62-L76 VanDerWaalsContact OE1-CD1 3.32Å; E62-L76 WeakPolarHBondContact OE1-CD1 3.24Å; Y63-L76 PolarHBondContact O-N 2.9Å
77	T	95.7	Very high	96.4	Very high	29 Å²	29	61.1 Å²	61.1	18%	0.178	32%	0.324	C	S	.	.	S	Bend	trans	-135.3	166.4	-179	72.2	0	0	0	0	110.5	E61 Y63 L79 G80 E81	E61-T77 HydrophobicContact CG-CG2 4.06Å; E61-T77 VanDerWaalsContact OE1-CG2 3.25Å; E61-T77 WeakPolarHBondContact OE1-CG2 3.42Å; Y63-T77 WeakPolarHBondContact CB-OG1 3.46Å; Y63-T77 PolarHBondContact O-N 2.89Å; T77-L79 PolarHBondContact O-N 2.95Å; T77-G80 PolarHBondContact O-N 2.76Å; T77-E81 PolarHBondContact O-N 2.9Å
78	E	93.8	Very high	96.4	Very high	168 Å²	168	63 Å²	63	79%	0.785	33%	0.334	S	S	*	.	H	α-helix	trans	-56.8	-33.6	177.6	-63.5	-175.7	175.6	0	0	112.5	G80 E81	E78-G80 VanDerWaalsContact C-N 3.28Å; E78-G80 PolarHBondContact O-N 3.24Å; E78-E81 PolarHBondContact O-N 2.88Å
79	L	91.3	Very high	96.4	Very high	99 Å²	99	69 Å²	69	52%	0.518	36%	0.357	S	S	.	.	H	α-helix	trans	-61	-39.1	175.3	-179.5	65.1	0	0	0	111.6	Y63 T77	Y63-L79 HydrophobicContact CD2-CD2 4.3Å; Y63-L79 HydrophobicContact CD2-CG 4.21Å; Y63-L79 HydrophobicContact CG-CD2 4.21Å; T77-L79 PolarHBondContact O-N 2.95Å
80	G	95.9	Very high	96.5	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-77	-18.4	-178.2	0	0	0	0	0	114.7	L64 A75 T77 E78 V82 D83 A84	L64-G80 WeakPolarHBondContact CD1-O 3.4Å; A75-G80 WeakPolarHBondContact CB-O 3.37Å; T77-G80 PolarHBondContact O-N 2.76Å; E78-G80 VanDerWaalsContact C-N 3.28Å; E78-G80 PolarHBondContact O-N 3.24Å; G80-V82 VanDerWaalsContact C-N 3.33Å; G80-V82 PolarHBondContact O-N 3.36Å; G80-D83 PolarHBondContact O-N 2.81Å; G80-A84 VanDerWaalsContact O-CB 3.29Å; G80-A84 WeakPolarHBondContact O-CB 3.48Å; G80-A84 PolarHBondContact O-N 3.42Å
81	E	97.1	Very high	96.4	Very high	124 Å²	124	69.3 Å²	69.3	58%	0.579	35%	0.351	S	S	*	.	H	α-helix	trans	-61.6	-42.8	-175.7	-68.6	-170.7	171.8	0	0	112.2	A75 T77 E78 A84 D85	A75-E81 HydrophobicContact CB-CB 4.48Å; A75-E81 HydrophobicContact CB-CG 4.05Å; T77-E81 PolarHBondContact O-N 2.9Å; E78-E81 PolarHBondContact O-N 2.88Å; E81-A84 PolarHBondContact O-N 3.2Å; E81-D85 WeakPolarHBondContact O-CB 3.15Å; E81-D85 PolarHBondContact O-N 2.84Å
82	V	95.4	Very high	96.3	Very high	103 Å²	103	73.4 Å²	73.4	62%	0.624	37%	0.371	S	S	*	.	H	α-helix	trans	-64.2	-46.3	179.5	-178	0	0	0	0	110.7	G80 Q86	G80-V82 VanDerWaalsContact C-N 3.33Å; G80-V82 PolarHBondContact O-N 3.36Å; V82-Q86 WeakPolarHBondContact O-CB 3.15Å; V82-Q86 PolarHBondContact O-N 2.94Å
83	D	95.6	Very high	96.2	Very high	41 Å²	41	72.5 Å²	72.5	22%	0.219	37%	0.367	C	S	.	.	H	α-helix	trans	-66.1	-44.2	179.2	-79.1	-17	0	0	0	111.3	Y63 L64 G80 Q86 W87	Y63-D83 WeakPolarHBondContact CE2-OD2 3.45Å; L64-D83 HydrophobicContact CD1-CB 3.58Å; G80-D83 PolarHBondContact O-N 2.81Å; D83-Q86 PolarHBondContact O-N 3.21Å; D83-W87 HydrophobicContact CB-CZ2 4.44Å; D83-W87 VanDerWaalsContact O-CB 3.24Å; D83-W87 WeakPolarHBondContact O-CB 3.37Å; D83-W87 PolarHBondContact O-N 3.38Å
84	A	97.3	Very high	96.1	Very high	8 Å²	8	72.7 Å²	72.7	7%	0.066	37%	0.368	C	S	.	.	H	α-helix	trans	-63.1	-46.4	179.6	0	0	0	0	0	111.5	L64 F73 A75 G80 E81 Q86 W87 N88	L64-A84 HydrophobicContact CD1-CB 3.78Å; F73-A84 HydrophobicContact CB-CB 4.48Å; A75-A84 HydrophobicContact CB-CB 3.98Å; G80-A84 VanDerWaalsContact O-CB 3.29Å; G80-A84 WeakPolarHBondContact O-CB 3.48Å; G80-A84 PolarHBondContact O-N 3.42Å; E81-A84 PolarHBondContact O-N 3.2Å; A84-Q86 PolarHBondContact O-N 2.75Å; A84-W87 PolarHBondContact O-N 2.83Å; A84-N88 WeakPolarHBondContact O-CB 3.34Å; A84-N88 PolarHBondContact O-N 3.27Å; A84-N88 PolarHBondContact O-ND2 2.72Å
85	D	96.3	Very high	96	Very high	89 Å²	89	76 Å²	76	48%	0.476	38%	0.38	S	S	.	.	H	α-helix	trans	-61.1	-44.1	176.7	177.9	65.6	0	0	0	111.4	E81 K89	E81-D85 WeakPolarHBondContact O-CB 3.15Å; E81-D85 PolarHBondContact O-N 2.84Å; D85-K89 WeakPolarHBondContact O-CD 3.37Å; D85-K89 VanDerWaalsContact O-CG 3.31Å; D85-K89 WeakPolarHBondContact O-CG 3.48Å; D85-K89 PolarHBondContact O-N 3.41Å; D85-K89 WeakPolarHBondContact OD1-CE 3.46Å; D85-K89 IonicContact OD1-NZ 2.83Å; D85-K89 PolarHBondContact OD1-NZ 3.39Å; D85-K89 IonicContact OD2-NZ 2.62Å; D85-K89 PolarHBondContact OD2-NZ 3.27Å
86	Q	95.8	Very high	95.9	Very high	103 Å²	103	78.3 Å²	78.3	48%	0.481	39%	0.392	S	S	.	.	H	α-helix	trans	-67.6	-44.2	179	-172.3	179	9.9	0	0	112.3	V82 D83 A84 K89	V82-Q86 WeakPolarHBondContact O-CB 3.15Å; V82-Q86 PolarHBondContact O-N 2.94Å; D83-Q86 PolarHBondContact O-N 3.21Å; A84-Q86 PolarHBondContact O-N 2.75Å; Q86-K89 PolarHBondContact O-N 3.46Å
87	W	97.1	Very high	95.8	Very high	39 Å²	39	75 Å²	75	15%	0.148	38%	0.377	C	S	.	.	H	α-helix	trans	-75.6	-33.4	-174.9	-66.1	12.7	0	0	0	111.8	F56 L64 F73 D83 A84 K89 R90 L93	F56-W87 HydrophobicContact CD1-CH2 4.23Å; F56-W87 HydrophobicContact CD1-CZ3 4.46Å; F56-W87 HydrophobicContact CD2-CZ3 4.21Å; F56-W87 AromaticContact CE1-CH2 3.91Å; F56-W87 HydrophobicContact CE1-CH2 3.91Å; F56-W87 AromaticContact CE1-CZ3 4Å; F56-W87 HydrophobicContact CE1-CZ3 4Å; F56-W87 HydrophobicContact CE2-CH2 4.4Å; F56-W87 AromaticContact CE2-CZ3 3.71Å; F56-W87 HydrophobicContact CE2-CZ3 3.71Å; F56-W87 AromaticContact CZ-CH2 4Å; F56-W87 HydrophobicContact CZ-CH2 4Å; F56-W87 AromaticContact CZ-CZ3 3.59Å; F56-W87 HydrophobicContact CZ-CZ3 3.59Å; L64-W87 HydrophobicContact CD2-CE3 4.09Å; L64-W87 HydrophobicContact CD2-CZ3 3.7Å; F73-W87 AromaticContact CD1-CE3 3.6Å; F73-W87 HydrophobicContact CD1-CE3 3.6Å; F73-W87 HydrophobicContact CD1-CZ3 4.08Å; F73-W87 HydrophobicContact CD2-CB 3.85Å; F73-W87 HydrophobicContact CD2-CE3 4.41Å; F73-W87 AromaticContact CE1-CE3 3.47Å; F73-W87 HydrophobicContact CE1-CE3 3.47Å; F73-W87 VanDerWaalsContact CE1-CE3 3.47Å; F73-W87 AromaticContact CE1-CZ3 3.83Å; F73-W87 HydrophobicContact CE1-CZ3 3.83Å; F73-W87 HydrophobicContact CE2-CB 4.1Å; F73-W87 HydrophobicContact CE2-CE3 4.34Å; F73-W87 HydrophobicContact CG-CB 4.29Å; F73-W87 HydrophobicContact CG-CE3 4.07Å; F73-W87 AromaticContact CZ-CE3 3.88Å; F73-W87 HydrophobicContact CZ-CE3 3.88Å; D83-W87 HydrophobicContact CB-CZ2 4.44Å; D83-W87 VanDerWaalsContact O-CB 3.24Å; D83-W87 WeakPolarHBondContact O-CB 3.37Å; D83-W87 PolarHBondContact O-N 3.38Å; A84-W87 PolarHBondContact O-N 2.83Å; W87-K89 PolarHBondContact O-N 2.61Å; W87-R90 PolarHBondContact O-N 2.82Å; W87-R90 VanDerWaalsContact O-N 3.08Å; W87-L93 HydrophobicContact CG-CD1 4.38Å
88	N	97.6	Very high	95.8	Very high	49 Å²	49	79 Å²	79	26%	0.262	39%	0.388	S	S	.	.	H	α-helix	trans	-68.6	-20	173.8	-72.4	-31.4	0	0	0	113.3	L72 F73 A84 L94	L72-N88 WeakPolarHBondContact CB-OD1 3.35Å; F73-N88 PolarHBondContact N-OD1 3.1Å; F73-N88 PolarHBondContact O-ND2 3.27Å; A84-N88 WeakPolarHBondContact O-CB 3.34Å; A84-N88 PolarHBondContact O-N 3.27Å; A84-N88 PolarHBondContact O-ND2 2.72Å; N88-L94 WeakPolarHBondContact O-CD1 2.92Å
89	K	97.2	Very high	96	Very high	150 Å²	150	73.1 Å²	73.1	65%	0.652	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-15.2	171.8	-71.3	167.8	-174.3	165.6	0	113	D85 Q86 W87 L91	D85-K89 WeakPolarHBondContact O-CD 3.37Å; D85-K89 VanDerWaalsContact O-CG 3.31Å; D85-K89 WeakPolarHBondContact O-CG 3.48Å; D85-K89 PolarHBondContact O-N 3.41Å; D85-K89 WeakPolarHBondContact OD1-CE 3.46Å; D85-K89 IonicContact OD1-NZ 2.83Å; D85-K89 PolarHBondContact OD1-NZ 3.39Å; D85-K89 IonicContact OD2-NZ 2.62Å; D85-K89 PolarHBondContact OD2-NZ 3.27Å; Q86-K89 PolarHBondContact O-N 3.46Å; W87-K89 PolarHBondContact O-N 2.61Å; K89-L91 PolarHBondContact O-N 2.78Å
90	R	97.5	Very high	96.2	Very high	100 Å²	100	68.7 Å²	68.7	38%	0.377	35%	0.346	S	S	.	.			trans	-89.9	98.8	177.8	-76.4	-160	-68	-169.3	-3.1	110.8	W87 D92 L93 L94	W87-R90 PolarHBondContact O-N 2.82Å; W87-R90 VanDerWaalsContact O-N 3.08Å; R90-D92 VanDerWaalsContact C-N 3.3Å; R90-D92 WeakPolarHBondContact CB-OD1 2.99Å; R90-D92 PolarHBondContact O-N 3.4Å; R90-L93 HydrophobicContact CB-CB 4.14Å; R90-L93 HydrophobicContact CB-CD1 4.34Å; R90-L93 HydrophobicContact CB-CG 4.13Å; R90-L93 PolarHBondContact O-N 3.01Å; R90-L94 PolarHBondContact O-N 2.74Å; R90-L94 VanDerWaalsContact O-N 3.09Å
91	L	95.3	Very high	96.2	Very high	102 Å²	102	69.7 Å²	69.7	53%	0.534	35%	0.352	S	S	.	.	H	α-helix	trans	-61	-38.9	-177.6	-174.7	64	0	0	0	112.3	K89 L93 L94 E95	K89-L91 PolarHBondContact O-N 2.78Å; L91-L93 VanDerWaalsContact C-N 3.32Å; L91-L93 PolarHBondContact O-N 2.96Å; L91-L94 PolarHBondContact O-N 2.95Å; L91-E95 HydrophobicContact CD1-CG 4Å; L91-E95 HydrophobicContact CG-CG 4.13Å; L91-E95 WeakPolarHBondContact O-CB 3.3Å; L91-E95 WeakPolarHBondContact O-CG 3.34Å; L91-E95 PolarHBondContact O-N 2.95Å
92	D	96	Very high	96.1	Very high	96 Å²	96	68.7 Å²	68.7	51%	0.513	35%	0.35	S	S	.	.	H	α-helix	trans	-57.1	-43.4	176.6	59.6	-49.1	0	0	0	112.3	R90 T96	R90-D92 VanDerWaalsContact C-N 3.3Å; R90-D92 WeakPolarHBondContact CB-OD1 2.99Å; R90-D92 PolarHBondContact O-N 3.4Å; D92-T96 VanDerWaalsContact O-CB 3.32Å; D92-T96 WeakPolarHBondContact O-CB 3.45Å; D92-T96 PolarHBondContact O-N 3.25Å; D92-T96 VanDerWaalsContact O-N 3.08Å; D92-T96 PolarHBondContact O-OG1 2.92Å
93	L	95	Very high	95.8	Very high	50 Å²	50	69.1 Å²	69.1	26%	0.262	35%	0.347	S	S	.	.	H	α-helix	trans	-71.5	-43	177.2	-70.8	-165	0	0	0	112.6	W87 R90 L91 T96 S97	W87-L93 HydrophobicContact CG-CD1 4.38Å; R90-L93 HydrophobicContact CB-CB 4.14Å; R90-L93 HydrophobicContact CB-CD1 4.34Å; R90-L93 HydrophobicContact CB-CG 4.13Å; R90-L93 PolarHBondContact O-N 3.01Å; L91-L93 VanDerWaalsContact C-N 3.32Å; L91-L93 PolarHBondContact O-N 2.96Å; L93-T96 PolarHBondContact O-N 2.73Å; L93-S97 VanDerWaalsContact O-CB 3.26Å; L93-S97 WeakPolarHBondContact O-CB 3.42Å; L93-S97 PolarHBondContact O-N 3.3Å; L93-S97 PolarHBondContact O-OG 3.28Å
94	L	95.8	Very high	95.7	Very high	13 Å²	13	69.6 Å²	69.6	7%	0.068	35%	0.352	C	S	.	.	H	α-helix	trans	-63.5	-44.8	178.5	-81	179.4	0	0	0	111.8	F66 L72 F73 N88 R90 L91 S97 R98	F66-L94 HydrophobicContact CE2-CD2 4.31Å; L72-L94 HydrophobicContact CB-CD2 4.26Å; F73-L94 HydrophobicContact CD2-CD2 3.92Å; F73-L94 HydrophobicContact CE2-CD2 4.07Å; N88-L94 WeakPolarHBondContact O-CD1 2.92Å; R90-L94 PolarHBondContact O-N 2.74Å; R90-L94 VanDerWaalsContact O-N 3.09Å; L91-L94 PolarHBondContact O-N 2.95Å; L94-S97 PolarHBondContact O-N 3.02Å; L94-R98 WeakPolarHBondContact O-CB 3.38Å; L94-R98 WeakPolarHBondContact O-CD 3.43Å; L94-R98 WeakPolarHBondContact O-CG 3.36Å; L94-R98 PolarHBondContact O-N 3.28Å
95	E	95.7	Very high	95.5	Very high	111 Å²	111	69.2 Å²	69.2	52%	0.519	35%	0.348	S	S	.	.	H	α-helix	trans	-63.4	-44.8	177.8	-73.7	-178	172.7	0	0	111.3	L91 S97 R98 A99	L91-E95 HydrophobicContact CD1-CG 4Å; L91-E95 HydrophobicContact CG-CG 4.13Å; L91-E95 WeakPolarHBondContact O-CB 3.3Å; L91-E95 WeakPolarHBondContact O-CG 3.34Å; L91-E95 PolarHBondContact O-N 2.95Å; E95-S97 PolarHBondContact O-N 2.86Å; E95-R98 PolarHBondContact O-N 3.35Å; E95-A99 VanDerWaalsContact O-CB 3.29Å; E95-A99 WeakPolarHBondContact O-CB 3.48Å; E95-A99 PolarHBondContact O-N 3.09Å
