A0A087YCU8_POEFO Loading...

Src like adaptor 2a

AlphaFold DB , UniProt , Accession A0A087YCU8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 253 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	43.1	Very low	35.1	Very low	253 Å²	253	153.4 Å²	153.4	100%	1.246	85%	0.854	S	S	*	*				0	103.1	0	-75.2	-98.7	-103.7	0	0	107.2
2	G	33.8	Very low	35.1	Very low	84 Å²	84	155.3 Å²	155.3	87%	0.866	85%	0.851	S	S	*	*			trans	-175.7	102.6	-176.3	0	0	0	0	0	110.6
3	T	38.8	Very low	35	Very low	142 Å²	142	152.7 Å²	152.7	87%	0.871	84%	0.844	S	S	*	*			trans	-93.9	137	167.6	46.5	0	0	0	0	109.1
4	C	28.6	Very low	35	Very low	130 Å²	130	151.2 Å²	151.2	88%	0.878	84%	0.84	S	S	*	*			trans	-166.1	153.7	134.6	-138.9	0	0	0	0	113.4
5	Y	34.1	Very low	35.2	Very low	219 Å²	219	151.3 Å²	151.3	86%	0.859	84%	0.837	S	S	*	*			trans	-71.7	148.5	-168.3	-92.2	-107.9	0	0	0	116
6	T	36	Very low	35.1	Very low	142 Å²	142	152.1 Å²	152.1	87%	0.871	83%	0.833	S	S	*	*			trans	-143.6	129.4	141.1	-32.9	0	0	0	0	112.8
7	R	35	Very low	35	Very low	184 Å²	184	152.6 Å²	152.6	69%	0.694	84%	0.835	S	S	*	*			trans	-69.8	132.6	177.4	178.9	-175.8	-173.9	169.1	1.3	111.4	Q9	R7-Q9 HydrophobicContact CG-CG 4.4Å; R7-Q9 VanDerWaalsContact NH2-NE2 3.17Å
8	C	32.6	Very low	34.8	Very low	130 Å²	130	154.1 Å²	154.1	88%	0.878	84%	0.835	S	S	*	*			trans	-120.7	105.2	157.6	-74.7	0	0	0	0	108.5
9	Q	31.9	Very low	35	Very low	133 Å²	133	152 Å²	152	62%	0.621	83%	0.833	S	S	*	*			trans	-77.2	122.2	165	-82.3	167.8	-53.6	0	0	108.3	R7	R7-Q9 HydrophobicContact CG-CG 4.4Å; R7-Q9 VanDerWaalsContact NH2-NE2 3.17Å
10	C	33	Very low	34.8	Very low	117 Å²	117	147.9 Å²	147.9	79%	0.791	83%	0.827	S	S	*	*			trans	-104.2	103	155.1	30.5	0	0	0	0	107.4	Q12	C10-Q12 PolarHBondContact O-N 3.28Å
11	N	38.8	Very low	34.9	Very low	153 Å²	153	146.1 Å²	146.1	82%	0.818	83%	0.825	S	S	*	*			trans	-69.2	107.7	165	-74.4	-15.1	0	0	0	107.4
12	Q	35.8	Very low	34.5	Very low	176 Å²	176	138.6 Å²	138.6	82%	0.822	80%	0.803	S	S	*	*			trans	-124.5	105.9	164.8	-149.5	155.9	4.8	0	0	108.1	C10 V14	C10-Q12 PolarHBondContact O-N 3.28Å; Q12-V14 PolarHBondContact O-N 3.21Å
13	T	33.8	Very low	34.6	Very low	122 Å²	122	140 Å²	140	75%	0.748	80%	0.795	S	S	*	*			trans	-49.5	124.9	171	43.5	0	0	0	0	109.6	L15	T13-L15 PolarHBondContact O-N 3.06Å
14	V	35.1	Very low	34.7	Very low	132 Å²	132	138.8 Å²	138.8	80%	0.8	79%	0.789	S	S	*	*			trans	-60.2	98.6	167.4	178	0	0	0	0	107.3	Q12 E16	Q12-V14 PolarHBondContact O-N 3.21Å; V14-E16 HydrophobicContact CG1-CG 4.29Å; V14-E16 PolarHBondContact O-N 3.01Å
15	L	37.7	Very low	35.3	Very low	152 Å²	152	144 Å²	144	80%	0.796	79%	0.791	S	S	*	*			trans	-80.8	99.2	158.6	-92	156.5	0	0	0	105.6	T13 N17	T13-L15 PolarHBondContact O-N 3.06Å; L15-N17 PolarHBondContact O-N 3.21Å
16	E	33.3	Very low	36.1	Very low	164 Å²	164	142.3 Å²	142.3	77%	0.766	79%	0.79	S	S	*	*			trans	-51.8	110.3	162.4	-76.1	175.3	132.5	0	0	107.9	V14 Q18	V14-E16 HydrophobicContact CG1-CG 4.29Å; V14-E16 PolarHBondContact O-N 3.01Å; E16-Q18 VanDerWaalsContact C-N 3.26Å; E16-Q18 PolarHBondContact O-N 3.05Å
17	N	32.9	Very low	37.4	Very low	161 Å²	161	143.6 Å²	143.6	86%	0.861	78%	0.779	S	S	*	*			trans	-66.9	96.9	165.2	-100.6	-4.1	0	0	0	106.9	L15 S19	L15-N17 PolarHBondContact O-N 3.21Å; N17-S19 PolarHBondContact O-N 2.91Å
18	Q	31.9	Very low	39.6	Very low	180 Å²	180	143.1 Å²	143.1	84%	0.841	79%	0.785	S	S	*	*			trans	-50.3	122.4	167.7	-66.1	178.4	18.1	0	0	107.8	E16 G20	E16-Q18 VanDerWaalsContact C-N 3.26Å; E16-Q18 PolarHBondContact O-N 3.05Å; Q18-G20 PolarHBondContact O-N 3.3Å
19	S	38.2	Very low	42.4	Very low	114 Å²	114	139.6 Å²	139.6	80%	0.797	76%	0.762	S	S	*	*			trans	-46.2	114.5	176.6	49.7	0	0	0	0	109.6	N17 S21	N17-S19 PolarHBondContact O-N 2.91Å; S19-S21 PolarHBondContact O-N 2.99Å
20	G	32	Very low	45.4	Very low	70 Å²	70	134.3 Å²	134.3	72%	0.722	74%	0.739	S	S	*	*			trans	-47.6	129.1	172	0	0	0	0	0	109.3	Q18 A22	Q18-G20 PolarHBondContact O-N 3.3Å; G20-A22 PolarHBondContact O-N 2.76Å
21	S	35.8	Very low	48.4	Very low	110 Å²	110	130.4 Å²	130.4	77%	0.769	71%	0.709	S	S	*	*			trans	-46.4	112.9	173	42.8	0	0	0	0	108.8	S19 T23	S19-S21 PolarHBondContact O-N 2.99Å; S21-T23 VanDerWaalsContact C-N 3.28Å; S21-T23 PolarHBondContact O-N 3.16Å
22	A	36.1	Very low	51.2	Low	96 Å²	96	123.1 Å²	123.1	79%	0.793	67%	0.67	S	S	*	*			trans	-60.1	100.7	166.6	0	0	0	0	0	106.3	G20	G20-A22 PolarHBondContact O-N 2.76Å
23	T	35.1	Very low	54.1	Low	113 Å²	113	114.7 Å²	114.7	69%	0.693	63%	0.631	S	S	*	*			trans	-49.9	134.1	160.8	40.9	0	0	0	0	106.7	S21 R25	S21-T23 VanDerWaalsContact C-N 3.28Å; S21-T23 PolarHBondContact O-N 3.16Å; T23-R25 PolarHBondContact O-N 3.38Å
24	P	40	Very low	57	Low	116 Å²	116	109.1 Å²	109.1	75%	0.753	60%	0.597	S	S	*	*			trans	-55.5	122.4	177.5	8.9	-9.4	0	0	0	106.3	Q26	P24-Q26 PolarHBondContact O-N 3.04Å
25	R	42.3	Very low	59.9	Low	240 Å²	240	107.1 Å²	107.1	91%	0.906	58%	0.576	S	S	*	*			trans	-47.8	107.5	172.7	-73.9	-176	176.9	-173.5	-0.8	105.7	T23 R27	T23-R25 PolarHBondContact O-N 3.38Å; R25-R27 PolarHBondContact O-N 2.93Å
26	Q	50.9	Low	62.6	Low	183 Å²	183	103.5 Å²	103.5	86%	0.855	56%	0.557	S	S	*	*			trans	-55.7	117	175	-78.1	-166.8	-20.5	0	0	105.1	P24 E28	P24-Q26 PolarHBondContact O-N 3.04Å; Q26-E28 PolarHBondContact O-N 3.23Å
27	R	62.9	Low	65.5	Low	170 Å²	170	98.8 Å²	98.8	64%	0.642	53%	0.532	S	S	*	.			trans	-58.1	116.5	178.4	-70.1	-174.6	-177.6	165.3	0.9	106.2	R25 S29 T85	R25-R27 PolarHBondContact O-N 2.93Å; R27-S29 PolarHBondContact O-N 3.31Å; R27-T85 HydrophobicContact CB-CG2 3.71Å; R27-T85 HydrophobicContact CG-CG2 4.42Å
28	E	81.6	Confident	68.2	Low	173 Å²	173	91.9 Å²	91.9	81%	0.808	50%	0.497	S	S	*	.			trans	-62.2	108.3	178.5	-71.3	-177.2	174.5	0	0	107.4	Q26	Q26-E28 PolarHBondContact O-N 3.23Å
29	S	90.9	Very high	70.7	Confident	57 Å²	57	87.4 Å²	87.4	40%	0.399	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	138.3	172.2	64.3	0	0	0	0	109.5	R27 K83 V84	R27-S29 PolarHBondContact O-N 3.31Å; S29-K83 VanDerWaalsContact CB-CE 3.43Å; S29-K83 WeakPolarHBondContact OG-CE 3.47Å; S29-V84 CarbonylContact C-O 3.54Å; S29-V84 VanDerWaalsContact CA-O 3.22Å; S29-V84 WeakPolarHBondContact CA-O 2.95Å
30	V	94.8	Very high	72.8	Confident	22 Å²	22	89.2 Å²	89.2	13%	0.133	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	151.8	173.7	-60.4	0	0	0	0	109.9	V32 V84 I188 L191	V30-V32 HydrophobicContact CG2-CG2 4.16Å; V30-V84 HydrophobicContact CG2-CB 3.78Å; V30-V84 HydrophobicContact CG2-CG2 4.44Å; V30-V84 PolarHBondContact N-O 3.39Å; V30-V84 PolarHBondContact O-N 3.46Å; V30-I188 HydrophobicContact CG2-CD1 4.23Å; V30-L191 HydrophobicContact CB-CD1 4.24Å; V30-L191 HydrophobicContact CG1-CD1 3.84Å; V30-L191 HydrophobicContact CG2-CD1 3.74Å
31	I	96.4	Very high	74.6	Confident	34 Å²	34	93.9 Å²	93.9	17%	0.174	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	134.8	170.9	-56.9	-52.7	0	0	0	107.9	R52 L53 V55 T81 A82 K83	I31-R52 WeakPolarHBondContact O-CA 3.45Å; I31-L53 HydrophobicContact CB-CB 4.37Å; I31-L53 HydrophobicContact CG2-CB 4.17Å; I31-L53 HydrophobicContact CG2-CD1 4.29Å; I31-L53 PolarHBondContact O-N 3.39Å; I31-V55 HydrophobicContact CB-CG2 4.37Å; I31-V55 HydrophobicContact CG1-CG2 3.72Å; I31-V55 HydrophobicContact CG2-CG2 4.49Å; I31-T81 HydrophobicContact CG2-CG2 4.21Å; I31-A82 CarbonylContact C-O 3.5Å; I31-A82 WeakPolarHBondContact CA-O 3.46Å; I31-K83 HydrophobicContact CD1-CB 3.82Å; I31-K83 HydrophobicContact CD1-CG 4.13Å
32	V	96.9	Very high	76.4	Confident	0 Å²	0	97.9 Å²	97.9	0%	0	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	138.8	-177.6	176	0	0	0	0	109.5	V30 E51 T81 A82 V84 I188	V30-V32 HydrophobicContact CG2-CG2 4.16Å; V32-E51 CarbonylContact C-O 3.57Å; V32-E51 WeakPolarHBondContact CA-O 3.4Å; V32-T81 CarbonylContact O-C 3.59Å; V32-T81 WeakPolarHBondContact O-CA 3.46Å; V32-A82 PolarHBondContact N-O 3.15Å; V32-A82 PolarHBondContact O-N 3Å; V32-V84 HydrophobicContact CB-CG2 4.15Å; V32-V84 HydrophobicContact CG2-CB 4.48Å; V32-V84 HydrophobicContact CG2-CG2 3.6Å; V32-I188 HydrophobicContact CG2-CD1 3.91Å; V32-I188 HydrophobicContact CG2-CG1 4.09Å; V32-I188 HydrophobicContact CG2-CG2 3.7Å
33	S	96.9	Very high	78.6	Confident	0 Å²	0	96.9 Å²	96.9	0%	0	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	131.2	172.4	-168.8	0	0	0	0	110.5	Y35 M47 H48 G50 E51	S33-Y35 PolarHBondContact OG-N 2.93Å; S33-Y35 PolarHBondContact OG-O 3.27Å; S33-M47 VanDerWaalsContact OG-CE 3.24Å; S33-M47 WeakPolarHBondContact OG-CE 3.46Å; S33-H48 VanDerWaalsContact CB-O 3.3Å; S33-H48 WeakPolarHBondContact CB-O 3.41Å; S33-G50 PolarHBondContact O-N 3.47Å; S33-E51 PolarHBondContact N-O 2.82Å
34	L	96.4	Very high	81	Confident	4 Å²	4	97.9 Å²	97.9	2%	0.021	47%	0.469	C	S	.	.			trans	-86.5	-30.8	172.1	-62.8	-177	0	0	0	111.1	M49 Y80 A82 I93 K97 L101	L34-M49 WeakPolarHBondContact O-CG 3.36Å; L34-Y80 WeakPolarHBondContact CB-O 3.25Å; L34-Y80 PolarHBondContact N-O 2.9Å; L34-A82 HydrophobicContact CD1-CB 4.11Å; L34-A82 HydrophobicContact CD2-CB 3.65Å; L34-A82 HydrophobicContact CG-CB 4Å; L34-I93 HydrophobicContact CD1-CG2 4.07Å; L34-I93 HydrophobicContact CD2-CG2 3.7Å; L34-K97 VanDerWaalsContact C-CE 3.47Å; L34-K97 HydrophobicContact CB-CG 4.35Å; L34-K97 HydrophobicContact CD1-CG 4.47Å; L34-K97 HydrophobicContact CD2-CG 3.99Å; L34-K97 WeakPolarHBondContact O-CE 3.39Å; L34-K97 PolarHBondContact O-NZ 3.21Å; L34-L101 HydrophobicContact CD2-CD1 4.12Å
35	Y	95.1	Very high	83.4	Confident	91 Å²	91	95.1 Å²	95.1	36%	0.357	45%	0.448	S	S	.	.	S	Bend	trans	-124.5	155.9	-174.3	-56.8	-89.3	0	0	0	111.4	S33 Y80	S33-Y35 PolarHBondContact OG-N 2.93Å; S33-Y35 PolarHBondContact OG-O 3.27Å; Y35-Y80 AromaticContact CD2-CD1 3.82Å; Y35-Y80 HydrophobicContact CD2-CD1 3.82Å; Y35-Y80 HydrophobicContact CD2-CD2 4.16Å; Y35-Y80 HydrophobicContact CD2-CE1 4.21Å; Y35-Y80 AromaticContact CD2-CG 3.78Å; Y35-Y80 HydrophobicContact CD2-CG 3.78Å; Y35-Y80 HydrophobicContact CE2-CD2 4.36Å; Y35-Y80 HydrophobicContact CE2-CG 4.38Å; Y35-Y80 HydrophobicContact CG-CD1 4.21Å; Y35-Y80 HydrophobicContact CG-CE1 4.32Å
36	D	94.2	Very high	85.7	Confident	75 Å²	75	84.7 Å²	84.7	40%	0.401	41%	0.411	S	S	.	.			trans	-67.2	133.6	160.1	-62.2	-29.4	0	0	0	107.9	L45 M47 H48 M49	D36-L45 HydrophobicContact CB-CD1 4.12Å; D36-L45 HydrophobicContact CB-CD2 4.05Å; D36-M47 WeakPolarHBondContact CA-O 3.36Å; D36-H48 WeakPolarHBondContact OD1-CA 3.47Å; D36-M49 PolarHBondContact OD1-N 3.08Å
37	Y	93.4	Very high	87.7	Confident	65 Å²	65	76 Å²	76	26%	0.255	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-141.1	138.7	-178.7	-176.1	-88.4	0	0	0	110.7	T46 M47 V76 Y80	Y37-T46 PolarHBondContact O-N 3.29Å; Y37-T46 PolarHBondContact O-OG1 3.46Å; Y37-T46 VanDerWaalsContact O-OG1 3.06Å; Y37-M47 HydrophobicContact CD1-SD 4.3Å; Y37-M47 PolarHBondContact N-O 3.49Å; Y37-M47 PolarHBondContact O-N 3.46Å; Y37-V76 HydrophobicContact CD1-CG1 3.84Å; Y37-V76 HydrophobicContact CD2-CG1 3.98Å; Y37-V76 HydrophobicContact CE1-CG1 3.87Å; Y37-V76 HydrophobicContact CE2-CG1 3.98Å; Y37-V76 HydrophobicContact CG-CG1 3.91Å; Y37-Y80 HydrophobicContact CD2-CD1 4.25Å; Y37-Y80 HydrophobicContact CD2-CE1 4.07Å
38	P	91.5	Very high	89.1	Confident	17 Å²	17	70.9 Å²	70.9	11%	0.11	35%	0.353	C	S	.	.	S	Bend	cis	-67.1	145.8	-11.6	27.7	-33.6	0	0	0	111.8	F40 T43 L45	P38-F40 HydrophobicContact CB-CD2 3.92Å; P38-F40 HydrophobicContact CB-CE2 4.46Å; P38-F40 PolarHBondContact O-N 2.98Å; P38-T43 HydrophobicContact CG-CG2 3.48Å; P38-T43 VanDerWaalsContact CG-CG2 3.48Å; P38-L45 WeakPolarHBondContact O-CD2 3.46Å
39	S	83.3	Confident	89.8	Confident	86 Å²	86	64.7 Å²	64.7	60%	0.601	33%	0.325	S	S	*	.			trans	-81.8	4.7	-177.1	57.6	0	0	0	0	114.5
40	F	82.6	Confident	90	Very high	151 Å²	151	62.3 Å²	62.3	66%	0.662	31%	0.309	S	S	*	.	S	Bend	trans	-77.6	137	-178.8	-55.6	-68.8	0	0	0	111.2	P38 T43	P38-F40 HydrophobicContact CB-CD2 3.92Å; P38-F40 HydrophobicContact CB-CE2 4.46Å; P38-F40 PolarHBondContact O-N 2.98Å; F40-T43 PolarHBondContact O-N 3.08Å
41	E	69.7	Low	90	Very high	169 Å²	169	61.2 Å²	61.2	79%	0.79	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	144.1	174.1	-67.4	-177.9	163.8	0	0	110.9	T43	E41-T43 VanDerWaalsContact C-N 3.3Å; E41-T43 PolarHBondContact O-N 3.41Å
42	H	74.1	Confident	90	Very high	193 Å²	193	64 Å²	64	89%	0.894	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	12.2	179.2	-48.3	-71	0	0	0	117.2
43	T	82.4	Confident	90	Very high	76 Å²	76	64.3 Å²	64.3	47%	0.466	31%	0.312	S	S	.	.	S	Bend	trans	-102.8	142.7	170.9	-49.8	0	0	0	0	110.7	P38 F40 E41 L45	P38-T43 HydrophobicContact CG-CG2 3.48Å; P38-T43 VanDerWaalsContact CG-CG2 3.48Å; F40-T43 PolarHBondContact O-N 3.08Å; E41-T43 VanDerWaalsContact C-N 3.3Å; E41-T43 PolarHBondContact O-N 3.41Å; T43-L45 PolarHBondContact O-N 3.05Å