96	T	95.1	Very high	95.4	Very high	80 Å²	80	68.2 Å²	68.2	49%	0.491	34%	0.338	S	S	.	.	H	α-helix	trans	-62	-43.6	176	-57.1	0	0	0	0	111.4	D92 L93 A99 A100	D92-T96 VanDerWaalsContact O-CB 3.32Å; D92-T96 WeakPolarHBondContact O-CB 3.45Å; D92-T96 PolarHBondContact O-N 3.25Å; D92-T96 VanDerWaalsContact O-N 3.08Å; D92-T96 PolarHBondContact O-OG1 2.92Å; L93-T96 PolarHBondContact O-N 2.73Å; T96-A99 PolarHBondContact O-N 3.32Å; T96-A100 PolarHBondContact O-N 2.85Å
97	S	95.5	Very high	94.9	Very high	22 Å²	22	67.4 Å²	67.4	15%	0.154	33%	0.334	C	S	.	.	H	α-helix	trans	-67	-37.9	179.8	-55.7	0	0	0	0	112	F66 F73 L93 L94 E95 A100	F66-S97 VanDerWaalsContact CE1-O 3.26Å; F66-S97 WeakPolarHBondContact CE1-O 3.31Å; F66-S97 VanDerWaalsContact CE2-CB 3.49Å; F66-S97 VanDerWaalsContact CZ-C 3.48Å; F73-S97 WeakPolarHBondContact CZ-OG 3.46Å; L93-S97 VanDerWaalsContact O-CB 3.26Å; L93-S97 WeakPolarHBondContact O-CB 3.42Å; L93-S97 PolarHBondContact O-N 3.3Å; L93-S97 PolarHBondContact O-OG 3.28Å; L94-S97 PolarHBondContact O-N 3.02Å; E95-S97 PolarHBondContact O-N 2.86Å; S97-A100 WeakPolarHBondContact O-CB 3.12Å; S97-A100 PolarHBondContact O-N 3.38Å
98	R	96.3	Very high	94.4	Very high	113 Å²	113	70.5 Å²	70.5	43%	0.426	35%	0.35	S	S	.	.	H	α-helix	trans	-66.6	-39.1	172.3	-70.6	165.6	-173.2	157.6	1.3	111.6	F66 G71 L94 E95 A100	F66-R98 HydrophobicContact CZ-CG 3.97Å; G71-R98 VanDerWaalsContact O-CZ 3.27Å; G71-R98 PolarHBondContact O-NE 2.96Å; G71-R98 PolarHBondContact O-NH2 2.96Å; L94-R98 WeakPolarHBondContact O-CB 3.38Å; L94-R98 WeakPolarHBondContact O-CD 3.43Å; L94-R98 WeakPolarHBondContact O-CG 3.36Å; L94-R98 PolarHBondContact O-N 3.28Å; E95-R98 PolarHBondContact O-N 3.35Å; R98-A100 PolarHBondContact O-N 3.12Å
99	A	96.6	Very high	93.9	Very high	44 Å²	44	72 Å²	72	36%	0.364	35%	0.353	S	S	.	.	H	α-helix	trans	-67.5	-23.5	177.7	0	0	0	0	0	112.8	E95 T96 V101 N102 M103	E95-A99 VanDerWaalsContact O-CB 3.29Å; E95-A99 WeakPolarHBondContact O-CB 3.48Å; E95-A99 PolarHBondContact O-N 3.09Å; T96-A99 PolarHBondContact O-N 3.32Å; A99-V101 PolarHBondContact O-N 2.82Å; A99-V101 VanDerWaalsContact O-N 3.1Å; A99-N102 PolarHBondContact O-N 2.88Å; A99-M103 HydrophobicContact CB-SD 4.1Å; A99-M103 WeakPolarHBondContact O-CG 3.49Å; A99-M103 PolarHBondContact O-N 3.46Å
100	A	96.1	Very high	93.2	Very high	6 Å²	6	71.4 Å²	71.4	5%	0.05	35%	0.35	C	S	.	.	H	α-helix	trans	-52.6	-31.5	-180	0	0	0	0	0	114	F52 T96 S97 R98 N102 V104 C105	F52-A100 HydrophobicContact CD1-CB 3.46Å; F52-A100 VanDerWaalsContact CD1-CB 3.46Å; F52-A100 HydrophobicContact CE1-CB 3.22Å; F52-A100 HydrophobicContact CE2-CB 4.4Å; F52-A100 HydrophobicContact CG-CB 4.14Å; F52-A100 HydrophobicContact CZ-CB 3.72Å; T96-A100 PolarHBondContact O-N 2.85Å; S97-A100 WeakPolarHBondContact O-CB 3.12Å; S97-A100 PolarHBondContact O-N 3.38Å; R98-A100 PolarHBondContact O-N 3.12Å; A100-N102 PolarHBondContact O-N 3.1Å; A100-V104 HydrophobicContact CB-CG2 4.3Å; A100-V104 WeakPolarHBondContact O-CA 3.24Å; A100-V104 VanDerWaalsContact O-CB 3.28Å; A100-V104 WeakPolarHBondContact O-CB 3.4Å; A100-V104 PolarHBondContact O-N 3.17Å; A100-C105 PolarHBondContact O-N 3.38Å; A100-C105 VanDerWaalsContact O-N 3.12Å
101	V	96.3	Very high	92.4	Very high	20 Å²	20	71.1 Å²	71.1	12%	0.121	36%	0.356	C	S	.	.	I	π-helix	trans	-54.1	-43.6	173.5	177.1	0	0	0	0	111.4	V50 F52 A99 C105 R106	V50-V101 HydrophobicContact CB-CG1 3.87Å; V50-V101 HydrophobicContact CG1-CG1 3.9Å; F52-V101 HydrophobicContact CB-CG2 3.79Å; A99-V101 PolarHBondContact O-N 2.82Å; A99-V101 VanDerWaalsContact O-N 3.1Å; V101-C105 WeakPolarHBondContact O-CB 3.36Å; V101-R106 WeakPolarHBondContact O-CG 3.22Å; V101-R106 PolarHBondContact O-N 3Å
102	N	94.1	Very high	91.8	Very high	103 Å²	103	67 Å²	67	55%	0.551	34%	0.338	S	S	*	.	I	π-helix	trans	-89.5	-44.8	-177.5	-67.7	-31.8	0	0	0	112.3	A99 A100 R106	A99-N102 PolarHBondContact O-N 2.88Å; A100-N102 PolarHBondContact O-N 3.1Å; N102-R106 WeakPolarHBondContact OD1-CD 3.02Å; N102-R106 PolarHBondContact OD1-NE 2.95Å
103	M	90.8	Very high	91.1	Very high	112 Å²	112	64.2 Å²	64.2	55%	0.552	33%	0.328	S	S	*	.	I	π-helix	trans	-77	-29.4	-174.4	67	-175.6	-85	0	0	113.2	A99 Q107	A99-M103 HydrophobicContact CB-SD 4.1Å; A99-M103 WeakPolarHBondContact O-CG 3.49Å; A99-M103 PolarHBondContact O-N 3.46Å; M103-Q107 WeakPolarHBondContact O-CB 3.38Å
104	V	92.2	Very high	90.6	Very high	52 Å²	52	62.6 Å²	62.6	32%	0.315	32%	0.321	S	S	.	.	I	π-helix	trans	-104.2	-73	177.3	-173.5	0	0	0	0	109.2	A100 R106 Q107 E108	A100-V104 HydrophobicContact CB-CG2 4.3Å; A100-V104 WeakPolarHBondContact O-CA 3.24Å; A100-V104 VanDerWaalsContact O-CB 3.28Å; A100-V104 WeakPolarHBondContact O-CB 3.4Å; A100-V104 PolarHBondContact O-N 3.17Å; V104-R106 PolarHBondContact O-N 2.59Å; V104-Q107 PolarHBondContact O-N 2.58Å; V104-E108 HydrophobicContact CG1-CG 4.16Å; V104-E108 WeakPolarHBondContact O-CB 3.48Å; V104-E108 WeakPolarHBondContact O-CG 3.38Å; V104-E108 PolarHBondContact O-N 2.96Å
105	C	94.1	Very high	90.2	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.33	C	S	.	.	I	π-helix	trans	-59.5	-51.6	-166.2	-61.9	0	0	0	0	113.6	C41 F43 V50 F52 A100 V101 Q107 E108 Y109	C41-C105 HydrophobicContact CB-CB 3.65Å; C41-C105 WeakPolarHBondContact CB-SG 3.06Å; C41-C105 WeakPolarHBondContact SG-CA 3.42Å; C41-C105 WeakPolarHBondContact SG-CB 3.43Å; C41-C105 CovalentContact SG-SG 2.04Å; C41-C105 PolarHBondContact SG-SG 2.82Å; F43-C105 HydrophobicContact CE1-CB 4.02Å; F43-C105 WeakPolarHBondContact CE1-O 3.12Å; F43-C105 HydrophobicContact CZ-CB 3.83Å; F43-C105 VanDerWaalsContact CZ-O 3.22Å; F43-C105 WeakPolarHBondContact CZ-O 3.22Å; V50-C105 HydrophobicContact CG1-CB 3.56Å; F52-C105 WeakPolarHBondContact CD2-SG 3.38Å; A100-C105 PolarHBondContact O-N 3.38Å; A100-C105 VanDerWaalsContact O-N 3.12Å; V101-C105 WeakPolarHBondContact O-CB 3.36Å; C105-Q107 PolarHBondContact O-N 3.35Å; C105-E108 PolarHBondContact O-N 3.28Å; C105-Y109 WeakPolarHBondContact O-CB 3.47Å; C105-Y109 PolarHBondContact O-N 2.85Å
106	R	92.8	Very high	89.9	Confident	68 Å²	68	61.5 Å²	61.5	26%	0.257	32%	0.317	S	S	.	.	H	α-helix	trans	-65.2	-30.2	179.1	-70	179.8	-171.7	-80.8	-12	112.9	T47 V50 V101 N102 V104 K110	T47-R106 VanDerWaalsContact O-CZ 3.26Å; T47-R106 PolarHBondContact O-NH1 3.46Å; T47-R106 PolarHBondContact O-NH2 3.42Å; T47-R106 VanDerWaalsContact O-NH2 3.14Å; V50-R106 HydrophobicContact CG2-CG 4.28Å; V101-R106 WeakPolarHBondContact O-CG 3.22Å; V101-R106 PolarHBondContact O-N 3Å; N102-R106 WeakPolarHBondContact OD1-CD 3.02Å; N102-R106 PolarHBondContact OD1-NE 2.95Å; V104-R106 PolarHBondContact O-N 2.59Å; R106-K110 WeakPolarHBondContact O-CG 3.27Å; R106-K110 PolarHBondContact O-N 2.87Å
107	Q	86.4	Confident	89.6	Confident	86 Å²	86	58.7 Å²	58.7	40%	0.402	30%	0.3	S	S	.	.	H	α-helix	trans	-72.9	-48.6	178.3	-173.5	61.8	9.8	0	0	110.5	M103 V104 C105 Y109 K110 L111	M103-Q107 WeakPolarHBondContact O-CB 3.38Å; V104-Q107 PolarHBondContact O-N 2.58Å; C105-Q107 PolarHBondContact O-N 3.35Å; Q107-Y109 VanDerWaalsContact C-N 3.29Å; Q107-Y109 PolarHBondContact O-N 3.14Å; Q107-K110 WeakPolarHBondContact O-CB 3.39Å; Q107-K110 PolarHBondContact O-N 2.04Å; Q107-K110 VanDerWaalsContact O-N 3.09Å; Q107-L111 WeakPolarHBondContact O-CG 3.45Å; Q107-L111 PolarHBondContact O-N 3.34Å
108	E	86.3	Confident	89.4	Confident	104 Å²	104	62.5 Å²	62.5	49%	0.486	32%	0.315	S	S	.	.	H	α-helix	trans	-60.5	-38	174.5	-68.3	-53.7	139.3	0	0	111.8	V104 C105 K110 L111 G112	V104-E108 HydrophobicContact CG1-CG 4.16Å; V104-E108 WeakPolarHBondContact O-CB 3.48Å; V104-E108 WeakPolarHBondContact O-CG 3.38Å; V104-E108 PolarHBondContact O-N 2.96Å; C105-E108 PolarHBondContact O-N 3.28Å; E108-K110 VanDerWaalsContact C-N 3.3Å; E108-K110 PolarHBondContact O-N 3.03Å; E108-L111 PolarHBondContact O-N 3.42Å; E108-L111 VanDerWaalsContact O-N 3.12Å; E108-G112 PolarHBondContact O-N 3.32Å
109	Y	87.2	Confident	89.1	Confident	79 Å²	79	62.5 Å²	62.5	31%	0.31	32%	0.315	S	S	.	.	H	α-helix	trans	-58.6	-42.7	174.1	-171.3	-88.3	0	0	0	111.9	F43 G46 T47 C105 Q107 L111 A113	F43-Y109 HydrophobicContact CB-CD2 4.32Å; F43-Y109 HydrophobicContact CB-CE2 4.24Å; F43-Y109 AromaticContact CD1-CD2 3.53Å; F43-Y109 HydrophobicContact CD1-CD2 3.53Å; F43-Y109 HydrophobicContact CD1-CE2 4.21Å; F43-Y109 HydrophobicContact CD1-CG 4.13Å; F43-Y109 AromaticContact CD2-CD2 3.93Å; F43-Y109 HydrophobicContact CD2-CD2 3.93Å; F43-Y109 AromaticContact CE1-CD2 3.74Å; F43-Y109 HydrophobicContact CE1-CD2 3.74Å; F43-Y109 AromaticContact CE1-CG 4Å; F43-Y109 HydrophobicContact CE1-CG 4Å; F43-Y109 HydrophobicContact CE2-CD2 4.1Å; F43-Y109 AromaticContact CG-CD2 3.65Å; F43-Y109 HydrophobicContact CG-CD2 3.65Å; F43-Y109 HydrophobicContact CG-CE2 4.07Å; F43-Y109 HydrophobicContact CZ-CD2 4.01Å; F43-Y109 HydrophobicContact CZ-CG 4.38Å; G46-Y109 WeakPolarHBondContact CA-OH 3.39Å; T47-Y109 HydrophobicContact CG2-CD1 3.27Å; T47-Y109 HydrophobicContact CG2-CD2 4.3Å; T47-Y109 HydrophobicContact CG2-CE1 3.71Å; T47-Y109 HydrophobicContact CG2-CG 3.61Å; C105-Y109 WeakPolarHBondContact O-CB 3.47Å; C105-Y109 PolarHBondContact O-N 2.85Å; Q107-Y109 VanDerWaalsContact C-N 3.29Å; Q107-Y109 PolarHBondContact O-N 3.14Å; Y109-L111 VanDerWaalsContact C-N 3.27Å; Y109-L111 PolarHBondContact O-N 2.62Å; Y109-A113 HydrophobicContact CD1-CB 3.98Å; Y109-A113 HydrophobicContact CD2-CB 4.2Å; Y109-A113 HydrophobicContact CE1-CB 3.75Å; Y109-A113 HydrophobicContact CE2-CB 3.99Å; Y109-A113 HydrophobicContact CG-CB 4.2Å; Y109-A113 WeakPolarHBondContact O-CB 3.41Å; Y109-A113 PolarHBondContact O-N 3.12Å
110	K	82.9	Confident	88.9	Confident	138 Å²	138	63.9 Å²	63.9	60%	0.6	32%	0.316	S	S	*	.	H	α-helix	trans	-65.5	-32.6	177.8	-69.7	169.3	-174.7	173.5	0	112.5	R106 Q107 E108 P114	R106-K110 WeakPolarHBondContact O-CG 3.27Å; R106-K110 PolarHBondContact O-N 2.87Å; Q107-K110 WeakPolarHBondContact O-CB 3.39Å; Q107-K110 PolarHBondContact O-N 2.04Å; Q107-K110 VanDerWaalsContact O-N 3.09Å; E108-K110 VanDerWaalsContact C-N 3.3Å; E108-K110 PolarHBondContact O-N 3.03Å; K110-P114 WeakPolarHBondContact O-CD 3.39Å; K110-P114 WeakPolarHBondContact O-CG 3.32Å
111	L	80.3	Confident	88.7	Confident	94 Å²	94	69.1 Å²	69.1	49%	0.492	34%	0.344	S	S	.	.	H	α-helix	trans	-79.7	-48.9	180	-65	173.8	0	0	0	111.1	Q107 E108 Y109 P114 F115	Q107-L111 WeakPolarHBondContact O-CG 3.45Å; Q107-L111 PolarHBondContact O-N 3.34Å; E108-L111 PolarHBondContact O-N 3.42Å; E108-L111 VanDerWaalsContact O-N 3.12Å; Y109-L111 VanDerWaalsContact C-N 3.27Å; Y109-L111 PolarHBondContact O-N 2.62Å; L111-P114 WeakPolarHBondContact O-CD 3.38Å; L111-F115 VanDerWaalsContact O-CD1 3.3Å; L111-F115 WeakPolarHBondContact O-CD1 3.45Å; L111-F115 WeakPolarHBondContact O-CE1 3.31Å