44	E	85.9	Confident	89.9	Confident	133 Å²	133	67.6 Å²	67.6	62%	0.621	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-65.4	124.1	171.2	-68.5	-175.8	173.7	0	0	110.3	T46 R72	E44-T46 PolarHBondContact O-N 2.83Å; E44-R72 IonicContact OE2-CZ 3.25Å; E44-R72 VanDerWaalsContact OE2-CZ 3.25Å; E44-R72 IonicContact OE2-NH1 2.8Å; E44-R72 PolarHBondContact OE2-NH1 2.9Å; E44-R72 IonicContact OE2-NH2 2.75Å; E44-R72 PolarHBondContact OE2-NH2 2.68Å
45	L	88.8	Confident	89.9	Confident	58 Å²	58	70.3 Å²	70.3	30%	0.304	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-63.1	124.4	176	-63.9	179.5	0	0	0	110.2	D36 P38 T43	D36-L45 HydrophobicContact CB-CD1 4.12Å; D36-L45 HydrophobicContact CB-CD2 4.05Å; P38-L45 WeakPolarHBondContact O-CD2 3.46Å; T43-L45 PolarHBondContact O-N 3.05Å
46	T	90.5	Very high	90	Very high	22 Å²	22	69.3 Å²	69.3	14%	0.135	35%	0.353	C	S	.	.	S	Bend	trans	-84.7	-30.8	169.5	57.2	0	0	0	0	110.7	Y37 E44 S67 T70 R72 S74	Y37-T46 PolarHBondContact O-N 3.29Å; Y37-T46 PolarHBondContact O-OG1 3.46Å; Y37-T46 VanDerWaalsContact O-OG1 3.06Å; E44-T46 PolarHBondContact O-N 2.83Å; T46-S67 VanDerWaalsContact O-CB 3.29Å; T46-S67 WeakPolarHBondContact O-CB 3.12Å; T46-T70 WeakPolarHBondContact O-CG2 3.42Å; T46-T70 PolarHBondContact O-OG1 3.23Å; T46-R72 HydrophobicContact CG2-CB 4.25Å; T46-S74 VanDerWaalsContact CB-OG 3.31Å; T46-S74 WeakPolarHBondContact CB-OG 3.37Å; T46-S74 PolarHBondContact OG1-OG 2.94Å
47	M	93	Very high	90.1	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-131	145.5	179.3	-57.6	163	48.2	0	0	113	S33 D36 Y37 E51 L53 V65 V76	S33-M47 VanDerWaalsContact OG-CE 3.24Å; S33-M47 WeakPolarHBondContact OG-CE 3.46Å; D36-M47 WeakPolarHBondContact CA-O 3.36Å; Y37-M47 HydrophobicContact CD1-SD 4.3Å; Y37-M47 PolarHBondContact N-O 3.49Å; Y37-M47 PolarHBondContact O-N 3.46Å; M47-E51 WeakPolarHBondContact CA-OE1 3.5Å; M47-E51 VanDerWaalsContact CB-OE1 3.27Å; M47-E51 WeakPolarHBondContact CB-OE1 3.25Å; M47-L53 HydrophobicContact CE-CD1 3.58Å; M47-L53 HydrophobicContact CE-CD2 4.01Å; M47-L53 HydrophobicContact CE-CG 4.44Å; M47-L53 HydrophobicContact CG-CD2 4.24Å; M47-V65 HydrophobicContact CE-CG2 3.91Å; M47-V65 HydrophobicContact SD-CG2 3.56Å; M47-V65 VanDerWaalsContact SD-CG2 3.56Å; M47-V76 HydrophobicContact CE-CG1 4.4Å; M47-V76 HydrophobicContact CE-CG2 4.45Å; M47-V76 HydrophobicContact SD-CG1 3.89Å
48	H	93.7	Very high	90.2	Very high	62 Å²	62	70.1 Å²	70.1	29%	0.287	37%	0.365	S	S	.	.			trans	-116.9	138.3	177	-62.5	82.9	0	0	0	111.2	S33 D36 G50 E51	S33-H48 VanDerWaalsContact CB-O 3.3Å; S33-H48 WeakPolarHBondContact CB-O 3.41Å; D36-H48 WeakPolarHBondContact OD1-CA 3.47Å; H48-G50 PolarHBondContact O-N 3.33Å; H48-E51 PolarHBondContact N-OE1 3.41Å; H48-E51 WeakPolarHBondContact O-CB 3.07Å; H48-E51 VanDerWaalsContact O-CG 3.25Å; H48-E51 WeakPolarHBondContact O-CG 3.4Å; H48-E51 PolarHBondContact O-N 3.23Å; H48-E51 VanDerWaalsContact O-N 3.13Å
49	M	95.4	Very high	90.4	Very high	44 Å²	44	74.1 Å²	74.1	22%	0.217	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	130.1	173.8	172.9	177.5	74.9	0	0	110.8	L34 D36 E51 K97 E100 L101	L34-M49 WeakPolarHBondContact O-CG 3.36Å; D36-M49 PolarHBondContact OD1-N 3.08Å; M49-E51 VanDerWaalsContact C-N 3.35Å; M49-K97 PolarHBondContact SD-NZ 3.3Å; M49-E100 HydrophobicContact CE-CB 4.28Å; M49-E100 HydrophobicContact SD-CB 3.97Å; M49-L101 HydrophobicContact CG-CD2 3.81Å; M49-L101 HydrophobicContact SD-CD2 4.44Å
50	G	95.1	Very high	90.8	Very high	6 Å²	6	72.1 Å²	72.1	6%	0.062	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.9	3.3	179.2	0	0	0	0	0	114.4	S33 H48 I188 Q189	S33-G50 PolarHBondContact O-N 3.47Å; H48-G50 PolarHBondContact O-N 3.33Å; G50-I188 CarbonylContact O-C 3.59Å; G50-I188 WeakPolarHBondContact O-CA 3.37Å; G50-Q189 PolarHBondContact O-N 3.06Å
51	E	95.5	Very high	91.4	Very high	0 Å²	0	71.3 Å²	71.3	0%	0	38%	0.381	C	S	.	.	B	Isolated β-bridge	trans	-85.1	155.4	173.9	88.6	179.6	143.8	0	0	113.5	V32 S33 M47 H48 M49 L53 S67 T69 Q189	V32-E51 CarbonylContact C-O 3.57Å; V32-E51 WeakPolarHBondContact CA-O 3.4Å; S33-E51 PolarHBondContact N-O 2.82Å; M47-E51 WeakPolarHBondContact CA-OE1 3.5Å; M47-E51 VanDerWaalsContact CB-OE1 3.27Å; M47-E51 WeakPolarHBondContact CB-OE1 3.25Å; H48-E51 PolarHBondContact N-OE1 3.41Å; H48-E51 WeakPolarHBondContact O-CB 3.07Å; H48-E51 VanDerWaalsContact O-CG 3.25Å; H48-E51 WeakPolarHBondContact O-CG 3.4Å; H48-E51 PolarHBondContact O-N 3.23Å; H48-E51 VanDerWaalsContact O-N 3.13Å; M49-E51 VanDerWaalsContact C-N 3.35Å; E51-L53 HydrophobicContact CG-CD2 3.87Å; E51-S67 VanDerWaalsContact CD-OG 3.27Å; E51-S67 PolarHBondContact OE1-OG 2.75Å; E51-S67 PolarHBondContact OE2-OG 3.08Å; E51-T69 WeakPolarHBondContact OE2-CB 3.36Å; E51-T69 PolarHBondContact OE2-OG1 3.25Å; E51-Q189 CarbonylContact C-O 3.54Å; E51-Q189 HydrophobicContact CB-CB 4.04Å; E51-Q189 HydrophobicContact CB-CG 4.4Å
52	R	95.8	Very high	92.7	Very high	93 Å²	93	67.5 Å²	67.5	35%	0.351	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	137.8	171.4	-179.8	-176.4	174.2	-178.3	3	111.3	I31 T68 I188 Q189	I31-R52 WeakPolarHBondContact O-CA 3.45Å; R52-T68 HydrophobicContact CB-CG2 4.32Å; R52-T68 HydrophobicContact CG-CG2 3.99Å; R52-T68 WeakPolarHBondContact O-CB 3.22Å; R52-T68 WeakPolarHBondContact O-CG2 3.22Å; R52-T68 PolarHBondContact O-N 2.98Å; R52-T68 VanDerWaalsContact O-N 3.17Å; R52-T68 PolarHBondContact O-OG1 2.75Å; R52-I188 HydrophobicContact CB-CG2 4.09Å; R52-Q189 WeakPolarHBondContact CB-O 3.27Å; R52-Q189 PolarHBondContact N-O 3.42Å
53	L	96.3	Very high	93.8	Very high	5 Å²	5	58.6 Å²	58.6	3%	0.026	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	153.8	176.9	-55.3	175.9	0	0	0	110.8	I31 M47 E51 V65 R66 T81	I31-L53 HydrophobicContact CB-CB 4.37Å; I31-L53 HydrophobicContact CG2-CB 4.17Å; I31-L53 HydrophobicContact CG2-CD1 4.29Å; I31-L53 PolarHBondContact O-N 3.39Å; M47-L53 HydrophobicContact CE-CD1 3.58Å; M47-L53 HydrophobicContact CE-CD2 4.01Å; M47-L53 HydrophobicContact CE-CG 4.44Å; M47-L53 HydrophobicContact CG-CD2 4.24Å; E51-L53 HydrophobicContact CG-CD2 3.87Å; L53-V65 HydrophobicContact CB-CB 4.26Å; L53-V65 HydrophobicContact CB-CG1 4.47Å; L53-V65 HydrophobicContact CD1-CB 4.2Å; L53-V65 HydrophobicContact CD1-CG1 4.24Å; L53-V65 HydrophobicContact CD1-CG2 4.11Å; L53-R66 WeakPolarHBondContact CA-O 3.49Å; L53-T81 HydrophobicContact CD1-CG2 3.92Å
54	T	96	Very high	94.5	Very high	69 Å²	69	57.4 Å²	57.4	42%	0.423	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	126.2	166.3	-55	0	0	0	0	108.6	V56 V65 R66	T54-V56 PolarHBondContact O-N 3.1Å; T54-V65 CarbonylContact O-C 3.46Å; T54-V65 WeakPolarHBondContact O-CA 3.46Å; T54-R66 PolarHBondContact N-O 2.92Å; T54-R66 PolarHBondContact O-N 3.3Å
55	V	96.1	Very high	95	Very high	62 Å²	62	51 Å²	51	38%	0.376	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	125.5	174.9	178.6	0	0	0	0	108.9	I31 D58 V63	I31-V55 HydrophobicContact CB-CG2 4.37Å; I31-V55 HydrophobicContact CG1-CG2 3.72Å; I31-V55 HydrophobicContact CG2-CG2 4.49Å; V55-D58 HydrophobicContact CG1-CB 4.34Å; V55-V63 HydrophobicContact CG1-CG2 3.76Å; V55-V63 HydrophobicContact CG2-CG2 4.22Å
56	V	96.8	Very high	95.4	Very high	70 Å²	70	53.7 Å²	53.7	42%	0.424	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-47.2	176.7	-179	0	0	0	0	110	T54 M64 R66	T54-V56 PolarHBondContact O-N 3.1Å; V56-M64 HydrophobicContact CB-CB 4.22Å; V56-M64 HydrophobicContact CB-CG 3.95Å; V56-M64 HydrophobicContact CG1-CG 4.33Å; V56-M64 PolarHBondContact N-O 3.03Å; V56-R66 HydrophobicContact CG2-CB 3.97Å
57	S	96.6	Very high	95.6	Very high	43 Å²	43	52.7 Å²	52.7	30%	0.301	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	150.8	171.5	67.4	0	0	0	0	110.5	V63 M64	S57-V63 VanDerWaalsContact O-CG2 3.22Å; S57-V63 WeakPolarHBondContact O-CG2 3.36Å; S57-M64 PolarHBondContact N-O 3.01Å; S57-M64 PolarHBondContact O-N 2.96Å; S57-M64 WeakPolarHBondContact OG-CB 3.31Å
58	D	95.6	Very high	95.5	Very high	113 Å²	113	55.4 Å²	55.4	60%	0.604	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.2	110	178.7	-176.9	-8.2	0	0	0	108.4	V55 G60	V55-D58 HydrophobicContact CG1-CB 4.34Å; D58-G60 PolarHBondContact OD1-N 3.4Å
59	D	95.2	Very high	95.3	Very high	101 Å²	101	55.5 Å²	55.5	54%	0.54	30%	0.303	S	S	.	.			trans	-103.6	13.9	-179	-57.7	-52.3	0	0	0	111.1	D61 F62 Y75	D59-D61 PolarHBondContact O-N 3.12Å; D59-F62 CarbonylContact C-O 3.51Å; D59-F62 WeakPolarHBondContact CA-O 3.4Å; D59-F62 WeakPolarHBondContact CB-O 3.33Å; D59-F62 PolarHBondContact N-O 3.05Å; D59-Y75 WeakPolarHBondContact OD2-CE2 3.22Å
60	G	92.8	Very high	95.1	Very high	44 Å²	44	55.8 Å²	55.8	45%	0.454	31%	0.307	S	S	.	.	S	Bend	trans	87.5	-80	179.1	0	0	0	0	0	113.1	D58 F62 T78	D58-G60 PolarHBondContact OD1-N 3.4Å; G60-F62 VanDerWaalsContact C-N 3.29Å; G60-T78 WeakPolarHBondContact O-CB 3.47Å; G60-T78 PolarHBondContact O-OG1 2.95Å
61	D	94.7	Very high	94.9	Very high	134 Å²	134	57.8 Å²	57.8	72%	0.717	33%	0.328	S	S	*	.	S	Bend	trans	-75.1	-24.1	-179.2	-71.1	-30.7	0	0	0	112.4	D59 P77 T78	D59-D61 PolarHBondContact O-N 3.12Å; D61-P77 WeakPolarHBondContact O-CA 3.15Å; D61-T78 PolarHBondContact O-N 3.06Å; D61-T78 PolarHBondContact O-OG1 2.64Å
62	F	96.6	Very high	94.8	Very high	90 Å²	90	63.1 Å²	63.1	40%	0.395	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	152.8	178.8	-68	-96.9	0	0	0	110.1	D59 G60 Y75 V76 P77	D59-F62 CarbonylContact C-O 3.51Å; D59-F62 WeakPolarHBondContact CA-O 3.4Å; D59-F62 WeakPolarHBondContact CB-O 3.33Å; D59-F62 PolarHBondContact N-O 3.05Å; G60-F62 VanDerWaalsContact C-N 3.29Å; F62-Y75 HydrophobicContact CB-CD2 4.45Å; F62-Y75 HydrophobicContact CB-CE1 3.76Å; F62-Y75 HydrophobicContact CB-CE2 3.68Å; F62-Y75 VanDerWaalsContact CB-OH 3.26Å; F62-Y75 WeakPolarHBondContact CB-OH 3.47Å; F62-Y75 HydrophobicContact CD1-CD1 4.28Å; F62-Y75 AromaticContact CD1-CE1 3.89Å; F62-Y75 HydrophobicContact CD1-CE1 3.89Å; F62-Y75 AromaticContact CG-CE1 3.9Å; F62-Y75 HydrophobicContact CG-CE1 3.9Å; F62-Y75 AromaticContact CG-CZ 3.92Å; F62-V76 CarbonylContact C-O 3.5Å; F62-V76 WeakPolarHBondContact CA-O 3.37Å; F62-P77 HydrophobicContact CD1-CB 4.49Å; F62-P77 HydrophobicContact CD1-CG 4.23Å; F62-P77 HydrophobicContact CE1-CB 4.4Å; F62-P77 HydrophobicContact CE1-CG 3.85Å
63	V	97.1	Very high	94.8	Very high	6 Å²	6	63 Å²	63	4%	0.036	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	134.9	-177.8	61.2	0	0	0	0	109.1	V55 S57 V65 V76 T81	V55-V63 HydrophobicContact CG1-CG2 3.76Å; V55-V63 HydrophobicContact CG2-CG2 4.22Å; S57-V63 VanDerWaalsContact O-CG2 3.22Å; S57-V63 WeakPolarHBondContact O-CG2 3.36Å; V63-V65 HydrophobicContact CB-CG1 4.41Å; V63-V65 HydrophobicContact CG1-CG1 3.88Å; V63-V65 HydrophobicContact CG2-CG1 3.77Å; V63-V76 HydrophobicContact CG1-CG2 3.83Å; V63-V76 PolarHBondContact N-O 3.18Å; V63-V76 PolarHBondContact O-N 2.88Å; V63-T81 HydrophobicContact CG1-CG2 4Å
64	M	97.1	Very high	94.8	Very high	50 Å²	50	63.2 Å²	63.2	25%	0.246	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	118.4	166.5	-172.7	67.1	73.5	0	0	108.2	V56 S57 E73 S74 Y75	V56-M64 HydrophobicContact CB-CB 4.22Å; V56-M64 HydrophobicContact CB-CG 3.95Å; V56-M64 HydrophobicContact CG1-CG 4.33Å; V56-M64 PolarHBondContact N-O 3.03Å; S57-M64 PolarHBondContact N-O 3.01Å; S57-M64 PolarHBondContact O-N 2.96Å; S57-M64 WeakPolarHBondContact OG-CB 3.31Å; M64-E73 HydrophobicContact SD-CB 4.25Å; M64-S74 VanDerWaalsContact SD-C 3.53Å; M64-Y75 HydrophobicContact CB-CD2 4.21Å; M64-Y75 HydrophobicContact CE-CD2 3.91Å; M64-Y75 HydrophobicContact CE-CG 4.16Å; M64-Y75 HydrophobicContact SD-CD2 4.47Å
65	V	97	Very high	94.8	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	149.5	-179.2	-66.2	0	0	0	0	111	M47 L53 T54 V63 E73 S74 V76 T81	M47-V65 HydrophobicContact CE-CG2 3.91Å; M47-V65 HydrophobicContact SD-CG2 3.56Å; M47-V65 VanDerWaalsContact SD-CG2 3.56Å; L53-V65 HydrophobicContact CB-CB 4.26Å; L53-V65 HydrophobicContact CB-CG1 4.47Å; L53-V65 HydrophobicContact CD1-CB 4.2Å; L53-V65 HydrophobicContact CD1-CG1 4.24Å; L53-V65 HydrophobicContact CD1-CG2 4.11Å; T54-V65 CarbonylContact O-C 3.46Å; T54-V65 WeakPolarHBondContact O-CA 3.46Å; V63-V65 HydrophobicContact CB-CG1 4.41Å; V63-V65 HydrophobicContact CG1-CG1 3.88Å; V63-V65 HydrophobicContact CG2-CG1 3.77Å; V65-E73 CarbonylContact O-C 3.53Å; V65-E73 WeakPolarHBondContact O-CA 3.29Å; V65-S74 WeakPolarHBondContact CG2-O 3.49Å; V65-S74 PolarHBondContact N-O 2.68Å; V65-S74 PolarHBondContact O-N 3.35Å; V65-V76 HydrophobicContact CG2-CG2 3.93Å; V65-T81 HydrophobicContact CG1-CG2 4.31Å