112	G	81.6	Confident	88.6	Confident	17 Å²	17	69.1 Å²	69.1	18%	0.175	34%	0.342	C	S	.	.	H	α-helix	trans	-89.2	-34.7	-170	0	0	0	0	0	116.5	E108 P114 F115 T116	E108-G112 PolarHBondContact O-N 3.32Å; G112-P114 VanDerWaalsContact C-N 3.34Å; G112-F115 PolarHBondContact O-N 2.71Å; G112-T116 WeakPolarHBondContact O-CB 3.33Å; G112-T116 PolarHBondContact O-N 3.09Å; G112-T116 PolarHBondContact O-OG1 3.39Å
113	A	82.6	Confident	88.6	Confident	36 Å²	36	71 Å²	71	30%	0.298	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-59.7	-35.8	-179.6	0	0	0	0	0	114.1	Y109 F115 T116	Y109-A113 HydrophobicContact CD1-CB 3.98Å; Y109-A113 HydrophobicContact CD2-CB 4.2Å; Y109-A113 HydrophobicContact CE1-CB 3.75Å; Y109-A113 HydrophobicContact CE2-CB 3.99Å; Y109-A113 HydrophobicContact CG-CB 4.2Å; Y109-A113 WeakPolarHBondContact O-CB 3.41Å; Y109-A113 PolarHBondContact O-N 3.12Å; A113-F115 PolarHBondContact O-N 3.04Å; A113-T116 PolarHBondContact O-N 3.5Å
114	P	84.4	Confident	88.8	Confident	16 Å²	16	67.4 Å²	67.4	10%	0.104	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-53.5	-34	175.8	-35.4	41.7	0	0	0	116.3	K110 L111 G112 W131 W188	K110-P114 WeakPolarHBondContact O-CD 3.39Å; K110-P114 WeakPolarHBondContact O-CG 3.32Å; L111-P114 WeakPolarHBondContact O-CD 3.38Å; G112-P114 VanDerWaalsContact C-N 3.34Å; P114-W131 VanDerWaalsContact O-CH2 3.29Å; P114-W131 WeakPolarHBondContact O-CH2 3.4Å; P114-W188 HydrophobicContact CB-CD2 3.58Å; P114-W188 HydrophobicContact CB-CE3 4Å; P114-W188 HydrophobicContact CB-CG 4.01Å; P114-W188 HydrophobicContact CB-CH2 3.87Å; P114-W188 HydrophobicContact CB-CZ2 3.45Å; P114-W188 VanDerWaalsContact CB-CZ2 3.45Å; P114-W188 HydrophobicContact CB-CZ3 4.15Å; P114-W188 HydrophobicContact CG-CD2 4.12Å; P114-W188 HydrophobicContact CG-CG 4.45Å; P114-W188 HydrophobicContact CG-CH2 4.26Å; P114-W188 HydrophobicContact CG-CZ2 3.41Å; P114-W188 VanDerWaalsContact CG-CZ2 3.41Å
115	F	86.6	Confident	88.8	Confident	60 Å²	60	65.8 Å²	65.8	26%	0.263	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-115.4	6.7	-173.6	61.8	-104.9	0	0	0	113.1	L111 G112 A113 W131 M160 L161 M163	L111-F115 VanDerWaalsContact O-CD1 3.3Å; L111-F115 WeakPolarHBondContact O-CD1 3.45Å; L111-F115 WeakPolarHBondContact O-CE1 3.31Å; G112-F115 PolarHBondContact O-N 2.71Å; A113-F115 PolarHBondContact O-N 3.04Å; F115-W131 WeakPolarHBondContact O-CZ2 3.49Å; F115-M160 HydrophobicContact CD2-CE 4.43Å; F115-M160 HydrophobicContact CE2-CE 4Å; F115-M160 CarbonylContact O-C 3.45Å; F115-M160 VanDerWaalsContact O-CA 3.24Å; F115-M160 WeakPolarHBondContact O-CA 3.49Å; F115-L161 HydrophobicContact CB-CB 4.46Å; F115-L161 WeakPolarHBondContact CB-O 3.43Å; F115-L161 PolarHBondContact O-N 2.97Å; F115-M163 HydrophobicContact CB-CG 3.96Å; F115-M163 HydrophobicContact CB-SD 3.85Å
116	T	89.4	Confident	88.8	Confident	41 Å²	41	71.7 Å²	71.7	25%	0.252	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	122.1	179.8	-55.1	0	0	0	0	110.2	G112 A113 T158 M160	G112-T116 WeakPolarHBondContact O-CB 3.33Å; G112-T116 PolarHBondContact O-N 3.09Å; G112-T116 PolarHBondContact O-OG1 3.39Å; A113-T116 PolarHBondContact O-N 3.5Å; T116-T158 HydrophobicContact CG2-CG2 3.77Å; T116-M160 HydrophobicContact CG2-CG 3.74Å; T116-M160 HydrophobicContact CG2-SD 4.44Å
117	V	90.3	Very high	88.9	Confident	21 Å²	21	70.4 Å²	70.4	13%	0.127	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	109.9	174.7	173.9	0	0	0	0	109.5	R119 W131 T158 V159 C173 V175	V117-R119 HydrophobicContact CG1-CG 4.42Å; V117-W131 HydrophobicContact CB-CZ2 4.42Å; V117-W131 HydrophobicContact CG2-CH2 4.01Å; V117-W131 HydrophobicContact CG2-CZ2 3.68Å; V117-T158 WeakPolarHBondContact O-CA 3.38Å; V117-V159 PolarHBondContact N-O 2.79Å; V117-V159 PolarHBondContact O-N 2.7Å; V117-C173 HydrophobicContact CG2-CB 3.78Å; V117-V175 HydrophobicContact CG1-CG2 4.5Å
118	E	89.6	Confident	89.2	Confident	102 Å²	102	68.3 Å²	68.3	48%	0.477	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	133.4	172.5	-171.6	176.9	171.6	0	0	109.5	N120 T158	E118-N120 PolarHBondContact OE1-ND2 2.95Å; E118-N120 PolarHBondContact OE1-OD1 3.38Å; E118-T158 HydrophobicContact CB-CG2 4.5Å
119	R	91.6	Very high	89.6	Confident	114 Å²	114	64.6 Å²	64.6	43%	0.43	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	118.5	172.8	-66.7	-63.3	99.4	174.3	6.5	107.8	V117 F122 I127 Q156 T157	V117-R119 HydrophobicContact CG1-CG 4.42Å; R119-F122 HydrophobicContact CB-CD1 3.97Å; R119-F122 HydrophobicContact CB-CE1 3.91Å; R119-F122 WeakPolarHBondContact O-CE1 3.48Å; R119-I127 HydrophobicContact CB-CD1 4.11Å; R119-I127 HydrophobicContact CG-CD1 3.92Å; R119-Q156 CarbonylContact O-C 3.56Å; R119-Q156 WeakPolarHBondContact O-CA 3.47Å; R119-T157 HydrophobicContact CB-CG2 4.23Å; R119-T157 PolarHBondContact N-O 2.6Å; R119-T157 PolarHBondContact O-N 2.85Å
120	N	91.6	Very high	90	Very high	72 Å²	72	64.1 Å²	64.1	39%	0.385	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	162.6	178.5	-61.5	-25.5	0	0	0	110	E118 F122 Q156	E118-N120 PolarHBondContact OE1-ND2 2.95Å; E118-N120 PolarHBondContact OE1-OD1 3.38Å; N120-F122 VanDerWaalsContact C-N 3.31Å; N120-F122 PolarHBondContact O-N 3.5Å; N120-Q156 WeakPolarHBondContact OD1-CB 3.3Å
121	D	92.6	Very high	90.5	Very high	117 Å²	117	57.9 Å²	57.9	63%	0.626	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	54.9	37.3	169.4	-50.3	-33.5	0	0	0	115.2	F155	D121-F155 PolarHBondContact N-O 2.95Å; D121-F155 VanDerWaalsContact N-O 3.14Å
122	F	94.1	Very high	91.1	Very high	20 Å²	20	55 Å²	55	9%	0.088	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	155.2	178.8	68.4	-90.8	0	0	0	113.3	R119 N120 P124 I127 L147 F155 T157 H177	R119-F122 HydrophobicContact CB-CD1 3.97Å; R119-F122 HydrophobicContact CB-CE1 3.91Å; R119-F122 WeakPolarHBondContact O-CE1 3.48Å; N120-F122 VanDerWaalsContact C-N 3.31Å; N120-F122 PolarHBondContact O-N 3.5Å; F122-P124 WeakPolarHBondContact CD2-O 3.37Å; F122-I127 HydrophobicContact CD1-CD1 4.39Å; F122-I127 HydrophobicContact CD2-CB 4.45Å; F122-I127 HydrophobicContact CD2-CD1 4.29Å; F122-I127 HydrophobicContact CE1-CD1 4.13Å; F122-I127 HydrophobicContact CE2-CB 3.8Å; F122-I127 HydrophobicContact CE2-CD1 4.04Å; F122-I127 HydrophobicContact CE2-CG2 3.7Å; F122-I127 HydrophobicContact CG-CD1 4.46Å; F122-I127 HydrophobicContact CZ-CB 4.19Å; F122-I127 HydrophobicContact CZ-CD1 3.96Å; F122-I127 HydrophobicContact CZ-CG2 3.68Å; F122-L147 HydrophobicContact CE2-CD1 3.89Å; F122-L147 HydrophobicContact CZ-CD1 3.59Å; F122-F155 WeakPolarHBondContact CD1-O 3.17Å; F122-F155 HydrophobicContact CD2-CB 4.3Å; F122-F155 HydrophobicContact CE1-CB 4.23Å; F122-F155 WeakPolarHBondContact CE1-O 3.06Å; F122-F155 HydrophobicContact CE2-CB 3.84Å; F122-F155 HydrophobicContact CZ-CB 3.8Å; F122-F155 PolarHBondContact N-O 3.38Å; F122-F155 PolarHBondContact O-N 3.06Å; F122-T157 HydrophobicContact CE1-CG2 4.07Å; F122-T157 HydrophobicContact CZ-CG2 4.03Å; F122-H177 AromaticContact CD2-CD2 3.92Å; F122-H177 AromaticContact CD2-NE2 3.6Å
123	Y	93.9	Very high	91.7	Very high	143 Å²	143	57.6 Å²	57.6	56%	0.561	29%	0.288	S	S	*	.	S	Bend	trans	-154.8	139.7	175.9	-176.4	-89.6	0	0	0	110.6	W153 F155 H177	Y123-W153 WeakPolarHBondContact CD2-O 3.28Å; Y123-F155 HydrophobicContact CD2-CD2 4.32Å; Y123-F155 AromaticContact CD2-CE2 3.87Å; Y123-F155 HydrophobicContact CD2-CE2 3.87Å; Y123-F155 HydrophobicContact CE2-CE2 4.22Å; Y123-H177 VanDerWaalsContact C-CE1 3.5Å; Y123-H177 PolarHBondContact O-CE1 2.97Å
124	P	94.9	Very high	92.1	Very high	36 Å²	36	60 Å²	60	23%	0.234	30%	0.296	C	S	.	.	S	Bend	cis	-73.6	178.2	1.2	32.8	-36.8	0	0	0	113.1	F122 D126 H177 P178	F122-P124 WeakPolarHBondContact CD2-O 3.37Å; P124-D126 PolarHBondContact O-N 3.07Å; P124-H177 PolarHBondContact O-NE2 2.87Å; P124-P178 HydrophobicContact CG-CB 4.2Å; P124-P178 HydrophobicContact CG-CG 3.96Å
125	G	92.3	Very high	92.4	Very high	17 Å²	17	62.2 Å²	62.2	18%	0.175	32%	0.321	C	S	.	.	S	Bend	trans	-69.3	-12.3	-177.9	0	0	0	0	0	114.8	I127	G125-I127 PolarHBondContact O-N 3.35Å
126	D	93.3	Very high	92.7	Very high	125 Å²	125	66.7 Å²	66.7	67%	0.668	34%	0.343	S	S	*	.			trans	-72	92.8	-179.1	-59.8	-66.7	0	0	0	111	P124 H177 P178	P124-D126 PolarHBondContact O-N 3.07Å; D126-H177 PolarHBondContact O-CD2 3.44Å; D126-H177 VanDerWaalsContact O-CD2 3.28Å; D126-P178 HydrophobicContact CB-CG 4.48Å; D126-P178 WeakPolarHBondContact O-CD 3.45Å
127	I	94.8	Very high	93	Very high	41 Å²	41	68 Å²	68	21%	0.21	35%	0.346	C	S	.	.			trans	-124.2	139.2	177.3	-166.8	168.7	0	0	0	110.6	R119 F122 G125 V129 L147 T157 V175 H177	R119-I127 HydrophobicContact CB-CD1 4.11Å; R119-I127 HydrophobicContact CG-CD1 3.92Å; F122-I127 HydrophobicContact CD1-CD1 4.39Å; F122-I127 HydrophobicContact CD2-CB 4.45Å; F122-I127 HydrophobicContact CD2-CD1 4.29Å; F122-I127 HydrophobicContact CE1-CD1 4.13Å; F122-I127 HydrophobicContact CE2-CB 3.8Å; F122-I127 HydrophobicContact CE2-CD1 4.04Å; F122-I127 HydrophobicContact CE2-CG2 3.7Å; F122-I127 HydrophobicContact CG-CD1 4.46Å; F122-I127 HydrophobicContact CZ-CB 4.19Å; F122-I127 HydrophobicContact CZ-CD1 3.96Å; F122-I127 HydrophobicContact CZ-CG2 3.68Å; G125-I127 PolarHBondContact O-N 3.35Å; I127-V129 HydrophobicContact CD1-CG2 4.18Å; I127-V129 HydrophobicContact CG1-CG2 4.05Å; I127-L147 HydrophobicContact CG2-CD1 4.47Å; I127-T157 HydrophobicContact CD1-CG2 4.42Å; I127-T157 HydrophobicContact CG2-CG2 4.1Å; I127-V175 HydrophobicContact CD1-CG1 4.08Å; I127-V175 HydrophobicContact CG1-CG1 4.23Å; I127-H177 HydrophobicContact CG1-CB 4.37Å
128	S	94.2	Very high	93.1	Very high	41 Å²	41	69.5 Å²	69.5	29%	0.287	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	118.5	174.3	158	0	0	0	0	108.5	V175 E176	S128-V175 WeakPolarHBondContact O-CA 3.17Å; S128-E176 PolarHBondContact N-O 2.86Å; S128-E176 PolarHBondContact O-N 2.88Å; S128-E176 PolarHBondContact OG-OE2 3.35Å
129	V	94.6	Very high	93.2	Very high	27 Å²	27	73.5 Å²	73.5	16%	0.164	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	116.5	179.2	-175.8	0	0	0	0	107.9	I127 V159 C173 L174 V175	I127-V129 HydrophobicContact CD1-CG2 4.18Å; I127-V129 HydrophobicContact CG1-CG2 4.05Å; V129-V159 HydrophobicContact CB-CB 4.44Å; V129-V159 HydrophobicContact CB-CG2 3.9Å; V129-V159 HydrophobicContact CG1-CB 3.88Å; V129-V159 HydrophobicContact CG1-CG1 4.09Å; V129-V159 HydrophobicContact CG1-CG2 3.87Å; V129-V159 HydrophobicContact CG2-CG2 4.22Å; V129-C173 WeakPolarHBondContact CG1-SG 3.37Å; V129-L174 WeakPolarHBondContact CA-O 3.38Å; V129-V175 HydrophobicContact CG1-CG2 4.42Å; V129-V175 HydrophobicContact CG2-CG2 4.44Å