66	R	96.4	Very high	94.8	Very high	113 Å²	113	62 Å²	62	43%	0.426	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	123	170.3	-168.1	-177.4	-64.2	165.4	-2.1	109.5	L53 T54 V56 T68 R72 E73	L53-R66 WeakPolarHBondContact CA-O 3.49Å; T54-R66 PolarHBondContact N-O 2.92Å; T54-R66 PolarHBondContact O-N 3.3Å; V56-R66 HydrophobicContact CG2-CB 3.97Å; R66-T68 PolarHBondContact O-N 2.82Å; R66-R72 WeakPolarHBondContact CA-O 3.43Å; R66-E73 HydrophobicContact CB-CG 4.03Å; R66-E73 HydrophobicContact CG-CG 3.95Å; R66-E73 IonicContact CZ-OE1 3.2Å; R66-E73 IonicContact NE-OE1 2.95Å; R66-E73 PolarHBondContact NE-OE1 3.47Å; R66-E73 IonicContact NH2-OE1 2.64Å; R66-E73 PolarHBondContact NH2-OE1 3.49Å
67	S	94.9	Very high	94.7	Very high	2 Å²	2	60.3 Å²	60.3	1%	0.014	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	131.3	172.5	161.8	0	0	0	0	109.6	T46 E51 T69 T70 G71 R72	T46-S67 VanDerWaalsContact O-CB 3.29Å; T46-S67 WeakPolarHBondContact O-CB 3.12Å; E51-S67 VanDerWaalsContact CD-OG 3.27Å; E51-S67 PolarHBondContact OE1-OG 2.75Å; E51-S67 PolarHBondContact OE2-OG 3.08Å; S67-T69 VanDerWaalsContact C-N 3.28Å; S67-T69 PolarHBondContact OG-N 2.84Å; S67-T69 VanDerWaalsContact OG-N 3.15Å; S67-T70 WeakPolarHBondContact CB-OG1 3.22Å; S67-T70 PolarHBondContact OG-N 3.32Å; S67-T70 PolarHBondContact OG-OG1 2.85Å; S67-G71 WeakPolarHBondContact O-CA 3.46Å; S67-G71 PolarHBondContact O-N 2.88Å; S67-R72 PolarHBondContact N-O 3.12Å
68	T	91.4	Very high	94.7	Very high	56 Å²	56	60.8 Å²	60.8	34%	0.344	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-21.6	174.5	58.6	0	0	0	0	112.4	R52 R66	R52-T68 HydrophobicContact CB-CG2 4.32Å; R52-T68 HydrophobicContact CG-CG2 3.99Å; R52-T68 WeakPolarHBondContact O-CB 3.22Å; R52-T68 WeakPolarHBondContact O-CG2 3.22Å; R52-T68 PolarHBondContact O-N 2.98Å; R52-T68 VanDerWaalsContact O-N 3.17Å; R52-T68 PolarHBondContact O-OG1 2.75Å; R66-T68 PolarHBondContact O-N 2.82Å
69	T	90.1	Very high	94.6	Very high	65 Å²	65	60.5 Å²	60.5	40%	0.399	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-47.7	179.1	-42.9	0	0	0	0	111.7	E51 S67	E51-T69 WeakPolarHBondContact OE2-CB 3.36Å; E51-T69 PolarHBondContact OE2-OG1 3.25Å; S67-T69 VanDerWaalsContact C-N 3.28Å; S67-T69 PolarHBondContact OG-N 2.84Å; S67-T69 VanDerWaalsContact OG-N 3.15Å
70	T	90.4	Very high	94.7	Very high	49 Å²	49	58.7 Å²	58.7	30%	0.301	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-18.5	-174.3	71.5	0	0	0	0	113	T46 S67 R72	T46-T70 WeakPolarHBondContact O-CG2 3.42Å; T46-T70 PolarHBondContact O-OG1 3.23Å; S67-T70 WeakPolarHBondContact CB-OG1 3.22Å; S67-T70 PolarHBondContact OG-N 3.32Å; S67-T70 PolarHBondContact OG-OG1 2.85Å; T70-R72 PolarHBondContact O-N 2.99Å; T70-R72 WeakPolarHBondContact OG1-CB 3.47Å; T70-R72 PolarHBondContact OG1-N 3.25Å
71	G	91.6	Very high	94.8	Very high	49 Å²	49	57.5 Å²	57.5	51%	0.505	30%	0.295	S	S	.	.			trans	70.3	0.1	-172.5	0	0	0	0	0	114.4	S67	S67-G71 WeakPolarHBondContact O-CA 3.46Å; S67-G71 PolarHBondContact O-N 2.88Å
72	R	93.3	Very high	94.9	Very high	111 Å²	111	51.2 Å²	51.2	42%	0.419	26%	0.262	S	S	.	.			trans	-82.8	149.2	-178.3	-62.1	-176.5	177.9	-177.5	-1	111.1	E44 T46 R66 S67 T70	E44-R72 IonicContact OE2-CZ 3.25Å; E44-R72 VanDerWaalsContact OE2-CZ 3.25Å; E44-R72 IonicContact OE2-NH1 2.8Å; E44-R72 PolarHBondContact OE2-NH1 2.9Å; E44-R72 IonicContact OE2-NH2 2.75Å; E44-R72 PolarHBondContact OE2-NH2 2.68Å; T46-R72 HydrophobicContact CG2-CB 4.25Å; R66-R72 WeakPolarHBondContact CA-O 3.43Å; S67-R72 PolarHBondContact N-O 3.12Å; T70-R72 PolarHBondContact O-N 2.99Å; T70-R72 WeakPolarHBondContact OG1-CB 3.47Å; T70-R72 PolarHBondContact OG1-N 3.25Å
73	E	95.3	Very high	94.8	Very high	92 Å²	92	51.7 Å²	51.7	43%	0.43	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	148.6	175.7	-64.8	-176.8	170.5	0	0	111.2	M64 V65 R66	M64-E73 HydrophobicContact SD-CB 4.25Å; V65-E73 CarbonylContact O-C 3.53Å; V65-E73 WeakPolarHBondContact O-CA 3.29Å; R66-E73 HydrophobicContact CB-CG 4.03Å; R66-E73 HydrophobicContact CG-CG 3.95Å; R66-E73 IonicContact CZ-OE1 3.2Å; R66-E73 IonicContact NE-OE1 2.95Å; R66-E73 PolarHBondContact NE-OE1 3.47Å; R66-E73 IonicContact NH2-OE1 2.64Å; R66-E73 PolarHBondContact NH2-OE1 3.49Å
74	S	95.1	Very high	94.8	Very high	9 Å²	9	51.4 Å²	51.4	6%	0.063	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	135	-179.4	-66.4	0	0	0	0	110.2	T46 M64 V65	T46-S74 VanDerWaalsContact CB-OG 3.31Å; T46-S74 WeakPolarHBondContact CB-OG 3.37Å; T46-S74 PolarHBondContact OG1-OG 2.94Å; M64-S74 VanDerWaalsContact SD-C 3.53Å; V65-S74 WeakPolarHBondContact CG2-O 3.49Å; V65-S74 PolarHBondContact N-O 2.68Å; V65-S74 PolarHBondContact O-N 3.35Å
75	Y	96.1	Very high	94.7	Very high	104 Å²	104	49.9 Å²	49.9	41%	0.408	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	107.2	175.8	-169.2	-118.2	0	0	0	108.8	D59 F62 M64	D59-Y75 WeakPolarHBondContact OD2-CE2 3.22Å; F62-Y75 HydrophobicContact CB-CD2 4.45Å; F62-Y75 HydrophobicContact CB-CE1 3.76Å; F62-Y75 HydrophobicContact CB-CE2 3.68Å; F62-Y75 VanDerWaalsContact CB-OH 3.26Å; F62-Y75 WeakPolarHBondContact CB-OH 3.47Å; F62-Y75 HydrophobicContact CD1-CD1 4.28Å; F62-Y75 AromaticContact CD1-CE1 3.89Å; F62-Y75 HydrophobicContact CD1-CE1 3.89Å; F62-Y75 AromaticContact CG-CE1 3.9Å; F62-Y75 HydrophobicContact CG-CE1 3.9Å; F62-Y75 AromaticContact CG-CZ 3.92Å; M64-Y75 HydrophobicContact CB-CD2 4.21Å; M64-Y75 HydrophobicContact CE-CD2 3.91Å; M64-Y75 HydrophobicContact CE-CG 4.16Å; M64-Y75 HydrophobicContact SD-CD2 4.47Å
76	V	96.2	Very high	94.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	153.9	-170.6	-60.2	0	0	0	0	110.9	Y37 M47 F62 V63 V65 T81	Y37-V76 HydrophobicContact CD1-CG1 3.84Å; Y37-V76 HydrophobicContact CD2-CG1 3.98Å; Y37-V76 HydrophobicContact CE1-CG1 3.87Å; Y37-V76 HydrophobicContact CE2-CG1 3.98Å; Y37-V76 HydrophobicContact CG-CG1 3.91Å; M47-V76 HydrophobicContact CE-CG1 4.4Å; M47-V76 HydrophobicContact CE-CG2 4.45Å; M47-V76 HydrophobicContact SD-CG1 3.89Å; F62-V76 CarbonylContact C-O 3.5Å; F62-V76 WeakPolarHBondContact CA-O 3.37Å; V63-V76 HydrophobicContact CG1-CG2 3.83Å; V63-V76 PolarHBondContact N-O 3.18Å; V63-V76 PolarHBondContact O-N 2.88Å; V65-V76 HydrophobicContact CG2-CG2 3.93Å; V76-T81 HydrophobicContact CG2-CG2 4.15Å