130	R	94.1	Very high	93.1	Very high	69 Å²	69	73.5 Å²	73.5	26%	0.26	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	135.9	-176	-66.7	-173.2	-74.3	144.9	-6.5	110.9	F132 E137 C173 L174 E176	R130-F132 HydrophobicContact CB-CE2 3.82Å; R130-F132 HydrophobicContact CB-CZ 4.47Å; R130-E137 IonicContact NH1-OE2 3.77Å; R130-E137 PolarHBondContact NH1-OE2 3.1Å; R130-C173 WeakPolarHBondContact O-CA 3.31Å; R130-L174 PolarHBondContact N-O 2.96Å; R130-L174 VanDerWaalsContact NH2-CD2 3.3Å; R130-L174 PolarHBondContact O-N 2.82Å; R130-E176 IonicContact NE-OE2 3.77Å; R130-E176 IonicContact NH2-OE1 2.68Å; R130-E176 PolarHBondContact NH2-OE1 3.36Å; R130-E176 IonicContact NH2-OE2 3.35Å; R130-E176 PolarHBondContact NH2-OE2 3.02Å
131	W	94.5	Very high	92.9	Very high	7 Å²	7	70.5 Å²	70.5	3%	0.027	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	145.3	175.3	-81.1	101.9	0	0	0	111.1	P114 F115 V117 E137 E138 V142 L161 S172 C173	P114-W131 VanDerWaalsContact O-CH2 3.29Å; P114-W131 WeakPolarHBondContact O-CH2 3.4Å; F115-W131 WeakPolarHBondContact O-CZ2 3.49Å; V117-W131 HydrophobicContact CB-CZ2 4.42Å; V117-W131 HydrophobicContact CG2-CH2 4.01Å; V117-W131 HydrophobicContact CG2-CZ2 3.68Å; W131-E137 CarbonylContact O-C 3.57Å; W131-E137 WeakPolarHBondContact O-CA 3.47Å; W131-E138 HydrophobicContact CB-CB 4.42Å; W131-E138 PolarHBondContact O-N 2.79Å; W131-V142 HydrophobicContact CB-CG2 3.94Å; W131-V142 HydrophobicContact CG-CG2 4.18Å; W131-L161 HydrophobicContact CB-CD2 4.24Å; W131-L161 HydrophobicContact CD2-CB 3.84Å; W131-L161 HydrophobicContact CD2-CD2 4.01Å; W131-L161 HydrophobicContact CE3-CB 4.34Å; W131-L161 HydrophobicContact CE3-CD2 3.89Å; W131-L161 HydrophobicContact CG-CB 4.01Å; W131-L161 HydrophobicContact CG-CD2 4.19Å; W131-L161 HydrophobicContact CZ2-CB 4.32Å; W131-S172 CarbonylContact C-O 3.46Å; W131-C173 HydrophobicContact CD2-CB 4.18Å; W131-C173 HydrophobicContact CE3-CB 4.04Å; W131-C173 HydrophobicContact CH2-CB 4.01Å; W131-C173 HydrophobicContact CZ2-CB 4.17Å; W131-C173 HydrophobicContact CZ3-CB 3.95Å
132	F	93.3	Very high	92.9	Very high	32 Å²	32	66.6 Å²	66.6	14%	0.14	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	135.4	174.9	-64.9	-101.2	0	0	0	110	R130 Q136 E137 Y171 S172 L174	R130-F132 HydrophobicContact CB-CE2 3.82Å; R130-F132 HydrophobicContact CB-CZ 4.47Å; F132-Q136 CarbonylContact C-O 3.6Å; F132-Q136 WeakPolarHBondContact CA-O 3.29Å; F132-E137 HydrophobicContact CD1-CB 4.02Å; F132-E137 HydrophobicContact CE1-CB 3.76Å; F132-E137 HydrophobicContact CE1-CG 4.24Å; F132-E137 HydrophobicContact CZ-CB 4.29Å; F132-E137 HydrophobicContact CZ-CG 4.28Å; F132-Y171 CarbonylContact O-C 3.57Å; F132-Y171 WeakPolarHBondContact O-CA 3.46Å; F132-S172 WeakPolarHBondContact CB-OG 3.35Å; F132-S172 PolarHBondContact N-O 2.75Å; F132-S172 PolarHBondContact O-N 3.41Å; F132-L174 HydrophobicContact CD2-CB 4.32Å; F132-L174 HydrophobicContact CE2-CB 3.83Å; F132-L174 HydrophobicContact CE2-CD2 4.02Å; F132-L174 HydrophobicContact CZ-CD2 4.35Å
133	R	92.2	Very high	92.9	Very high	72 Å²	72	71.6 Å²	71.6	27%	0.272	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	121.1	168.8	-177.7	179.7	-177.8	-174.2	1.7	108.3	G135 Q136 E166 D169 Y171	R133-G135 PolarHBondContact O-N 3.01Å; R133-G135 VanDerWaalsContact O-N 3.09Å; R133-Q136 PolarHBondContact N-O 2.91Å; R133-Q136 PolarHBondContact O-N 3.35Å; R133-E166 IonicContact CZ-OE1 2.74Å; R133-E166 VanDerWaalsContact NH2-CD 3.32Å; R133-E166 IonicContact NH2-OE1 3.66Å; R133-E166 PolarHBondContact NH2-OE1 2.68Å; R133-E166 IonicContact NH2-OE2 2.78Å; R133-D169 IonicContact CZ-OD2 3Å; R133-D169 IonicContact NE-OD1 3.36Å; R133-D169 IonicContact NE-OD2 3.18Å; R133-D169 PolarHBondContact NE-OD2 2.65Å; R133-D169 IonicContact NH2-OD1 3.01Å; R133-D169 IonicContact NH2-OD2 3.89Å; R133-D169 PolarHBondContact NH2-OD2 2.88Å; R133-Y171 HydrophobicContact CB-CD1 4.14Å; R133-Y171 HydrophobicContact CB-CE1 3.94Å; R133-Y171 HydrophobicContact CG-CD1 4.18Å; R133-Y171 HydrophobicContact CG-CE1 3.6Å; R133-Y171 PolarHBondContact NE-OH 3.35Å; R133-Y171 VanDerWaalsContact NE-OH 3.11Å
134	N	91.3	Very high	92.8	Very high	88 Å²	88	68 Å²	68	47%	0.471	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	35.3	-179	-58.3	-33.1	0	0	0	113.4	Q136 D169 V170	N134-Q136 VanDerWaalsContact C-N 3.32Å; N134-Q136 PolarHBondContact O-N 2.87Å; N134-D169 PolarHBondContact ND2-OD1 3.15Å; N134-D169 WeakPolarHBondContact OD1-CA 3.3Å; N134-V170 PolarHBondContact N-O 3.4Å; N134-V170 PolarHBondContact OD1-N 3.36Å
135	G	90.9	Very high	92.7	Very high	61 Å²	61	70.6 Å²	70.6	63%	0.629	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.2	-3	-179	0	0	0	0	0	115.6	R133	R133-G135 PolarHBondContact O-N 3.01Å; R133-G135 VanDerWaalsContact O-N 3.09Å
136	Q	93.4	Very high	92.6	Very high	154 Å²	154	71.4 Å²	71.4	72%	0.72	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	135	173.8	-63.8	-170.7	-37.3	0	0	110.5	F132 R133 N134 E138	F132-Q136 CarbonylContact C-O 3.6Å; F132-Q136 WeakPolarHBondContact CA-O 3.29Å; R133-Q136 PolarHBondContact N-O 2.91Å; R133-Q136 PolarHBondContact O-N 3.35Å; N134-Q136 VanDerWaalsContact C-N 3.32Å; N134-Q136 PolarHBondContact O-N 2.87Å; Q136-E138 PolarHBondContact O-N 3Å
137	E	94.8	Very high	92.7	Very high	68 Å²	68	69.7 Å²	69.7	32%	0.318	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	125.7	-179.2	-169.2	176.2	134.4	0	0	110.4	R130 W131 F132 R139	R130-E137 IonicContact NH1-OE2 3.77Å; R130-E137 PolarHBondContact NH1-OE2 3.1Å; W131-E137 CarbonylContact O-C 3.57Å; W131-E137 WeakPolarHBondContact O-CA 3.47Å; F132-E137 HydrophobicContact CD1-CB 4.02Å; F132-E137 HydrophobicContact CE1-CB 3.76Å; F132-E137 HydrophobicContact CE1-CG 4.24Å; F132-E137 HydrophobicContact CZ-CB 4.29Å; F132-E137 HydrophobicContact CZ-CG 4.28Å; E137-R139 HydrophobicContact CG-CG 4.5Å; E137-R139 IonicContact OE1-CZ 3.46Å; E137-R139 IonicContact OE1-NE 3.17Å; E137-R139 PolarHBondContact OE1-NE 2.9Å; E137-R139 IonicContact OE1-NH2 2.86Å; E137-R139 PolarHBondContact OE1-NH2 3.1Å
138	E	93.3	Very high	92.7	Very high	53 Å²	53	70.7 Å²	70.7	25%	0.248	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	130.8	178.8	-171.2	54.2	-110.2	0	0	109.7	W131 Q136 S140 V142 L161	W131-E138 HydrophobicContact CB-CB 4.42Å; W131-E138 PolarHBondContact O-N 2.79Å; Q136-E138 PolarHBondContact O-N 3Å; E138-S140 PolarHBondContact OE1-N 2.87Å; E138-S140 VanDerWaalsContact OE1-N 3.13Å; E138-S140 PolarHBondContact OE1-OG 2.92Å; E138-V142 WeakPolarHBondContact O-CG2 3.38Å; E138-L161 HydrophobicContact CB-CD1 4.36Å; E138-L161 HydrophobicContact CG-CD1 3.61Å
139	R	92.4	Very high	92.7	Very high	186 Å²	186	76.4 Å²	76.4	70%	0.702	41%	0.405	S	S	*	.			trans	-128.8	-27.6	-178.4	-66.7	-173.4	176.4	-156.4	-1.1	113	E137 V142	E137-R139 HydrophobicContact CG-CG 4.5Å; E137-R139 IonicContact OE1-CZ 3.46Å; E137-R139 IonicContact OE1-NE 3.17Å; E137-R139 PolarHBondContact OE1-NE 2.9Å; E137-R139 IonicContact OE1-NH2 2.86Å; E137-R139 PolarHBondContact OE1-NH2 3.1Å; R139-V142 PolarHBondContact O-N 3.27Å
140	S	88.3	Confident	92.6	Very high	114 Å²	114	77.6 Å²	77.6	80%	0.797	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-38.6	-168.5	64.2	0	0	0	0	112.4	E138	E138-S140 PolarHBondContact OE1-N 2.87Å; E138-S140 VanDerWaalsContact OE1-N 3.13Å; E138-S140 PolarHBondContact OE1-OG 2.92Å
141	G	87.8	Confident	92.4	Very high	10 Å²	10	77.4 Å²	77.4	10%	0.103	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	8.6	177.2	0	0	0	0	0	114.8	M143 E162	G141-M143 PolarHBondContact O-N 2.87Å; G141-E162 PolarHBondContact O-N 3.01Å
142	V	92.9	Very high	92.4	Very high	35 Å²	35	81.3 Å²	81.3	21%	0.212	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	116.4	-175.7	180	0	0	0	0	110.7	W131 E138 R139 V159 M160 L161	W131-V142 HydrophobicContact CB-CG2 3.94Å; W131-V142 HydrophobicContact CG-CG2 4.18Å; E138-V142 WeakPolarHBondContact O-CG2 3.38Å; R139-V142 PolarHBondContact O-N 3.27Å; V142-V159 HydrophobicContact CG1-CG1 3.54Å; V142-M160 CarbonylContact C-O 3.51Å; V142-M160 WeakPolarHBondContact CA-O 3.5Å; V142-L161 HydrophobicContact CG2-CD1 3.95Å
143	M	92.8	Very high	92.3	Very high	125 Å²	125	89.1 Å²	89.1	62%	0.616	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.7	134.2	176	-63.6	-79.4	73.1	0	0	110.5	G141 V159 M160	G141-M143 PolarHBondContact O-N 2.87Å; M143-V159 CarbonylContact O-C 3.59Å; M143-V159 WeakPolarHBondContact O-CA 3.36Å; M143-M160 PolarHBondContact N-O 2.96Å; M143-M160 PolarHBondContact O-N 2.88Å
144	S	92.3	Very high	92.5	Very high	68 Å²	68	87 Å²	87	48%	0.476	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	141.1	176.9	177.5	0	0	0	0	110.1	G146 T158	S144-G146 PolarHBondContact O-N 3.46Å; S144-G146 PolarHBondContact OG-N 3.29Å; S144-T158 VanDerWaalsContact CA-O 3.31Å; S144-T158 WeakPolarHBondContact CA-O 3.29Å
145	T	92.4	Very high	92.7	Very high	90 Å²	90	83.4 Å²	83.4	55%	0.552	46%	0.455	S	S	*	.			trans	-68.4	-7.8	168.5	56	0	0	0	0	112.7	T158	T145-T158 PolarHBondContact N-O 2.71Å; T145-T158 PolarHBondContact OG1-N 2.75Å; T145-T158 PolarHBondContact OG1-O 3.47Å
146	G	91.9	Very high	92.9	Very high	34 Å²	34	83.6 Å²	83.6	35%	0.351	44%	0.44	S	S	.	.			trans	76.4	-169.9	-169.5	0	0	0	0	0	111.7	S144 T157	S144-G146 PolarHBondContact O-N 3.46Å; S144-G146 PolarHBondContact OG-N 3.29Å; G146-T157 VanDerWaalsContact O-CB 3.31Å; G146-T157 WeakPolarHBondContact O-CB 3.26Å; G146-T157 PolarHBondContact O-OG1 2.83Å
147	L	93.9	Very high	93	Very high	89 Å²	89	76.6 Å²	76.6	47%	0.466	41%	0.407	S	S	.	.			trans	-89.3	118.7	177.7	-167.3	74.4	0	0	0	109.6	F122 I127 F155	F122-L147 HydrophobicContact CE2-CD1 3.89Å; F122-L147 HydrophobicContact CZ-CD1 3.59Å; I127-L147 HydrophobicContact CG2-CD1 4.47Å; L147-F155 HydrophobicContact CD1-CB 3.71Å; L147-F155 HydrophobicContact CD1-CD1 4.08Å; L147-F155 HydrophobicContact CD1-CG 4.07Å; L147-F155 HydrophobicContact CD2-CD1 3.57Å; L147-F155 HydrophobicContact CD2-CE1 3.78Å; L147-F155 HydrophobicContact CD2-CG 4.17Å; L147-F155 HydrophobicContact CG-CB 4.2Å; L147-F155 HydrophobicContact CG-CD1 3.65Å; L147-F155 HydrophobicContact CG-CE1 4.33Å; L147-F155 HydrophobicContact CG-CG 4.16Å
148	V	94.9	Very high	92.9	Very high	61 Å²	61	74.6 Å²	74.6	37%	0.37	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	134.6	175.8	177.9	0	0	0	0	108.9	F155 Q156	V148-F155 CarbonylContact O-C 3.49Å; V148-F155 VanDerWaalsContact O-CA 3.28Å; V148-F155 WeakPolarHBondContact O-CA 3.44Å; V148-Q156 HydrophobicContact CB-CG 3.6Å; V148-Q156 HydrophobicContact CG1-CG 3.95Å; V148-Q156 PolarHBondContact N-O 3.18Å; V148-Q156 PolarHBondContact O-N 3.27Å
149	R	94	Very high	93	Very high	161 Å²	161	72.3 Å²	72.3	61%	0.608	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.8	127.8	178.1	-177.1	-175.5	-67.2	-87.6	0.8	109.8	F155	R149-F155 HydrophobicContact CB-CD1 4.24Å; R149-F155 HydrophobicContact CB-CE1 4.19Å; R149-F155 HydrophobicContact CG-CE1 4.26Å
150	N	92.8	Very high	93	Very high	52 Å²	52	67.4 Å²	67.4	28%	0.278	38%	0.375	S	S	.	.			trans	-79.2	-19	-177	-69.6	-13.9	0	0	0	113.8	D152 T154 Q156	N150-D152 VanDerWaalsContact C-N 3.34Å; N150-D152 WeakPolarHBondContact CB-OD1 3.32Å; N150-T154 WeakPolarHBondContact CB-OG1 3.41Å; N150-T154 PolarHBondContact N-O 3.44Å; N150-T154 VanDerWaalsContact N-O 3.1Å; N150-T154 PolarHBondContact ND2-OG1 3.49Å; N150-Q156 PolarHBondContact OD1-NE2 2.72Å