77	P	96.3	Very high	94.4	Very high	35 Å²	35	51.5 Å²	51.5	23%	0.227	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	144.5	169.4	-24.4	35.6	0	0	0	111.4	D61 F62 N79 Y80	D61-P77 WeakPolarHBondContact O-CA 3.15Å; F62-P77 HydrophobicContact CD1-CB 4.49Å; F62-P77 HydrophobicContact CD1-CG 4.23Å; F62-P77 HydrophobicContact CE1-CB 4.4Å; F62-P77 HydrophobicContact CE1-CG 3.85Å; P77-N79 WeakPolarHBondContact CB-OD1 3.36Å; P77-N79 PolarHBondContact O-N 3.03Å; P77-N79 VanDerWaalsContact O-N 3.15Å; P77-Y80 HydrophobicContact CB-CD2 3.9Å; P77-Y80 HydrophobicContact CB-CE2 4.3Å; P77-Y80 HydrophobicContact CG-CD2 3.99Å; P77-Y80 HydrophobicContact CG-CE2 4.02Å; P77-Y80 VanDerWaalsContact O-CB 3.3Å; P77-Y80 WeakPolarHBondContact O-CB 3.46Å; P77-Y80 PolarHBondContact O-N 3.36Å
78	T	95.2	Very high	94.5	Very high	53 Å²	53	52.4 Å²	52.4	33%	0.325	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-59.7	-31.6	-176.9	-62.9	0	0	0	0	112.8	G60 D61 Y80 T81	G60-T78 WeakPolarHBondContact O-CB 3.47Å; G60-T78 PolarHBondContact O-OG1 2.95Å; D61-T78 PolarHBondContact O-N 3.06Å; D61-T78 PolarHBondContact O-OG1 2.64Å; T78-Y80 PolarHBondContact O-N 3.19Å; T78-Y80 VanDerWaalsContact O-N 3.15Å; T78-T81 PolarHBondContact O-N 3.05Å; T78-T81 PolarHBondContact O-OG1 3.25Å
79	N	94.7	Very high	94.7	Very high	107 Å²	107	50.5 Å²	50.5	57%	0.572	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-70.6	-2.5	175.4	71.9	-25.5	0	0	0	114.5	P77	P77-N79 WeakPolarHBondContact CB-OD1 3.36Å; P77-N79 PolarHBondContact O-N 3.03Å; P77-N79 VanDerWaalsContact O-N 3.15Å
80	Y	95.9	Very high	95	Very high	64 Å²	64	47.4 Å²	47.4	25%	0.251	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-83.5	-4.9	168.1	-81.2	-129.4	0	0	0	112.1	L34 Y35 Y37 P77 T78	L34-Y80 WeakPolarHBondContact CB-O 3.25Å; L34-Y80 PolarHBondContact N-O 2.9Å; Y35-Y80 AromaticContact CD2-CD1 3.82Å; Y35-Y80 HydrophobicContact CD2-CD1 3.82Å; Y35-Y80 HydrophobicContact CD2-CD2 4.16Å; Y35-Y80 HydrophobicContact CD2-CE1 4.21Å; Y35-Y80 AromaticContact CD2-CG 3.78Å; Y35-Y80 HydrophobicContact CD2-CG 3.78Å; Y35-Y80 HydrophobicContact CE2-CD2 4.36Å; Y35-Y80 HydrophobicContact CE2-CG 4.38Å; Y35-Y80 HydrophobicContact CG-CD1 4.21Å; Y35-Y80 HydrophobicContact CG-CE1 4.32Å; Y37-Y80 HydrophobicContact CD2-CD1 4.25Å; Y37-Y80 HydrophobicContact CD2-CE1 4.07Å; P77-Y80 HydrophobicContact CB-CD2 3.9Å; P77-Y80 HydrophobicContact CB-CE2 4.3Å; P77-Y80 HydrophobicContact CG-CD2 3.99Å; P77-Y80 HydrophobicContact CG-CE2 4.02Å; P77-Y80 VanDerWaalsContact O-CB 3.3Å; P77-Y80 WeakPolarHBondContact O-CB 3.46Å; P77-Y80 PolarHBondContact O-N 3.36Å; T78-Y80 PolarHBondContact O-N 3.19Å; T78-Y80 VanDerWaalsContact O-N 3.15Å
81	T	96.1	Very high	95.2	Very high	19 Å²	19	46.6 Å²	46.6	12%	0.117	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	154.4	-178	72.5	0	0	0	0	110.5	I31 V32 L53 V63 V65 V76 T78	I31-T81 HydrophobicContact CG2-CG2 4.21Å; V32-T81 CarbonylContact O-C 3.59Å; V32-T81 WeakPolarHBondContact O-CA 3.46Å; L53-T81 HydrophobicContact CD1-CG2 3.92Å; V63-T81 HydrophobicContact CG1-CG2 4Å; V65-T81 HydrophobicContact CG1-CG2 4.31Å; V76-T81 HydrophobicContact CG2-CG2 4.15Å; T78-T81 PolarHBondContact O-N 3.05Å; T78-T81 PolarHBondContact O-OG1 3.25Å
82	A	96	Very high	95.1	Very high	2 Å²	2	47.1 Å²	47.1	2%	0.017	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	141.2	169.6	0	0	0	0	0	110.4	I31 V32 L34 Y90 I93	I31-A82 CarbonylContact C-O 3.5Å; I31-A82 WeakPolarHBondContact CA-O 3.46Å; V32-A82 PolarHBondContact N-O 3.15Å; V32-A82 PolarHBondContact O-N 3Å; L34-A82 HydrophobicContact CD1-CB 4.11Å; L34-A82 HydrophobicContact CD2-CB 3.65Å; L34-A82 HydrophobicContact CG-CB 4Å; A82-Y90 HydrophobicContact CB-CD1 4.42Å; A82-I93 HydrophobicContact CB-CG2 3.39Å
83	K	95.5	Very high	95.1	Very high	100 Å²	100	42 Å²	42	44%	0.435	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	131.1	169.3	177.7	-177.4	-176	177	0	109.1	S29 I31 T91	S29-K83 VanDerWaalsContact CB-CE 3.43Å; S29-K83 WeakPolarHBondContact OG-CE 3.47Å; I31-K83 HydrophobicContact CD1-CB 3.82Å; I31-K83 HydrophobicContact CD1-CG 4.13Å; K83-T91 WeakPolarHBondContact CB-OG1 3.22Å; K83-T91 PolarHBondContact O-N 2.69Å; K83-T91 PolarHBondContact O-OG1 3.17Å
84	V	96.3	Very high	95.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	122	178.6	-170.5	0	0	0	0	109	S29 V30 V32 L89 Y90 I188	S29-V84 CarbonylContact C-O 3.54Å; S29-V84 VanDerWaalsContact CA-O 3.22Å; S29-V84 WeakPolarHBondContact CA-O 2.95Å; V30-V84 HydrophobicContact CG2-CB 3.78Å; V30-V84 HydrophobicContact CG2-CG2 4.44Å; V30-V84 PolarHBondContact N-O 3.39Å; V30-V84 PolarHBondContact O-N 3.46Å; V32-V84 HydrophobicContact CB-CG2 4.15Å; V32-V84 HydrophobicContact CG2-CB 4.48Å; V32-V84 HydrophobicContact CG2-CG2 3.6Å; V84-L89 CarbonylContact C-O 3.6Å; V84-L89 VanDerWaalsContact CA-O 3.27Å; V84-L89 WeakPolarHBondContact CA-O 3.43Å; V84-Y90 HydrophobicContact CG1-CD2 3.88Å; V84-Y90 HydrophobicContact CG1-CE1 4.46Å; V84-Y90 HydrophobicContact CG1-CE2 3.66Å; V84-Y90 HydrophobicContact CG1-CG 4.36Å; V84-Y90 HydrophobicContact CG2-CD1 3.48Å; V84-Y90 VanDerWaalsContact CG2-CD1 3.48Å; V84-Y90 HydrophobicContact CG2-CD2 4.21Å; V84-Y90 HydrophobicContact CG2-CE1 3.36Å; V84-Y90 HydrophobicContact CG2-CE2 4.11Å; V84-Y90 HydrophobicContact CG2-CG 3.91Å; V84-I188 HydrophobicContact CB-CD1 4.42Å; V84-I188 HydrophobicContact CG1-CD1 4.11Å; V84-I188 HydrophobicContact CG2-CD1 4.38Å
85	T	94.9	Very high	95.1	Very high	18 Å²	18	45 Å²	45	11%	0.11	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	146.4	176.2	-47.7	0	0	0	0	109	R27 K87 W88 L89	R27-T85 HydrophobicContact CB-CG2 3.71Å; R27-T85 HydrophobicContact CG-CG2 4.42Å; T85-K87 PolarHBondContact O-N 2.97Å; T85-W88 PolarHBondContact O-N 3.34Å; T85-L89 PolarHBondContact N-O 2.98Å; T85-L89 WeakPolarHBondContact O-CB 3.27Å; T85-L89 PolarHBondContact O-N 3.2Å
86	D	93.4	Very high	95	Very high	38 Å²	38	47.1 Å²	47.1	20%	0.203	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	20.6	178.8	-52.4	-48.1	0	0	0	113.8	W88 H165	D86-W88 HydrophobicContact CB-CZ2 3.93Å; D86-W88 PolarHBondContact O-N 2.62Å; D86-W88 VanDerWaalsContact O-N 3.07Å; D86-W88 PolarHBondContact O-NE1 2.83Å; D86-W88 VanDerWaalsContact O-NE1 3.07Å; D86-H165 IonicContact OD1-CE1 3.07Å; D86-H165 IonicContact OD1-NE2 3.77Å; D86-H165 IonicContact OD2-CE1 2.73Å; D86-H165 PolarHBondContact OD2-CE1 3.21Å; D86-H165 IonicContact OD2-NE2 3.63Å
87	K	94.1	Very high	95	Very high	109 Å²	109	47.4 Å²	47.4	47%	0.474	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.3	-17.7	-175.6	-50	-176.9	178.8	-168	0	116.6	T85 P185 L191	T85-K87 PolarHBondContact O-N 2.97Å; K87-P185 HydrophobicContact CB-CB 4.28Å; K87-P185 HydrophobicContact CB-CG 4.34Å; K87-L191 HydrophobicContact CD-CD2 3.9Å; K87-L191 HydrophobicContact CG-CD2 4.24Å
88	W	96.3	Very high	95	Very high	20 Å²	20	45.8 Å²	45.8	8%	0.076	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.8	-10.4	-176.6	49.7	-99.7	0	0	0	114.4	T85 D86 F112 I114 L164 H165 V168 P185	T85-W88 PolarHBondContact O-N 3.34Å; D86-W88 HydrophobicContact CB-CZ2 3.93Å; D86-W88 PolarHBondContact O-N 2.62Å; D86-W88 VanDerWaalsContact O-N 3.07Å; D86-W88 PolarHBondContact O-NE1 2.83Å; D86-W88 VanDerWaalsContact O-NE1 3.07Å; W88-F112 HydrophobicContact CB-CD2 4.4Å; W88-F112 HydrophobicContact CB-CE2 3.71Å; W88-F112 HydrophobicContact CB-CZ 4.14Å; W88-F112 HydrophobicContact CD2-CE2 4.39Å; W88-F112 AromaticContact CG-CE2 3.9Å; W88-F112 HydrophobicContact CG-CE2 3.9Å; W88-F112 HydrophobicContact CG-CZ 4.2Å; W88-I114 HydrophobicContact CE3-CB 3.95Å; W88-I114 HydrophobicContact CE3-CD1 3.77Å; W88-I114 HydrophobicContact CE3-CG1 4.02Å; W88-I114 HydrophobicContact CZ3-CB 4.18Å; W88-I114 HydrophobicContact CZ3-CD1 3.67Å; W88-I114 HydrophobicContact CZ3-CG1 4.3Å; W88-I114 PolarHBondContact O-N 2.75Å; W88-L164 HydrophobicContact CH2-CB 3.65Å; W88-L164 HydrophobicContact CZ3-CB 3.97Å; W88-L164 HydrophobicContact CZ3-CD1 4.24Å; W88-H165 AromaticContact CZ2-CE1 3.81Å; W88-H165 AromaticContact CZ2-ND1 3.88Å; W88-H165 AromaticContact CZ2-NE2 3.96Å; W88-V168 HydrophobicContact CD2-CG2 4.25Å; W88-V168 HydrophobicContact CE3-CG2 4.23Å; W88-V168 HydrophobicContact CH2-CG2 4.31Å; W88-V168 HydrophobicContact CZ2-CG2 4.31Å; W88-V168 HydrophobicContact CZ3-CG2 4.26Å; W88-P185 HydrophobicContact CB-CB 4.04Å; W88-P185 HydrophobicContact CB-CG 4.33Å
89	L	96.6	Very high	95.1	Very high	16 Å²	16	44.2 Å²	44.2	8%	0.084	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	105.8	179.7	-179	61.8	0	0	0	111	V84 T85 I114 Y124 L164	V84-L89 CarbonylContact C-O 3.6Å; V84-L89 VanDerWaalsContact CA-O 3.27Å; V84-L89 WeakPolarHBondContact CA-O 3.43Å; T85-L89 PolarHBondContact N-O 2.98Å; T85-L89 WeakPolarHBondContact O-CB 3.27Å; T85-L89 PolarHBondContact O-N 3.2Å; L89-I114 CarbonylContact C-O 3.53Å; L89-I114 WeakPolarHBondContact CA-O 3.41Å; L89-I114 HydrophobicContact CD1-CB 4.23Å; L89-I114 HydrophobicContact CD1-CG2 3.84Å; L89-Y124 HydrophobicContact CD1-CD1 4.03Å; L89-Y124 HydrophobicContact CD1-CE1 4.06Å; L89-L164 HydrophobicContact CD1-CD1 4.1Å; L89-L164 HydrophobicContact CD2-CD1 4.42Å
90	Y	96.2	Very high	95.2	Very high	1 Å²	1	41.5 Å²	41.5	0%	0.004	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	133.2	-178.6	-72.2	-114.5	0	0	0	111.1	A82 V84 I93 L101 L113 I114 R115 E116 C186 I188	A82-Y90 HydrophobicContact CB-CD1 4.42Å; V84-Y90 HydrophobicContact CG1-CD2 3.88Å; V84-Y90 HydrophobicContact CG1-CE1 4.46Å; V84-Y90 HydrophobicContact CG1-CE2 3.66Å; V84-Y90 HydrophobicContact CG1-CG 4.36Å; V84-Y90 HydrophobicContact CG2-CD1 3.48Å; V84-Y90 VanDerWaalsContact CG2-CD1 3.48Å; V84-Y90 HydrophobicContact CG2-CD2 4.21Å; V84-Y90 HydrophobicContact CG2-CE1 3.36Å; V84-Y90 HydrophobicContact CG2-CE2 4.11Å; V84-Y90 HydrophobicContact CG2-CG 3.91Å; Y90-I93 VanDerWaalsContact CB-CD1 3.43Å; Y90-I93 HydrophobicContact CD1-CD1 3.82Å; Y90-I93 HydrophobicContact CD1-CG2 4.25Å; Y90-I93 HydrophobicContact CG-CD1 3.76Å; Y90-L101 HydrophobicContact CD1-CD1 4.35Å; Y90-L101 HydrophobicContact CE1-CD1 3.97Å; Y90-L113 HydrophobicContact CD2-CB 3.73Å; Y90-L113 HydrophobicContact CD2-CD1 4.45Å; Y90-L113 HydrophobicContact CD2-CD2 4.29Å; Y90-L113 HydrophobicContact CD2-CG 4.38Å; Y90-L113 HydrophobicContact CE2-CB 3.72Å; Y90-L113 HydrophobicContact CE2-CD2 4.18Å; Y90-I114 PolarHBondContact N-O 2.8Å; Y90-R115 VanDerWaalsContact O-CA 3.31Å; Y90-R115 WeakPolarHBondContact O-CA 3.12Å; Y90-E116 PolarHBondContact O-N 3.32Å; Y90-C186 HydrophobicContact CE2-CB 4.41Å; Y90-I188 WeakPolarHBondContact OH-CG1 3.22Å
91	T	93.9	Very high	95.2	Very high	31 Å²	31	38.6 Å²	38.6	19%	0.19	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	140	173.8	65.7	0	0	0	0	110	K83 E116	K83-T91 WeakPolarHBondContact CB-OG1 3.22Å; K83-T91 PolarHBondContact O-N 2.69Å; K83-T91 PolarHBondContact O-OG1 3.17Å; T91-E116 VanDerWaalsContact CG2-CD 3.49Å; T91-E116 HydrophobicContact CG2-CG 4.29Å; T91-E116 WeakPolarHBondContact CG2-OE1 3.24Å; T91-E116 WeakPolarHBondContact CG2-OE2 3.31Å
92	G	89.4	Confident	95.2	Very high	61 Å²	61	37.7 Å²	37.7	63%	0.629	19%	0.187	S	C	*	.	S	Bend	trans	77.9	24.5	178.7	0	0	0	0	0	114.8
93	I	94.7	Very high	95.2	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.01	20%	0.204	C	C	.	.			trans	-114.8	140.1	175.2	71.6	167.1	0	0	0	112.3	L34 A82 Y90 A98 L113 R115	L34-I93 HydrophobicContact CD1-CG2 4.07Å; L34-I93 HydrophobicContact CD2-CG2 3.7Å; A82-I93 HydrophobicContact CB-CG2 3.39Å; Y90-I93 VanDerWaalsContact CB-CD1 3.43Å; Y90-I93 HydrophobicContact CD1-CD1 3.82Å; Y90-I93 HydrophobicContact CD1-CG2 4.25Å; Y90-I93 HydrophobicContact CG-CD1 3.76Å; I93-A98 HydrophobicContact CD1-CB 3.97Å; I93-L113 HydrophobicContact CD1-CD1 3.84Å; I93-L113 HydrophobicContact CD1-CD2 4.26Å; I93-R115 HydrophobicContact CD1-CB 3.97Å; I93-R115 HydrophobicContact CG1-CB 3.66Å
94	S	94.6	Very high	95.2	Very high	33 Å²	33	39.3 Å²	39.3	23%	0.231	19%	0.194	C	C	.	.			trans	-79	165.3	175.1	76.3	0	0	0	0	111.9	Y96 K97 A98 E118	S94-Y96 VanDerWaalsContact C-N 3.29Å; S94-Y96 PolarHBondContact O-N 2.92Å; S94-K97 PolarHBondContact O-N 2.87Å; S94-K97 WeakPolarHBondContact OG-CB 3.4Å; S94-K97 PolarHBondContact OG-N 2.79Å; S94-K97 VanDerWaalsContact OG-N 3.12Å; S94-A98 PolarHBondContact O-N 3.48Å; S94-E118 WeakPolarHBondContact CB-OE1 3.38Å
95	R	94.2	Very high	95	Very high	132 Å²	132	44.5 Å²	44.5	50%	0.498	23%	0.228	S	C	.	.	H	α-helix	trans	-54.8	-46.9	171.6	-178	-177	174.5	173.9	-2.5	111.8	K97 A98 E99 H142	R95-K97 VanDerWaalsContact C-N 3.29Å; R95-K97 PolarHBondContact O-N 2.81Å; R95-A98 PolarHBondContact O-N 2.82Å; R95-E99 IonicContact NE-OE1 2.78Å; R95-E99 WeakPolarHBondContact O-CG 3.38Å; R95-E99 PolarHBondContact O-N 3.36Å; R95-H142 WeakPolarHBondContact CG-CE1 3.48Å; R95-H142 PolarHBondContact NE-CD2 3.25Å; R95-H142 PolarHBondContact NE-NE2 3.36Å; R95-H142 PolarHBondContact NH2-CD2 2.87Å