151	G	91.3	Very high	93.2	Very high	65 Å²	65	62.1 Å²	62.1	67%	0.67	34%	0.338	S	S	*	.	S	Bend	trans	89.3	-2.2	-177.2	0	0	0	0	0	114.1
152	D	94.6	Very high	93.2	Very high	90 Å²	90	69.3 Å²	69.3	48%	0.481	37%	0.369	S	S	.	.	S	Bend	trans	-113.4	24	179.1	67.6	-9.3	0	0	0	112.7	N150 T154	N150-D152 VanDerWaalsContact C-N 3.34Å; N150-D152 WeakPolarHBondContact CB-OD1 3.32Å; D152-T154 PolarHBondContact O-N 3.38Å; D152-T154 WeakPolarHBondContact OD1-CB 3.43Å; D152-T154 PolarHBondContact OD1-N 3.45Å; D152-T154 PolarHBondContact OD1-OG1 2.96Å; D152-T154 PolarHBondContact OD2-OG1 2.99Å
153	W	91.3	Very high	92.5	Very high	196 Å²	196	69.3 Å²	69.3	74%	0.742	37%	0.367	S	S	*	.	S	Bend	trans	70.5	4.5	-171.8	-56.8	85	0	0	0	116.2	Y123	Y123-W153 WeakPolarHBondContact CD2-O 3.28Å
154	T	96.2	Very high	92	Very high	26 Å²	26	70.5 Å²	70.5	16%	0.16	37%	0.374	C	S	.	.			trans	-103.7	167.4	173	72.1	0	0	0	0	112.4	N150 D152	N150-T154 WeakPolarHBondContact CB-OG1 3.41Å; N150-T154 PolarHBondContact N-O 3.44Å; N150-T154 VanDerWaalsContact N-O 3.1Å; N150-T154 PolarHBondContact ND2-OG1 3.49Å; D152-T154 PolarHBondContact O-N 3.38Å; D152-T154 WeakPolarHBondContact OD1-CB 3.43Å; D152-T154 PolarHBondContact OD1-N 3.45Å; D152-T154 PolarHBondContact OD1-OG1 2.96Å; D152-T154 PolarHBondContact OD2-OG1 2.99Å
155	F	95.2	Very high	91.3	Very high	14 Å²	14	70.1 Å²	70.1	6%	0.061	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	158.4	178.2	-60.1	-87.1	0	0	0	111.6	D121 F122 Y123 L147 V148 R149	D121-F155 PolarHBondContact N-O 2.95Å; D121-F155 VanDerWaalsContact N-O 3.14Å; F122-F155 WeakPolarHBondContact CD1-O 3.17Å; F122-F155 HydrophobicContact CD2-CB 4.3Å; F122-F155 HydrophobicContact CE1-CB 4.23Å; F122-F155 WeakPolarHBondContact CE1-O 3.06Å; F122-F155 HydrophobicContact CE2-CB 3.84Å; F122-F155 HydrophobicContact CZ-CB 3.8Å; F122-F155 PolarHBondContact N-O 3.38Å; F122-F155 PolarHBondContact O-N 3.06Å; Y123-F155 HydrophobicContact CD2-CD2 4.32Å; Y123-F155 AromaticContact CD2-CE2 3.87Å; Y123-F155 HydrophobicContact CD2-CE2 3.87Å; Y123-F155 HydrophobicContact CE2-CE2 4.22Å; L147-F155 HydrophobicContact CD1-CB 3.71Å; L147-F155 HydrophobicContact CD1-CD1 4.08Å; L147-F155 HydrophobicContact CD1-CG 4.07Å; L147-F155 HydrophobicContact CD2-CD1 3.57Å; L147-F155 HydrophobicContact CD2-CE1 3.78Å; L147-F155 HydrophobicContact CD2-CG 4.17Å; L147-F155 HydrophobicContact CG-CB 4.2Å; L147-F155 HydrophobicContact CG-CD1 3.65Å; L147-F155 HydrophobicContact CG-CE1 4.33Å; L147-F155 HydrophobicContact CG-CG 4.16Å; V148-F155 CarbonylContact O-C 3.49Å; V148-F155 VanDerWaalsContact O-CA 3.28Å; V148-F155 WeakPolarHBondContact O-CA 3.44Å; R149-F155 HydrophobicContact CB-CD1 4.24Å; R149-F155 HydrophobicContact CB-CE1 4.19Å; R149-F155 HydrophobicContact CG-CE1 4.26Å
156	Q	95.4	Very high	90.8	Very high	65 Å²	65	71.3 Å²	71.3	30%	0.304	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	150.8	171	67.3	-180	-72.5	0	0	111.2	R119 N120 V148 N150	R119-Q156 CarbonylContact O-C 3.56Å; R119-Q156 WeakPolarHBondContact O-CA 3.47Å; N120-Q156 WeakPolarHBondContact OD1-CB 3.3Å; V148-Q156 HydrophobicContact CB-CG 3.6Å; V148-Q156 HydrophobicContact CG1-CG 3.95Å; V148-Q156 PolarHBondContact N-O 3.18Å; V148-Q156 PolarHBondContact O-N 3.27Å; N150-Q156 PolarHBondContact OD1-NE2 2.72Å
157	T	93.9	Very high	90.3	Very high	6 Å²	6	76.3 Å²	76.3	4%	0.037	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	144.5	171.9	-167.5	0	0	0	0	110.5	R119 F122 I127 G146	R119-T157 HydrophobicContact CB-CG2 4.23Å; R119-T157 PolarHBondContact N-O 2.6Å; R119-T157 PolarHBondContact O-N 2.85Å; F122-T157 HydrophobicContact CE1-CG2 4.07Å; F122-T157 HydrophobicContact CZ-CG2 4.03Å; I127-T157 HydrophobicContact CD1-CG2 4.42Å; I127-T157 HydrophobicContact CG2-CG2 4.1Å; G146-T157 VanDerWaalsContact O-CB 3.31Å; G146-T157 WeakPolarHBondContact O-CB 3.26Å; G146-T157 PolarHBondContact O-OG1 2.83Å
158	T	94.2	Very high	89.7	Confident	26 Å²	26	75 Å²	75	16%	0.16	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	126.1	175.4	-54.1	0	0	0	0	108.2	T116 V117 E118 S144 T145 M160	T116-T158 HydrophobicContact CG2-CG2 3.77Å; V117-T158 WeakPolarHBondContact O-CA 3.38Å; E118-T158 HydrophobicContact CB-CG2 4.5Å; S144-T158 VanDerWaalsContact CA-O 3.31Å; S144-T158 WeakPolarHBondContact CA-O 3.29Å; T145-T158 PolarHBondContact N-O 2.71Å; T145-T158 PolarHBondContact OG1-N 2.75Å; T145-T158 PolarHBondContact OG1-O 3.47Å; T158-M160 HydrophobicContact CG2-CG 4.35Å
159	V	94.3	Very high	89.4	Confident	6 Å²	6	72.7 Å²	72.7	4%	0.036	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	119.3	179.9	-173.3	0	0	0	0	109	V117 V129 V142 M143	V117-V159 PolarHBondContact N-O 2.79Å; V117-V159 PolarHBondContact O-N 2.7Å; V129-V159 HydrophobicContact CB-CB 4.44Å; V129-V159 HydrophobicContact CB-CG2 3.9Å; V129-V159 HydrophobicContact CG1-CB 3.88Å; V129-V159 HydrophobicContact CG1-CG1 4.09Å; V129-V159 HydrophobicContact CG1-CG2 3.87Å; V129-V159 HydrophobicContact CG2-CG2 4.22Å; V142-V159 HydrophobicContact CG1-CG1 3.54Å; M143-V159 CarbonylContact O-C 3.59Å; M143-V159 WeakPolarHBondContact O-CA 3.36Å
160	M	92.3	Very high	89.2	Confident	82 Å²	82	67.4 Å²	67.4	40%	0.404	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	143.8	-178.9	-66.6	175.4	64.5	0	0	110.3	F115 T116 V142 M143 T158	F115-M160 HydrophobicContact CD2-CE 4.43Å; F115-M160 HydrophobicContact CE2-CE 4Å; F115-M160 CarbonylContact O-C 3.45Å; F115-M160 VanDerWaalsContact O-CA 3.24Å; F115-M160 WeakPolarHBondContact O-CA 3.49Å; T116-M160 HydrophobicContact CG2-CG 3.74Å; T116-M160 HydrophobicContact CG2-SD 4.44Å; V142-M160 CarbonylContact C-O 3.51Å; V142-M160 WeakPolarHBondContact CA-O 3.5Å; M143-M160 PolarHBondContact N-O 2.96Å; M143-M160 PolarHBondContact O-N 2.88Å; T158-M160 HydrophobicContact CG2-CG 4.35Å
161	L	92.2	Very high	89.1	Confident	4 Å²	4	65.1 Å²	65.1	2%	0.021	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	119.7	169	176.4	62	0	0	0	108.8	F115 W131 E138 V142 M163 Y171	F115-L161 HydrophobicContact CB-CB 4.46Å; F115-L161 WeakPolarHBondContact CB-O 3.43Å; F115-L161 PolarHBondContact O-N 2.97Å; W131-L161 HydrophobicContact CB-CD2 4.24Å; W131-L161 HydrophobicContact CD2-CB 3.84Å; W131-L161 HydrophobicContact CD2-CD2 4.01Å; W131-L161 HydrophobicContact CE3-CB 4.34Å; W131-L161 HydrophobicContact CE3-CD2 3.89Å; W131-L161 HydrophobicContact CG-CB 4.01Å; W131-L161 HydrophobicContact CG-CD2 4.19Å; W131-L161 HydrophobicContact CZ2-CB 4.32Å; E138-L161 HydrophobicContact CB-CD1 4.36Å; E138-L161 HydrophobicContact CG-CD1 3.61Å; V142-L161 HydrophobicContact CG2-CD1 3.95Å; L161-M163 HydrophobicContact CD2-CG 4.37Å; L161-M163 HydrophobicContact CD2-SD 3.77Å; L161-M163 HydrophobicContact CG-CB 4.25Å; L161-M163 HydrophobicContact CG-CG 4.15Å; L161-M163 HydrophobicContact CG-SD 4.16Å; L161-M163 PolarHBondContact O-N 2.65Å; L161-Y171 HydrophobicContact CD2-CD1 3.81Å; L161-Y171 HydrophobicContact CD2-CE1 4.16Å
162	E	88.3	Confident	89.2	Confident	161 Å²	161	63.4 Å²	63.4	75%	0.752	33%	0.332	S	S	*	.			trans	-72.2	119.1	167.7	-173.1	179.5	-178.5	0	0	109.1	G141	G141-E162 PolarHBondContact O-N 3.01Å
163	M	79.6	Confident	89.1	Confident	35 Å²	35	59.5 Å²	59.5	17%	0.172	31%	0.312	C	S	.	.			trans	-157.4	150.6	-177	52.8	174	-79.2	0	0	112.8	F115 L161 P165 Y171 W188	F115-M163 HydrophobicContact CB-CG 3.96Å; F115-M163 HydrophobicContact CB-SD 3.85Å; L161-M163 HydrophobicContact CD2-CG 4.37Å; L161-M163 HydrophobicContact CD2-SD 3.77Å; L161-M163 HydrophobicContact CG-CB 4.25Å; L161-M163 HydrophobicContact CG-CG 4.15Å; L161-M163 HydrophobicContact CG-SD 4.16Å; L161-M163 PolarHBondContact O-N 2.65Å; M163-P165 HydrophobicContact CE-CB 3.69Å; M163-P165 HydrophobicContact CE-CG 4.34Å; M163-Y171 HydrophobicContact CB-CE1 4.35Å; M163-Y171 HydrophobicContact CE-CD1 3.78Å; M163-Y171 HydrophobicContact CE-CD2 3.54Å; M163-Y171 HydrophobicContact CE-CE1 3.43Å; M163-Y171 VanDerWaalsContact CE-CE1 3.43Å; M163-Y171 HydrophobicContact CE-CE2 3.18Å; M163-Y171 HydrophobicContact CE-CG 3.82Å; M163-Y171 HydrophobicContact SD-CD1 3.5Å; M163-Y171 WeakPolarHBondContact SD-CD1 3.32Å; M163-Y171 HydrophobicContact SD-CD2 4.26Å; M163-Y171 HydrophobicContact SD-CE1 3.46Å; M163-Y171 WeakPolarHBondContact SD-CE1 3.2Å; M163-Y171 HydrophobicContact SD-CE2 4.24Å; M163-Y171 HydrophobicContact SD-CG 3.91Å; M163-W188 HydrophobicContact CE-CZ3 3.93Å
164	I	80.3	Confident	89.2	Confident	149 Å²	149	51.6 Å²	51.6	76%	0.764	28%	0.284	S	S	*	.			trans	-109.3	106.2	164.8	-60.2	170.8	0	0	0	105.7	E166	I164-E166 PolarHBondContact O-N 3.12Å
165	P	78.8	Confident	89.2	Confident	61 Å²	61	51 Å²	51	40%	0.396	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-65.6	123.1	-174.2	24	-31.5	0	0	0	111	M163 Y171 W188 A190	M163-P165 HydrophobicContact CE-CB 3.69Å; M163-P165 HydrophobicContact CE-CG 4.34Å; P165-Y171 HydrophobicContact CB-CE2 4.44Å; P165-W188 HydrophobicContact CB-CH2 3.95Å; P165-W188 HydrophobicContact CB-CZ3 4.05Å; P165-W188 HydrophobicContact CG-CH2 4.29Å; P165-A190 HydrophobicContact CB-CB 3.8Å
166	E	81.6	Confident	89.2	Confident	115 Å²	115	53.3 Å²	53.3	54%	0.537	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-91.8	149.3	171.7	-65.5	174.7	-135.2	0	0	110.8	R133 I164 G168 D169 A190	R133-E166 IonicContact CZ-OE1 2.74Å; R133-E166 VanDerWaalsContact NH2-CD 3.32Å; R133-E166 IonicContact NH2-OE1 3.66Å; R133-E166 PolarHBondContact NH2-OE1 2.68Å; R133-E166 IonicContact NH2-OE2 2.78Å; I164-E166 PolarHBondContact O-N 3.12Å; E166-G168 PolarHBondContact O-N 2.87Å; E166-D169 WeakPolarHBondContact CB-OD2 3.43Å; E166-D169 PolarHBondContact N-OD2 2.97Å; E166-D169 WeakPolarHBondContact O-CB 3.46Å; E166-D169 PolarHBondContact O-N 3.12Å; E166-A190 WeakPolarHBondContact O-CB 3.49Å
167	L	81.8	Confident	89.2	Confident	139 Å²	139	51 Å²	51	73%	0.728	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	123.1	-178.3	-176.6	71.3	0	0	0	110.8
168	G	81.9	Confident	89.3	Confident	61 Å²	61	55 Å²	55	63%	0.629	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.4	-4.9	179.2	0	0	0	0	0	114.5	E166	E166-G168 PolarHBondContact O-N 2.87Å
169	D	88.1	Confident	89.2	Confident	13 Å²	13	57.7 Å²	57.7	7%	0.07	33%	0.326	C	S	.	.			trans	-66.3	139.9	170.8	-79.2	-23.5	0	0	0	111.6	R133 N134 E166 Y171 A190	R133-D169 IonicContact CZ-OD2 3Å; R133-D169 IonicContact NE-OD1 3.36Å; R133-D169 IonicContact NE-OD2 3.18Å; R133-D169 PolarHBondContact NE-OD2 2.65Å; R133-D169 IonicContact NH2-OD1 3.01Å; R133-D169 IonicContact NH2-OD2 3.89Å; R133-D169 PolarHBondContact NH2-OD2 2.88Å; N134-D169 PolarHBondContact ND2-OD1 3.15Å; N134-D169 WeakPolarHBondContact OD1-CA 3.3Å; E166-D169 WeakPolarHBondContact CB-OD2 3.43Å; E166-D169 PolarHBondContact N-OD2 2.97Å; E166-D169 WeakPolarHBondContact O-CB 3.46Å; E166-D169 PolarHBondContact O-N 3.12Å; D169-Y171 HydrophobicContact CB-CD2 4.1Å; D169-Y171 HydrophobicContact CB-CE2 3.3Å; D169-Y171 PolarHBondContact OD2-OH 3.3Å; D169-A190 PolarHBondContact O-N 3.47Å; D169-A190 VanDerWaalsContact O-N 3.09Å
170	V	89.4	Confident	89.2	Confident	50 Å²	50	60.3 Å²	60.3	30%	0.303	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	117.4	172.5	-173.3	0	0	0	0	108.8	N134 A187 M189	N134-V170 PolarHBondContact N-O 3.4Å; N134-V170 PolarHBondContact OD1-N 3.36Å; V170-A187 HydrophobicContact CG1-CB 4.33Å; V170-M189 HydrophobicContact CG1-CG 4.48Å; V170-M189 HydrophobicContact CG2-CG 4.18Å
171	Y	90.5	Very high	89.2	Confident	3 Å²	3	62.8 Å²	62.8	1%	0.012	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	141.7	175.5	-63.2	-92.7	0	0	0	109	F132 R133 L161 M163 P165 D169 A187 W188	F132-Y171 CarbonylContact O-C 3.57Å; F132-Y171 WeakPolarHBondContact O-CA 3.46Å; R133-Y171 HydrophobicContact CB-CD1 4.14Å; R133-Y171 HydrophobicContact CB-CE1 3.94Å; R133-Y171 HydrophobicContact CG-CD1 4.18Å; R133-Y171 HydrophobicContact CG-CE1 3.6Å; R133-Y171 PolarHBondContact NE-OH 3.35Å; R133-Y171 VanDerWaalsContact NE-OH 3.11Å; L161-Y171 HydrophobicContact CD2-CD1 3.81Å; L161-Y171 HydrophobicContact CD2-CE1 4.16Å; M163-Y171 HydrophobicContact CB-CE1 4.35Å; M163-Y171 HydrophobicContact CE-CD1 3.78Å; M163-Y171 HydrophobicContact CE-CD2 3.54Å; M163-Y171 HydrophobicContact CE-CE1 3.43Å; M163-Y171 VanDerWaalsContact CE-CE1 3.43Å; M163-Y171 HydrophobicContact CE-CE2 3.18Å; M163-Y171 HydrophobicContact CE-CG 3.82Å; M163-Y171 HydrophobicContact SD-CD1 3.5Å; M163-Y171 WeakPolarHBondContact SD-CD1 3.32Å; M163-Y171 HydrophobicContact SD-CD2 4.26Å; M163-Y171 HydrophobicContact SD-CE1 3.46Å; M163-Y171 WeakPolarHBondContact SD-CE1 3.2Å; M163-Y171 HydrophobicContact SD-CE2 4.24Å; M163-Y171 HydrophobicContact SD-CG 3.91Å; P165-Y171 HydrophobicContact CB-CE2 4.44Å; D169-Y171 HydrophobicContact CB-CD2 4.1Å; D169-Y171 HydrophobicContact CB-CE2 3.3Å; D169-Y171 PolarHBondContact OD2-OH 3.3Å; Y171-A187 CarbonylContact O-C 3.52Å; Y171-A187 VanDerWaalsContact O-CA 3.32Å; Y171-A187 WeakPolarHBondContact O-CA 3.35Å; Y171-W188 AromaticContact CD2-CE3 3.8Å; Y171-W188 HydrophobicContact CD2-CE3 3.8Å; Y171-W188 AromaticContact CD2-CZ3 3.79Å; Y171-W188 HydrophobicContact CD2-CZ3 3.79Å; Y171-W188 HydrophobicContact CE2-CZ3 4.23Å; Y171-W188 HydrophobicContact CG-CE3 4.41Å; Y171-W188 PolarHBondContact N-O 3.37Å; Y171-W188 PolarHBondContact O-N 2.87Å
172	S	92.4	Very high	89.3	Confident	29 Å²	29	72.3 Å²	72.3	20%	0.203	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	140.3	173.5	54.8	0	0	0	0	111.1	W131 F132 V186	W131-S172 CarbonylContact C-O 3.46Å; F132-S172 WeakPolarHBondContact CB-OG 3.35Å; F132-S172 PolarHBondContact N-O 2.75Å; F132-S172 PolarHBondContact O-N 3.41Å; S172-V186 VanDerWaalsContact CA-O 3.29Å; S172-V186 WeakPolarHBondContact CA-O 3.32Å
173	C	92.9	Very high	89.5	Confident	8 Å²	8	68.2 Å²	68.2	5%	0.054	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	125.5	173.1	179.9	0	0	0	0	108.7	V117 V129 R130 W131 S185 V186	V117-C173 HydrophobicContact CG2-CB 3.78Å; V129-C173 WeakPolarHBondContact CG1-SG 3.37Å; R130-C173 WeakPolarHBondContact O-CA 3.31Å; W131-C173 HydrophobicContact CD2-CB 4.18Å; W131-C173 HydrophobicContact CE3-CB 4.04Å; W131-C173 HydrophobicContact CH2-CB 4.01Å; W131-C173 HydrophobicContact CZ2-CB 4.17Å; W131-C173 HydrophobicContact CZ3-CB 3.95Å; C173-S185 VanDerWaalsContact O-CA 3.24Å; C173-S185 WeakPolarHBondContact O-CA 3.25Å; C173-V186 PolarHBondContact N-O 3.5Å; C173-V186 VanDerWaalsContact N-O 3.13Å; C173-V186 PolarHBondContact O-N 2.72Å
174	L	94.4	Very high	90.2	Very high	31 Å²	31	69.9 Å²	69.9	16%	0.162	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	120.9	178	-176.3	70.1	0	0	0	109	V129 R130 F132 P183	V129-L174 WeakPolarHBondContact CA-O 3.38Å; R130-L174 PolarHBondContact N-O 2.96Å; R130-L174 VanDerWaalsContact NH2-CD2 3.3Å; R130-L174 PolarHBondContact O-N 2.82Å; F132-L174 HydrophobicContact CD2-CB 4.32Å; F132-L174 HydrophobicContact CE2-CB 3.83Å; F132-L174 HydrophobicContact CE2-CD2 4.02Å; F132-L174 HydrophobicContact CZ-CD2 4.35Å; L174-P183 HydrophobicContact CD1-CB 3.6Å; L174-P183 HydrophobicContact CG-CB 4.3Å
175	V	94.9	Very high	90.6	Very high	12 Å²	12	66.6 Å²	66.6	7%	0.073	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	122.8	178.1	-176.6	0	0	0	0	109.6	V117 I127 S128 V129 P183 V184	V117-V175 HydrophobicContact CG1-CG2 4.5Å; I127-V175 HydrophobicContact CD1-CG1 4.08Å; I127-V175 HydrophobicContact CG1-CG1 4.23Å; S128-V175 WeakPolarHBondContact O-CA 3.17Å; V129-V175 HydrophobicContact CG1-CG2 4.42Å; V129-V175 HydrophobicContact CG2-CG2 4.44Å; V175-P183 WeakPolarHBondContact O-CA 3.16Å; V175-V184 PolarHBondContact N-O 2.97Å; V175-V184 PolarHBondContact O-N 2.83Å
176	E	96.3	Very high	90.9	Very high	63 Å²	63	68.7 Å²	68.7	29%	0.294	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	128.4	175.1	-69.9	167.3	160.7	0	0	108.7	S128 R130 P183	S128-E176 PolarHBondContact N-O 2.86Å; S128-E176 PolarHBondContact O-N 2.88Å; S128-E176 PolarHBondContact OG-OE2 3.35Å; R130-E176 IonicContact NE-OE2 3.77Å; R130-E176 IonicContact NH2-OE1 2.68Å; R130-E176 PolarHBondContact NH2-OE1 3.36Å; R130-E176 IonicContact NH2-OE2 3.35Å; R130-E176 PolarHBondContact NH2-OE2 3.02Å; E176-P183 HydrophobicContact CG-CB 3.88Å; E176-P183 HydrophobicContact CG-CG 3.97Å
177	H	95.9	Very high	91.2	Very high	18 Å²	18	66.5 Å²	66.5	8%	0.083	40%	0.4	C	S	.	.			trans	-155.3	141.6	-179.3	-178.6	-102.6	0	0	0	110.2	F122 Y123 P124 D126 I127 S179 L180	F122-H177 AromaticContact CD2-CD2 3.92Å; F122-H177 AromaticContact CD2-NE2 3.6Å; Y123-H177 VanDerWaalsContact C-CE1 3.5Å; Y123-H177 PolarHBondContact O-CE1 2.97Å; P124-H177 PolarHBondContact O-NE2 2.87Å; D126-H177 PolarHBondContact O-CD2 3.44Å; D126-H177 VanDerWaalsContact O-CD2 3.28Å; I127-H177 HydrophobicContact CG1-CB 4.37Å; H177-S179 PolarHBondContact CE1-OG 2.92Å; H177-S179 WeakPolarHBondContact ND1-CB 3.49Å; H177-S179 PolarHBondContact ND1-N 3.37Å; H177-S179 VanDerWaalsContact ND1-N 3.19Å; H177-S179 PolarHBondContact ND1-OG 2.88Å; H177-S179 PolarHBondContact O-N 3.22Å; H177-S179 VanDerWaalsContact O-N 3.11Å; H177-L180 HydrophobicContact CB-CD1 4.07Å; H177-L180 HydrophobicContact CB-CG 4.28Å; H177-L180 WeakPolarHBondContact O-CB 3.42Å; H177-L180 PolarHBondContact O-N 2.89Å
178	P	94.9	Very high	91.4	Very high	90 Å²	90	63 Å²	63	58%	0.584	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-24.7	-176.9	-29.3	36.6	0	0	0	115.7	P124 D126 L180	P124-P178 HydrophobicContact CG-CB 4.2Å; P124-P178 HydrophobicContact CG-CG 3.96Å; D126-P178 HydrophobicContact CB-CG 4.48Å; D126-P178 WeakPolarHBondContact O-CD 3.45Å; P178-L180 VanDerWaalsContact C-N 3.25Å; P178-L180 PolarHBondContact O-N 2.86Å
179	S	93.3	Very high	91.4	Very high	81 Å²	81	66.7 Å²	66.7	57%	0.566	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-12.1	175.3	77.1	0	0	0	0	113.7	H177	H177-S179 PolarHBondContact CE1-OG 2.92Å; H177-S179 WeakPolarHBondContact ND1-CB 3.49Å; H177-S179 PolarHBondContact ND1-N 3.37Å; H177-S179 VanDerWaalsContact ND1-N 3.19Å; H177-S179 PolarHBondContact ND1-OG 2.88Å; H177-S179 PolarHBondContact O-N 3.22Å; H177-S179 VanDerWaalsContact O-N 3.11Å
180	L	92.8	Very high	90.9	Very high	62 Å²	62	66.7 Å²	66.7	33%	0.325	38%	0.381	S	S	.	.	S	Bend	trans	-99.4	126.5	-179.1	-61.1	174	0	0	0	109.9	H177 P178 R182 V184	H177-L180 HydrophobicContact CB-CD1 4.07Å; H177-L180 HydrophobicContact CB-CG 4.28Å; H177-L180 WeakPolarHBondContact O-CB 3.42Å; H177-L180 PolarHBondContact O-N 2.89Å; P178-L180 VanDerWaalsContact C-N 3.25Å; P178-L180 PolarHBondContact O-N 2.86Å; L180-R182 PolarHBondContact O-N 2.88Å; L180-V184 HydrophobicContact CD1-CB 4.46Å; L180-V184 HydrophobicContact CD1-CG2 3.95Å; L180-V184 HydrophobicContact CD2-CG2 4.38Å
181	P	93.8	Very high	89.8	Confident	134 Å²	134	68.6 Å²	68.6	87%	0.87	40%	0.395	S	S	*	.	S	Bend	trans	-68.5	-21.2	-179.8	27.5	-34.7	0	0	0	113.1
182	R	93.8	Very high	88.3	Confident	204 Å²	204	72.4 Å²	72.4	77%	0.77	42%	0.422	S	S	*	.	S	Bend	trans	-144.2	153.9	175.1	-62.8	-176.7	-166.8	143.6	4.4	109.3	L180 V184	L180-R182 PolarHBondContact O-N 2.88Å; R182-V184 PolarHBondContact O-N 2.85Å
183	P	92.8	Very high	86.6	Confident	74 Å²	74	80.4 Å²	80.4	48%	0.481	46%	0.456	S	S	.	.			trans	-56.8	138.3	172	-22	33.2	0	0	0	111	L174 V175 E176	L174-P183 HydrophobicContact CD1-CB 3.6Å; L174-P183 HydrophobicContact CG-CB 4.3Å; V175-P183 WeakPolarHBondContact O-CA 3.16Å; E176-P183 HydrophobicContact CG-CB 3.88Å; E176-P183 HydrophobicContact CG-CG 3.97Å
184	V	92.7	Very high	84.9	Confident	70 Å²	70	87.8 Å²	87.8	42%	0.424	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	124.4	176.8	174.5	0	0	0	0	108.1	V175 L180 R182	V175-V184 PolarHBondContact N-O 2.97Å; V175-V184 PolarHBondContact O-N 2.83Å; L180-V184 HydrophobicContact CD1-CB 4.46Å; L180-V184 HydrophobicContact CD1-CG2 3.95Å; L180-V184 HydrophobicContact CD2-CG2 4.38Å; R182-V184 PolarHBondContact O-N 2.85Å
185	S	89.2	Confident	83.2	Confident	80 Å²	80	89.1 Å²	89.1	56%	0.559	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.9	133.7	174.9	63.1	0	0	0	0	111.4	C173	C173-S185 VanDerWaalsContact O-CA 3.24Å; C173-S185 WeakPolarHBondContact O-CA 3.25Å
186	V	85.9	Confident	81.7	Confident	106 Å²	106	95.7 Å²	95.7	64%	0.642	52%	0.52	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.5	128.3	169.8	-179.2	0	0	0	0	107.9	S172 C173	S172-V186 VanDerWaalsContact CA-O 3.29Å; S172-V186 WeakPolarHBondContact CA-O 3.32Å; C173-V186 PolarHBondContact N-O 3.5Å; C173-V186 VanDerWaalsContact N-O 3.13Å; C173-V186 PolarHBondContact O-N 2.72Å
187	A	87.1	Confident	80	Confident	69 Å²	69	98.3 Å²	98.3	57%	0.57	53%	0.532	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.5	139.3	176.3	0	0	0	0	0	110.4	V170 Y171	V170-A187 HydrophobicContact CG1-CB 4.33Å; Y171-A187 CarbonylContact O-C 3.52Å; Y171-A187 VanDerWaalsContact O-CA 3.32Å; Y171-A187 WeakPolarHBondContact O-CA 3.35Å
188	W	85.3	Confident	78.5	Confident	66 Å²	66	105 Å²	105	25%	0.25	56%	0.561	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-128	138	174.6	177.5	89.2	0	0	0	109.3	P114 M163 P165 Y171 A190 P191	P114-W188 HydrophobicContact CB-CD2 3.58Å; P114-W188 HydrophobicContact CB-CE3 4Å; P114-W188 HydrophobicContact CB-CG 4.01Å; P114-W188 HydrophobicContact CB-CH2 3.87Å; P114-W188 HydrophobicContact CB-CZ2 3.45Å; P114-W188 VanDerWaalsContact CB-CZ2 3.45Å; P114-W188 HydrophobicContact CB-CZ3 4.15Å; P114-W188 HydrophobicContact CG-CD2 4.12Å; P114-W188 HydrophobicContact CG-CG 4.45Å; P114-W188 HydrophobicContact CG-CH2 4.26Å; P114-W188 HydrophobicContact CG-CZ2 3.41Å; P114-W188 VanDerWaalsContact CG-CZ2 3.41Å; M163-W188 HydrophobicContact CE-CZ3 3.93Å; P165-W188 HydrophobicContact CB-CH2 3.95Å; P165-W188 HydrophobicContact CB-CZ3 4.05Å; P165-W188 HydrophobicContact CG-CH2 4.29Å; Y171-W188 AromaticContact CD2-CE3 3.8Å; Y171-W188 HydrophobicContact CD2-CE3 3.8Å; Y171-W188 AromaticContact CD2-CZ3 3.79Å; Y171-W188 HydrophobicContact CD2-CZ3 3.79Å; Y171-W188 HydrophobicContact CE2-CZ3 4.23Å; Y171-W188 HydrophobicContact CG-CE3 4.41Å; Y171-W188 PolarHBondContact N-O 3.37Å; Y171-W188 PolarHBondContact O-N 2.87Å; W188-A190 HydrophobicContact CH2-CB 4.39Å; W188-A190 HydrophobicContact CZ3-CB 4.22Å; W188-P191 HydrophobicContact CH2-CG 4.46Å; W188-P191 HydrophobicContact CZ2-CG 3.88Å
189	M	83	Confident	77.2	Confident	138 Å²	138	104.5 Å²	104.5	68%	0.68	55%	0.552	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-107.1	137.8	177.5	-59.3	-176.4	-163.6	0	0	109.3	V170	V170-M189 HydrophobicContact CG1-CG 4.48Å; V170-M189 HydrophobicContact CG2-CG 4.18Å
190	A	76.9	Confident	76.4	Confident	12 Å²	12	105.4 Å²	105.4	10%	0.099	55%	0.55	C	S	.	*	P	Polyproline II helix	trans	-53.9	128.2	173.3	0	0	0	0	0	110.3	P165 E166 D169 W188 S192	P165-A190 HydrophobicContact CB-CB 3.8Å; E166-A190 WeakPolarHBondContact O-CB 3.49Å; D169-A190 PolarHBondContact O-N 3.47Å; D169-A190 VanDerWaalsContact O-N 3.09Å; W188-A190 HydrophobicContact CH2-CB 4.39Å; W188-A190 HydrophobicContact CZ3-CB 4.22Å; A190-S192 PolarHBondContact O-N 3.47Å
191	P	67.3	Low	75.7	Confident	90 Å²	90	106 Å²	106	58%	0.584	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-62.3	135.9	-179.6	-17.9	30.3	0	0	0	109.2	W188 E193	W188-P191 HydrophobicContact CH2-CG 4.46Å; W188-P191 HydrophobicContact CZ2-CG 3.88Å; P191-E193 PolarHBondContact O-N 3.3Å
192	S	58.9	Low	75.1	Confident	84 Å²	84	101.6 Å²	101.6	59%	0.587	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-68.1	119.8	167.4	60.3	0	0	0	0	108.8	A190 Y194	A190-S192 PolarHBondContact O-N 3.47Å; S192-Y194 PolarHBondContact O-N 2.95Å
193	E	56.2	Low	74.8	Confident	197 Å²	197	94.1 Å²	94.1	92%	0.921	52%	0.52	S	S	*	.	S	Bend	trans	-67.5	1.9	-178.2	-129.8	-171.1	-176.3	0	0	114.1	P191	P191-E193 PolarHBondContact O-N 3.3Å
194	Y	57.7	Low	74.5	Confident	162 Å²	162	94.3 Å²	94.3	64%	0.635	52%	0.52	S	S	*	.			trans	-136.8	99.1	-169.5	-138.4	-112.3	0	0	0	113.1	S192 W196 I199	S192-Y194 PolarHBondContact O-N 2.95Å; Y194-W196 PolarHBondContact O-N 3Å; Y194-I199 HydrophobicContact CD1-CD1 4.03Å; Y194-I199 HydrophobicContact CD2-CD1 4.46Å; Y194-I199 HydrophobicContact CE1-CD1 3.24Å; Y194-I199 HydrophobicContact CE2-CD1 3.74Å; Y194-I199 WeakPolarHBondContact OH-CD1 3.26Å
195	S	57.8	Low	74.3	Confident	60 Å²	60	94 Å²	94	42%	0.42	52%	0.524	S	S	.	.			trans	-75	76.2	166.5	-177	0	0	0	0	109.1	E197 K198	S195-E197 PolarHBondContact O-N 3.35Å; S195-K198 PolarHBondContact O-N 3.49Å
196	W	63.2	Low	74.4	Confident	150 Å²	150	97 Å²	97	57%	0.568	53%	0.528	S	S	*	.	H	α-helix	trans	-48.3	-31.8	175.4	65.2	-91.1	0	0	0	112.6	Y194 K198 I199 L200	Y194-W196 PolarHBondContact O-N 3Å; W196-K198 VanDerWaalsContact C-N 3.33Å; W196-K198 PolarHBondContact O-N 2.99Å; W196-I199 PolarHBondContact O-N 3.32Å; W196-L200 HydrophobicContact CE3-CD1 4.35Å; W196-L200 HydrophobicContact CE3-CD2 4.25Å; W196-L200 HydrophobicContact CZ3-CD2 4Å; W196-L200 PolarHBondContact O-N 3.3Å
197	E	62.3	Low	74.8	Confident	118 Å²	118	97.2 Å²	97.2	55%	0.551	53%	0.525	S	S	*	.	H	α-helix	trans	-50	-44.9	171.4	-74.5	-86.1	157.6	0	0	113.5	S195 S201	S195-E197 PolarHBondContact O-N 3.35Å; E197-S201 PolarHBondContact O-N 2.85Å; E197-S201 VanDerWaalsContact O-N 3.1Å
198	K	64.6	Low	75.2	Confident	158 Å²	158	99.1 Å²	99.1	69%	0.687	53%	0.525	S	S	*	.	H	α-helix	trans	-75.3	-34.6	-177.3	-72.1	-177.5	178.9	-179.4	0	111.7	S195 W196 S201 G202	S195-K198 PolarHBondContact O-N 3.49Å; W196-K198 VanDerWaalsContact C-N 3.33Å; W196-K198 PolarHBondContact O-N 2.99Å; K198-S201 PolarHBondContact O-N 2.84Å; K198-S201 PolarHBondContact O-OG 2.93Å; K198-G202 PolarHBondContact O-N 2.97Å
199	I	66.8	Low	75.6	Confident	79 Å²	79	98 Å²	98	41%	0.405	53%	0.533	S	S	.	.	H	α-helix	trans	-73.8	-37.5	177.5	-66.3	172.4	0	0	0	110.4	Y194 W196 S201 G202 A203	Y194-I199 HydrophobicContact CD1-CD1 4.03Å; Y194-I199 HydrophobicContact CD2-CD1 4.46Å; Y194-I199 HydrophobicContact CE1-CD1 3.24Å; Y194-I199 HydrophobicContact CE2-CD1 3.74Å; Y194-I199 WeakPolarHBondContact OH-CD1 3.26Å; W196-I199 PolarHBondContact O-N 3.32Å; I199-S201 VanDerWaalsContact C-N 3.32Å; I199-S201 PolarHBondContact O-N 3.4Å; I199-G202 PolarHBondContact O-N 3.49Å; I199-A203 VanDerWaalsContact O-CB 3.24Å; I199-A203 WeakPolarHBondContact O-CB 3.26Å; I199-A203 PolarHBondContact O-N 3.5Å
200	L	76.4	Confident	76.2	Confident	101 Å²	101	94.9 Å²	94.9	53%	0.529	52%	0.519	S	S	.	.	H	α-helix	trans	-59.3	-45.2	170.7	-117.1	75.6	0	0	0	110.6	W196 G202 A203 T204	W196-L200 HydrophobicContact CE3-CD1 4.35Å; W196-L200 HydrophobicContact CE3-CD2 4.25Å; W196-L200 HydrophobicContact CZ3-CD2 4Å; W196-L200 PolarHBondContact O-N 3.3Å; L200-G202 PolarHBondContact O-N 3.5Å; L200-A203 PolarHBondContact O-N 2.88Å; L200-T204 WeakPolarHBondContact O-CB 3.32Å; L200-T204 PolarHBondContact O-N 2.76Å; L200-T204 PolarHBondContact O-OG1 2.86Å
201	S	77.8	Confident	77	Confident	75 Å²	75	98.1 Å²	98.1	52%	0.524	54%	0.538	S	S	.	.	H	α-helix	trans	-62.3	-40.8	176.9	76.1	0	0	0	0	113.1	E197 K198 I199 T204 A205	E197-S201 PolarHBondContact O-N 2.85Å; E197-S201 VanDerWaalsContact O-N 3.1Å; K198-S201 PolarHBondContact O-N 2.84Å; K198-S201 PolarHBondContact O-OG 2.93Å; I199-S201 VanDerWaalsContact C-N 3.32Å; I199-S201 PolarHBondContact O-N 3.4Å; S201-T204 PolarHBondContact O-N 3.3Å; S201-A205 PolarHBondContact O-N 2.97Å; S201-A205 VanDerWaalsContact O-N 3.09Å
202	G	82.4	Confident	78.4	Confident	40 Å²	40	99 Å²	99	41%	0.412	54%	0.541	S	S	.	.	H	α-helix	trans	-69.2	-43.2	179.3	0	0	0	0	0	112.6	K198 I199 L200 T204 A205 F206	K198-G202 PolarHBondContact O-N 2.97Å; I199-G202 PolarHBondContact O-N 3.49Å; L200-G202 PolarHBondContact O-N 3.5Å; G202-T204 VanDerWaalsContact C-N 3.34Å; G202-T204 PolarHBondContact O-N 3.47Å; G202-A205 PolarHBondContact O-N 3.37Å; G202-F206 WeakPolarHBondContact O-CB 3.36Å; G202-F206 PolarHBondContact O-N 3.09Å
203	A	86.6	Confident	80	Confident	47 Å²	47	102.1 Å²	102.1	39%	0.388	54%	0.544	S	S	.	.	H	α-helix	trans	-64.3	-40	176.6	0	0	0	0	0	111.5	I199 L200 F206 L207	I199-A203 VanDerWaalsContact O-CB 3.24Å; I199-A203 WeakPolarHBondContact O-CB 3.26Å; I199-A203 PolarHBondContact O-N 3.5Å; L200-A203 PolarHBondContact O-N 2.88Å; A203-F206 PolarHBondContact O-N 2.69Å; A203-L207 WeakPolarHBondContact O-CB 3.44Å; A203-L207 VanDerWaalsContact O-CG 3.27Å; A203-L207 WeakPolarHBondContact O-CG 3.48Å; A203-L207 PolarHBondContact O-N 2.85Å
204	T	86.5	Confident	81.9	Confident	79 Å²	79	97.9 Å²	97.9	49%	0.485	53%	0.528	S	S	.	.	H	α-helix	trans	-64.6	-43.7	177.5	-44.1	0	0	0	0	111.1	L200 S201 G202 L208	L200-T204 WeakPolarHBondContact O-CB 3.32Å; L200-T204 PolarHBondContact O-N 2.76Å; L200-T204 PolarHBondContact O-OG1 2.86Å; S201-T204 PolarHBondContact O-N 3.3Å; G202-T204 VanDerWaalsContact C-N 3.34Å; G202-T204 PolarHBondContact O-N 3.47Å; T204-L208 WeakPolarHBondContact O-CG 3.22Å; T204-L208 PolarHBondContact O-N 3.08Å; T204-L208 VanDerWaalsContact O-N 3.07Å
205	A	89.3	Confident	83.7	Confident	62 Å²	62	94.5 Å²	94.5	51%	0.512	52%	0.523	S	S	.	.	H	α-helix	trans	-65	-40.4	176.6	0	0	0	0	0	112.6	S201 G202 L208 G209	S201-A205 PolarHBondContact O-N 2.97Å; S201-A205 VanDerWaalsContact O-N 3.09Å; G202-A205 PolarHBondContact O-N 3.37Å; A205-L208 PolarHBondContact O-N 2.9Å; A205-G209 PolarHBondContact O-N 3.29Å
206	F	91.3	Very high	85.4	Confident	144 Å²	144	93.4 Å²	93.4	63%	0.632	52%	0.522	S	S	*	.	H	α-helix	trans	-66.2	-42.5	178.4	-172.7	-103.7	0	0	0	112.3	G202 A203 G209 L210	G202-F206 WeakPolarHBondContact O-CB 3.36Å; G202-F206 PolarHBondContact O-N 3.09Å; A203-F206 PolarHBondContact O-N 2.69Å; F206-G209 PolarHBondContact O-N 3.48Å; F206-L210 HydrophobicContact CD1-CD1 3.82Å; F206-L210 HydrophobicContact CD1-CG 4.42Å; F206-L210 HydrophobicContact CE1-CD1 3.4Å; F206-L210 VanDerWaalsContact CE1-CD1 3.4Å; F206-L210 HydrophobicContact CE1-CG 4.09Å; F206-L210 HydrophobicContact CZ-CD1 4.03Å; F206-L210 HydrophobicContact CZ-CG 4.32Å; F206-L210 PolarHBondContact O-N 3.3Å
207	L	94.2	Very high	86.8	Confident	111 Å²	111	87.9 Å²	87.9	58%	0.581	51%	0.508	S	S	*	.	H	α-helix	trans	-63	-43.7	175.5	-72.2	171.6	0	0	0	111.6	A203 G209 L210 T211	A203-L207 WeakPolarHBondContact O-CB 3.44Å; A203-L207 VanDerWaalsContact O-CG 3.27Å; A203-L207 WeakPolarHBondContact O-CG 3.48Å; A203-L207 PolarHBondContact O-N 2.85Å; L207-G209 VanDerWaalsContact C-N 3.35Å; L207-G209 PolarHBondContact O-N 3.35Å; L207-L210 PolarHBondContact O-N 2.73Å; L207-T211 WeakPolarHBondContact O-CG2 3.32Å; L207-T211 PolarHBondContact O-N 3.46Å; L207-T211 VanDerWaalsContact O-N 3.1Å
208	L	94.6	Very high	88.3	Confident	109 Å²	109	86 Å²	86	57%	0.571	50%	0.504	S	S	*	.	H	α-helix	trans	-60.4	-44.3	174.5	-71.7	170.7	0	0	0	111.4	T204 A205 L210 T211 V212	T204-L208 WeakPolarHBondContact O-CG 3.22Å; T204-L208 PolarHBondContact O-N 3.08Å; T204-L208 VanDerWaalsContact O-N 3.07Å; A205-L208 PolarHBondContact O-N 2.9Å; L208-L210 PolarHBondContact O-N 3.49Å; L208-T211 PolarHBondContact O-N 2.87Å; L208-T211 PolarHBondContact O-OG1 2.89Å; L208-V212 WeakPolarHBondContact O-CG2 3.37Å; L208-V212 PolarHBondContact O-N 3.21Å
209	G	93.7	Very high	89.6	Confident	41 Å²	41	83.7 Å²	83.7	42%	0.423	50%	0.498	S	S	.	.	H	α-helix	trans	-59.6	-44.4	176.4	0	0	0	0	0	113.6	A205 F206 L207 T211 V212 F213	A205-G209 PolarHBondContact O-N 3.29Å; F206-G209 PolarHBondContact O-N 3.48Å; L207-G209 VanDerWaalsContact C-N 3.35Å; L207-G209 PolarHBondContact O-N 3.35Å; G209-T211 VanDerWaalsContact C-N 3.35Å; G209-T211 PolarHBondContact O-N 2.92Å; G209-V212 PolarHBondContact O-N 3.41Å; G209-F213 WeakPolarHBondContact O-CB 3.38Å; G209-F213 PolarHBondContact O-N 3.07Å
210	L	95.7	Very high	90.6	Very high	73 Å²	73	85.1 Å²	85.1	38%	0.382	50%	0.503	S	S	.	.	H	α-helix	trans	-62.1	-40.1	176.8	-80.2	173.9	0	0	0	112.4	F206 L207 L208 F213 L214	F206-L210 HydrophobicContact CD1-CD1 3.82Å; F206-L210 HydrophobicContact CD1-CG 4.42Å; F206-L210 HydrophobicContact CE1-CD1 3.4Å; F206-L210 VanDerWaalsContact CE1-CD1 3.4Å; F206-L210 HydrophobicContact CE1-CG 4.09Å; F206-L210 HydrophobicContact CZ-CD1 4.03Å; F206-L210 HydrophobicContact CZ-CG 4.32Å; F206-L210 PolarHBondContact O-N 3.3Å; L207-L210 PolarHBondContact O-N 2.73Å; L208-L210 PolarHBondContact O-N 3.49Å; L210-F213 PolarHBondContact O-N 3.04Å; L210-L214 WeakPolarHBondContact O-CB 3.48Å; L210-L214 VanDerWaalsContact O-CG 3.29Å; L210-L214 WeakPolarHBondContact O-CG 3.47Å; L210-L214 PolarHBondContact O-N 2.81Å
211	T	94.5	Very high	91.1	Very high	81 Å²	81	85.5 Å²	85.5	50%	0.497	51%	0.505	S	S	.	.	H	α-helix	trans	-64	-44.2	178.2	61.3	0	0	0	0	112.1	L207 L208 G209 F213 L214 V215	L207-T211 WeakPolarHBondContact O-CG2 3.32Å; L207-T211 PolarHBondContact O-N 3.46Å; L207-T211 VanDerWaalsContact O-N 3.1Å; L208-T211 PolarHBondContact O-N 2.87Å; L208-T211 PolarHBondContact O-OG1 2.89Å; G209-T211 VanDerWaalsContact C-N 3.35Å; G209-T211 PolarHBondContact O-N 2.92Å; T211-F213 VanDerWaalsContact C-N 3.35Å; T211-F213 PolarHBondContact O-N 3.4Å; T211-L214 PolarHBondContact O-N 2.96Å; T211-V215 VanDerWaalsContact O-CG2 3.3Å; T211-V215 WeakPolarHBondContact O-CG2 3.29Å; T211-V215 PolarHBondContact O-N 3.22Å
212	V	95.1	Very high	91.5	Very high	107 Å²	107	89.2 Å²	89.2	65%	0.648	51%	0.512	S	S	*	.	H	α-helix	trans	-63.1	-42.7	176.9	174.9	0	0	0	0	110.9	L208 G209 V215 G216	L208-V212 WeakPolarHBondContact O-CG2 3.37Å; L208-V212 PolarHBondContact O-N 3.21Å; G209-V212 PolarHBondContact O-N 3.41Å; V212-V215 PolarHBondContact O-N 3.35Å; V212-G216 PolarHBondContact O-N 3.38Å
213	F	94.5	Very high	91.5	Very high	150 Å²	150	90.1 Å²	90.1	66%	0.658	52%	0.516	S	S	*	.	H	α-helix	trans	-63.1	-46.2	178.3	-177	-98.9	0	0	0	112.4	G209 L210 T211 G216 A217	G209-F213 WeakPolarHBondContact O-CB 3.38Å; G209-F213 PolarHBondContact O-N 3.07Å; L210-F213 PolarHBondContact O-N 3.04Å; T211-F213 VanDerWaalsContact C-N 3.35Å; T211-F213 PolarHBondContact O-N 3.4Å; F213-G216 PolarHBondContact O-N 2.84Å; F213-A217 WeakPolarHBondContact O-CB 3.48Å; F213-A217 PolarHBondContact O-N 3.04Å
214	L	94.9	Very high	91.2	Very high	109 Å²	109	92.8 Å²	92.8	57%	0.571	52%	0.52	S	S	*	.	H	α-helix	trans	-63.9	-42.2	179.2	-71.5	173.6	0	0	0	112	L210 T211 A217 V218	L210-L214 WeakPolarHBondContact O-CB 3.48Å; L210-L214 VanDerWaalsContact O-CG 3.29Å; L210-L214 WeakPolarHBondContact O-CG 3.47Å; L210-L214 PolarHBondContact O-N 2.81Å; T211-L214 PolarHBondContact O-N 2.96Å; L214-A217 PolarHBondContact O-N 3.48Å; L214-V218 WeakPolarHBondContact O-CG2 3.12Å; L214-V218 PolarHBondContact O-N 2.92Å
215	V	95.5	Very high	90.8	Very high	90 Å²	90	96 Å²	96	55%	0.545	53%	0.527	S	S	.	.	H	α-helix	trans	-62.9	-44.8	175.5	172.7	0	0	0	0	110.6	T211 V212 A217 V218 I219	T211-V215 VanDerWaalsContact O-CG2 3.3Å; T211-V215 WeakPolarHBondContact O-CG2 3.29Å; T211-V215 PolarHBondContact O-N 3.22Å; V212-V215 PolarHBondContact O-N 3.35Å; V215-A217 PolarHBondContact O-N 3.46Å; V215-V218 PolarHBondContact O-N 3.49Å; V215-I219 HydrophobicContact CG1-CD1 3.87Å; V215-I219 WeakPolarHBondContact O-CG1 3.18Å; V215-I219 PolarHBondContact O-N 3.4Å
216	G	93.1	Very high	89.8	Confident	37 Å²	37	95.6 Å²	95.6	38%	0.381	52%	0.524	S	S	.	.	H	α-helix	trans	-59.2	-44.5	175.4	0	0	0	0	0	112.8	V212 F213 V218 I219 H220	V212-G216 PolarHBondContact O-N 3.38Å; F213-G216 PolarHBondContact O-N 2.84Å; G216-V218 PolarHBondContact O-N 3.39Å; G216-I219 PolarHBondContact O-N 2.8Å; G216-H220 WeakPolarHBondContact O-CB 3.12Å; G216-H220 PolarHBondContact O-N 3.33Å
217	A	93.3	Very high	88.2	Confident	35 Å²	35	93.1 Å²	93.1	29%	0.289	52%	0.524	S	S	.	.	H	α-helix	trans	-62.3	-42.5	176.9	0	0	0	0	0	112.1	F213 L214 V215 H220 L221	F213-A217 WeakPolarHBondContact O-CB 3.48Å; F213-A217 PolarHBondContact O-N 3.04Å; L214-A217 PolarHBondContact O-N 3.48Å; V215-A217 PolarHBondContact O-N 3.46Å; A217-H220 PolarHBondContact O-N 3.35Å; A217-L221 WeakPolarHBondContact O-CB 3.24Å; A217-L221 WeakPolarHBondContact O-CG 3.37Å; A217-L221 PolarHBondContact O-N 3.04Å
218	V	93.2	Very high	86.3	Confident	78 Å²	78	95.8 Å²	95.8	47%	0.473	54%	0.536	S	S	.	.	H	α-helix	trans	-63.5	-43.2	176.4	171	0	0	0	0	111.5	L214 V215 G216 L221 K222	L214-V218 WeakPolarHBondContact O-CG2 3.12Å; L214-V218 PolarHBondContact O-N 2.92Å; V215-V218 PolarHBondContact O-N 3.49Å; G216-V218 PolarHBondContact O-N 3.39Å; V218-L221 PolarHBondContact O-N 3.33Å; V218-K222 HydrophobicContact CG1-CD 4.41Å; V218-K222 WeakPolarHBondContact O-CB 3.39Å; V218-K222 WeakPolarHBondContact O-CG 3.31Å; V218-K222 PolarHBondContact O-N 3.08Å
219	I	91.9	Very high	84.6	Confident	109 Å²	109	98 Å²	98	56%	0.559	54%	0.544	S	S	*	.	H	α-helix	trans	-62.7	-45.1	176.8	-67	167.1	0	0	0	110.3	V215 G216 K222 A223	V215-I219 HydrophobicContact CG1-CD1 3.87Å; V215-I219 WeakPolarHBondContact O-CG1 3.18Å; V215-I219 PolarHBondContact O-N 3.4Å; G216-I219 PolarHBondContact O-N 2.8Å; I219-K222 PolarHBondContact O-N 3.47Å; I219-A223 WeakPolarHBondContact O-CB 3.4Å; I219-A223 PolarHBondContact O-N 3.39Å
220	H	88.5	Confident	82.5	Confident	110 Å²	110	101.7 Å²	101.7	51%	0.509	56%	0.558	S	S	.	*	H	α-helix	trans	-63.4	-43.9	178.9	-175.1	-91.6	0	0	0	112.4	G216 A217 K222 A223 Q224	G216-H220 WeakPolarHBondContact O-CB 3.12Å; G216-H220 PolarHBondContact O-N 3.33Å; A217-H220 PolarHBondContact O-N 3.35Å; H220-K222 VanDerWaalsContact C-N 3.35Å; H220-K222 PolarHBondContact O-N 3.24Å; H220-A223 PolarHBondContact O-N 3.38Å; H220-Q224 PolarHBondContact CE1-NE2 3.47Å; H220-Q224 VanDerWaalsContact CE1-NE2 3.29Å; H220-Q224 PolarHBondContact O-N 3.29Å
221	L	87.6	Confident	80.1	Confident	109 Å²	109	106.5 Å²	106.5	57%	0.571	58%	0.578	S	S	*	*	H	α-helix	trans	-64.3	-38.3	176	-71.4	170.5	0	0	0	112	A217 V218 K225	A217-L221 WeakPolarHBondContact O-CB 3.24Å; A217-L221 WeakPolarHBondContact O-CG 3.37Å; A217-L221 PolarHBondContact O-N 3.04Å; V218-L221 PolarHBondContact O-N 3.33Å; L221-K225 WeakPolarHBondContact O-CB 3.35Å; L221-K225 PolarHBondContact O-N 3.33Å
222	K	86.1	Confident	77.6	Confident	152 Å²	152	108.8 Å²	108.8	66%	0.661	59%	0.594	S	S	*	*	H	α-helix	trans	-64.7	-39.6	172.7	-77	-175.6	176.9	-175.3	0	112	V218 I219 H220 K225 A226	V218-K222 HydrophobicContact CG1-CD 4.41Å; V218-K222 WeakPolarHBondContact O-CB 3.39Å; V218-K222 WeakPolarHBondContact O-CG 3.31Å; V218-K222 PolarHBondContact O-N 3.08Å; I219-K222 PolarHBondContact O-N 3.47Å; H220-K222 VanDerWaalsContact C-N 3.35Å; H220-K222 PolarHBondContact O-N 3.24Å; K222-K225 PolarHBondContact O-N 3.28Å; K222-A226 PolarHBondContact O-N 2.91Å
223	A	81.8	Confident	75	Confident	60 Å²	60	106.8 Å²	106.8	50%	0.496	60%	0.596	S	S	.	*	H	α-helix	trans	-67	-41.9	176.8	0	0	0	0	0	112.4	I219 H220 K225 A226 S227	I219-A223 WeakPolarHBondContact O-CB 3.4Å; I219-A223 PolarHBondContact O-N 3.39Å; H220-A223 PolarHBondContact O-N 3.38Å; A223-K225 VanDerWaalsContact C-N 3.33Å; A223-K225 PolarHBondContact O-N 3.5Å; A223-A226 PolarHBondContact O-N 3.06Å; A223-S227 PolarHBondContact O-N 3.31Å
224	Q	80.5	Confident	72.2	Confident	102 Å²	102	107.6 Å²	107.6	48%	0.477	61%	0.607	S	S	.	*	H	α-helix	trans	-61.9	-41.3	173.9	-75.7	-166.8	-28.3	0	0	111.9	H220 A226 S227 M228	H220-Q224 PolarHBondContact CE1-NE2 3.47Å; H220-Q224 VanDerWaalsContact CE1-NE2 3.29Å; H220-Q224 PolarHBondContact O-N 3.29Å; Q224-A226 PolarHBondContact O-N 2.98Å; Q224-S227 PolarHBondContact O-N 3.4Å; Q224-M228 PolarHBondContact O-N 3.32Å
225	K	77.8	Confident	69.7	Low	147 Å²	147	112 Å²	112	64%	0.639	63%	0.625	S	S	*	*	H	α-helix	trans	-62.7	-42.4	176.8	-165.8	175.2	-179.1	-178.1	0	112.1	L221 K222 A223 S227 M228 E229	L221-K225 WeakPolarHBondContact O-CB 3.35Å; L221-K225 PolarHBondContact O-N 3.33Å; K222-K225 PolarHBondContact O-N 3.28Å; A223-K225 VanDerWaalsContact C-N 3.33Å; A223-K225 PolarHBondContact O-N 3.5Å; K225-S227 VanDerWaalsContact C-N 3.34Å; K225-S227 PolarHBondContact O-N 3.36Å; K225-M228 PolarHBondContact O-N 3.45Å; K225-E229 PolarHBondContact O-N 3.05Å
226	A	68.3	Low	67.2	Low	53 Å²	53	111.7 Å²	111.7	44%	0.438	63%	0.631	S	S	.	*	H	α-helix	trans	-65.3	-34.3	176.1	0	0	0	0	0	113.2	K222 A223 Q224 E229 T230	K222-A226 PolarHBondContact O-N 2.91Å; A223-A226 PolarHBondContact O-N 3.06Å; Q224-A226 PolarHBondContact O-N 2.98Å; A226-E229 PolarHBondContact O-N 2.62Å; A226-T230 PolarHBondContact O-OG1 2.83Å
227	S	56.8	Low	64.7	Low	92 Å²	92	115.7 Å²	115.7	64%	0.643	65%	0.653	S	S	*	*	H	α-helix	trans	-71.9	-31.9	175.8	-169.6	0	0	0	0	113	A223 Q224 K225 E229	A223-S227 PolarHBondContact O-N 3.31Å; Q224-S227 PolarHBondContact O-N 3.4Å; K225-S227 VanDerWaalsContact C-N 3.34Å; K225-S227 PolarHBondContact O-N 3.36Å; S227-E229 VanDerWaalsContact C-N 3.27Å
228	M	55.8	Low	62.1	Low	167 Å²	167	126.4 Å²	126.4	82%	0.823	69%	0.686	S	S	*	*	H	α-helix	trans	-72	-21.5	174.4	-75.1	173.4	77.8	0	0	112.7	Q224 K225	Q224-M228 PolarHBondContact O-N 3.32Å; K225-M228 PolarHBondContact O-N 3.45Å
229	E	57.3	Low	59.6	Low	157 Å²	157	126.5 Å²	126.5	73%	0.734	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-9.2	179.7	-127.5	163.3	176.3	0	0	113.6	K225 A226 S227	K225-E229 PolarHBondContact O-N 3.05Å; A226-E229 PolarHBondContact O-N 2.62Å; S227-E229 VanDerWaalsContact C-N 3.27Å
230	T	50.3	Low	57.2	Low	117 Å²	117	128.8 Å²	128.8	72%	0.718	71%	0.708	S	S	*	*	S	Bend	trans	-101.9	25.6	-173.2	-47.8	0	0	0	0	114.6	A226	A226-T230 PolarHBondContact O-OG1 2.83Å
231	Q	46	Very low	54.9	Low	175 Å²	175	131.3 Å²	131.3	82%	0.818	72%	0.724	S	S	*	*			trans	-149.6	106.5	168.7	-144.8	164.9	-26.4	0	0	109.4
232	P	42.3	Very low	53.2	Low	128 Å²	128	131.2 Å²	131.2	83%	0.831	73%	0.73	S	S	*	*	S	Bend		-143.3	158.1	67	36.6	-18	0	0	0	116.6
233	G	39.1	Very low	51.6	Low	66 Å²	66	129 Å²	129	68%	0.68	73%	0.732	S	S	*	*			trans	112.7	101.5	150.9	0	0	0	0	0	116.5
234	N	36.8	Very low	49.5	Very low	166 Å²	166	134.6 Å²	134.6	89%	0.888	75%	0.747	S	S	*	*			trans	-173.3	80.4	140.7	-93.7	-16.3	0	0	0	110.8
235	E	41	Very low	48.3	Very low	202 Å²	202	134.2 Å²	134.2	94%	0.944	75%	0.754	S	S	*	*			trans	-115.1	72.8	158.9	-163.4	167.8	-152.8	0	0	107.3
236	A	44.3	Very low	46.5	Very low	83 Å²	83	141.6 Å²	141.6	69%	0.686	78%	0.78	S	S	*	*			trans	-164.7	134.6	166.6	0	0	0	0	0	109.5
237	S	40	Very low	45.4	Very low	121 Å²	121	146.1 Å²	146.1	85%	0.846	80%	0.797	S	S	*	*			trans	94.4	60.4	174.2	-45.6	0	0	0	0	117.2
238	R	39.2	Very low	44.8	Very low	260 Å²	260	148.9 Å²	148.9	98%	0.981	81%	0.805	S	S	*	*			trans	-120	89.1	134.8	-96.2	-169.7	-164.3	120.3	3.6	108.5
239	A	41.4	Very low	44.2	Very low	80 Å²	80	147.9 Å²	147.9	66%	0.661	80%	0.804	S	S	*	*			trans	-130.4	131.9	161.7	0	0	0	0	0	107.8
240	L	40.5	Very low	43.5	Very low	158 Å²	158	147.4 Å²	147.4	83%	0.827	81%	0.808	S	S	*	*			trans	79.7	111.1	152	-58.7	154.5	0	0	0	117.4
241	L	40.9	Very low	43	Very low	162 Å²	162	149.3 Å²	149.3	85%	0.848	81%	0.814	S	S	*	*				177.3	161.6	105.7	-93	164.6	0	0	0	110.8
242	P	50.9	Low	42.8	Very low	108 Å²	108	147.5 Å²	147.5	70%	0.701	81%	0.813	S	S	*	*				-117.8	-172	-118.4	45.3	-32	0	0	0	113.2
243	P	53.2	Low	42.9	Very low	106 Å²	106	148.9 Å²	148.9	69%	0.688	81%	0.812	S	S	*	*			trans	-102.7	178.6	-164.1	39.6	-32	0	0	0	115.5
244	H	36.8	Very low	43.2	Very low	176 Å²	176	155.3 Å²	155.3	82%	0.815	82%	0.822	S	S	*	*			trans	102.9	163.7	163.2	-74.4	-55.9	0	0	0	118
245	P	55.8	Low	43.7	Very low	95 Å²	95	154.4 Å²	154.4	62%	0.617	82%	0.817	S	S	*	*			cis	-138.4	158.4	-41.3	35.9	-20.1	0	0	0	113.5
246	Y	40.3	Very low	43.9	Very low	302 Å²	302	150.1 Å²	150.1	100%	1.184	81%	0.805	S	S	*	*				172.7	0	125.9	-94.2	-67.7	0	0	0	109.2

Retrieved 246 of 246 residues in 169.7 ms (Link to these results)

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