96	Y	94.9	Very high	95	Very high	148 Å²	148	46.6 Å²	46.6	58%	0.58	24%	0.243	S	C	*	.	H	α-helix	trans	-60.9	-43.2	-179.8	177.1	-96.9	0	0	0	110.4	S94 A98 E99 E100	S94-Y96 VanDerWaalsContact C-N 3.29Å; S94-Y96 PolarHBondContact O-N 2.92Å; Y96-A98 PolarHBondContact O-N 2.84Å; Y96-E99 WeakPolarHBondContact O-CB 3.34Å; Y96-E99 PolarHBondContact O-N 3.48Å; Y96-E100 HydrophobicContact CD1-CG 4.34Å; Y96-E100 HydrophobicContact CE1-CG 3.83Å; Y96-E100 WeakPolarHBondContact CE1-OE1 3.34Å; Y96-E100 WeakPolarHBondContact CE1-OE2 3.4Å; Y96-E100 VanDerWaalsContact CZ-OE1 3.3Å; Y96-E100 PolarHBondContact O-N 2.85Å; Y96-E100 VanDerWaalsContact O-N 3.14Å; Y96-E100 PolarHBondContact OH-OE1 2.88Å
97	K	96	Very high	95.1	Very high	7 Å²	7	44.9 Å²	44.9	3%	0.03	23%	0.234	C	C	.	.	H	α-helix	trans	-68	-37.2	-177.8	-159.8	48.8	158.5	169.9	0	113.6	L34 M49 S94 R95 E99 E100 L101	L34-K97 VanDerWaalsContact C-CE 3.47Å; L34-K97 HydrophobicContact CB-CG 4.35Å; L34-K97 HydrophobicContact CD1-CG 4.47Å; L34-K97 HydrophobicContact CD2-CG 3.99Å; L34-K97 WeakPolarHBondContact O-CE 3.39Å; L34-K97 PolarHBondContact O-NZ 3.21Å; M49-K97 PolarHBondContact SD-NZ 3.3Å; S94-K97 PolarHBondContact O-N 2.87Å; S94-K97 WeakPolarHBondContact OG-CB 3.4Å; S94-K97 PolarHBondContact OG-N 2.79Å; S94-K97 VanDerWaalsContact OG-N 3.12Å; R95-K97 VanDerWaalsContact C-N 3.29Å; R95-K97 PolarHBondContact O-N 2.81Å; K97-E99 PolarHBondContact O-N 2.91Å; K97-E100 HydrophobicContact CD-CB 4.39Å; K97-E100 WeakPolarHBondContact CD-OE2 3.22Å; K97-E100 WeakPolarHBondContact CE-OE2 3.45Å; K97-E100 IonicContact NZ-OE2 3.15Å; K97-E100 PolarHBondContact NZ-OE2 3.32Å; K97-E100 PolarHBondContact O-N 2.79Å; K97-L101 WeakPolarHBondContact O-CG 3.34Å; K97-L101 PolarHBondContact O-N 3.3Å
98	A	96.7	Very high	95.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.3	-37.9	170.7	0	0	0	0	0	112.5	I93 S94 R95 Y96 L102 L113	I93-A98 HydrophobicContact CD1-CB 3.97Å; S94-A98 PolarHBondContact O-N 3.48Å; R95-A98 PolarHBondContact O-N 2.82Å; Y96-A98 PolarHBondContact O-N 2.84Å; A98-L102 WeakPolarHBondContact O-CB 3.22Å; A98-L102 WeakPolarHBondContact O-CG 3.27Å; A98-L102 PolarHBondContact O-N 3.33Å; A98-L113 HydrophobicContact CB-CD1 3.83Å; A98-L113 HydrophobicContact CB-CD2 4.2Å; A98-L113 HydrophobicContact CB-CG 4.45Å
99	E	96.3	Very high	95	Very high	21 Å²	21	48.3 Å²	48.3	10%	0.098	26%	0.256	C	S	.	.	H	α-helix	trans	-67.5	-42.4	176.9	-63.3	-172.6	176.8	0	0	112.1	R95 Y96 K97 L102 K103 N138 V140 H142	R95-E99 IonicContact NE-OE1 2.78Å; R95-E99 WeakPolarHBondContact O-CG 3.38Å; R95-E99 PolarHBondContact O-N 3.36Å; Y96-E99 WeakPolarHBondContact O-CB 3.34Å; Y96-E99 PolarHBondContact O-N 3.48Å; K97-E99 PolarHBondContact O-N 2.91Å; E99-L102 PolarHBondContact O-N 3.06Å; E99-K103 WeakPolarHBondContact O-CB 3.37Å; E99-K103 VanDerWaalsContact O-CD 3.32Å; E99-K103 WeakPolarHBondContact O-CD 3.43Å; E99-K103 WeakPolarHBondContact O-CG 3.34Å; E99-K103 PolarHBondContact O-N 2.86Å; E99-K103 IonicContact OE2-NZ 4Å; E99-K103 PolarHBondContact OE2-NZ 2.75Å; E99-N138 PolarHBondContact OE1-ND2 2.74Å; E99-V140 HydrophobicContact CB-CB 4.48Å; E99-V140 HydrophobicContact CB-CG2 4.31Å; E99-V140 HydrophobicContact CG-CB 3.96Å; E99-V140 HydrophobicContact CG-CG1 4Å; E99-V140 HydrophobicContact CG-CG2 4.34Å; E99-H142 WeakPolarHBondContact CG-NE2 3.3Å; E99-H142 IonicContact OE1-CD2 3.3Å; E99-H142 IonicContact OE1-CE1 3.73Å; E99-H142 IonicContact OE1-NE2 3.68Å; E99-H142 PolarHBondContact OE1-NE2 2.79Å
100	E	96.3	Very high	95	Very high	49 Å²	49	47.5 Å²	47.5	23%	0.229	25%	0.252	C	S	.	.	H	α-helix	trans	-60.7	-47.1	176.9	-66.3	-172.4	132	0	0	111.7	M49 Y96 K97 L102 K103	M49-E100 HydrophobicContact CE-CB 4.28Å; M49-E100 HydrophobicContact SD-CB 3.97Å; Y96-E100 HydrophobicContact CD1-CG 4.34Å; Y96-E100 HydrophobicContact CE1-CG 3.83Å; Y96-E100 WeakPolarHBondContact CE1-OE1 3.34Å; Y96-E100 WeakPolarHBondContact CE1-OE2 3.4Å; Y96-E100 VanDerWaalsContact CZ-OE1 3.3Å; Y96-E100 PolarHBondContact O-N 2.85Å; Y96-E100 VanDerWaalsContact O-N 3.14Å; Y96-E100 PolarHBondContact OH-OE1 2.88Å; K97-E100 HydrophobicContact CD-CB 4.39Å; K97-E100 WeakPolarHBondContact CD-OE2 3.22Å; K97-E100 WeakPolarHBondContact CE-OE2 3.45Å; K97-E100 IonicContact NZ-OE2 3.15Å; K97-E100 PolarHBondContact NZ-OE2 3.32Å; K97-E100 PolarHBondContact O-N 2.79Å; E100-L102 PolarHBondContact O-N 3.47Å; E100-K103 PolarHBondContact O-N 2.82Å
101	L	97.1	Very high	95.1	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-60.9	-45.9	177	-69.1	171.5	0	0	0	111.7	L34 M49 Y90 K97 K103 H104 N107	L34-L101 HydrophobicContact CD2-CD1 4.12Å; M49-L101 HydrophobicContact CG-CD2 3.81Å; M49-L101 HydrophobicContact SD-CD2 4.44Å; Y90-L101 HydrophobicContact CD1-CD1 4.35Å; Y90-L101 HydrophobicContact CE1-CD1 3.97Å; K97-L101 WeakPolarHBondContact O-CG 3.34Å; K97-L101 PolarHBondContact O-N 3.3Å; L101-K103 VanDerWaalsContact C-N 3.31Å; L101-K103 PolarHBondContact O-N 2.84Å; L101-H104 WeakPolarHBondContact O-CB 3.13Å; L101-H104 PolarHBondContact O-N 2.99Å; L101-N107 PolarHBondContact O-ND2 3.16Å
102	L	96.8	Very high	95.3	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-67.6	-30.2	179.1	-76.8	171	0	0	0	112.8	A98 E99 E100 H104 N107 A111 L113 L129 V140 C186	A98-L102 WeakPolarHBondContact O-CB 3.22Å; A98-L102 WeakPolarHBondContact O-CG 3.27Å; A98-L102 PolarHBondContact O-N 3.33Å; E99-L102 PolarHBondContact O-N 3.06Å; E100-L102 PolarHBondContact O-N 3.47Å; L102-H104 PolarHBondContact O-N 2.95Å; L102-N107 WeakPolarHBondContact O-CB 3.44Å; L102-N107 PolarHBondContact O-ND2 3.33Å; L102-A111 HydrophobicContact CD2-CB 4.36Å; L102-L113 HydrophobicContact CD1-CD2 4.37Å; L102-L113 HydrophobicContact CD1-CG 4.22Å; L102-L113 HydrophobicContact CD2-CD2 4.43Å; L102-L113 HydrophobicContact CG-CD2 4.02Å; L102-L113 HydrophobicContact CG-CG 4.32Å; L102-L129 HydrophobicContact CB-CB 4.44Å; L102-L129 WeakPolarHBondContact O-CD2 3.45Å; L102-V140 HydrophobicContact CB-CG2 4.05Å; L102-V140 HydrophobicContact CD1-CG1 3.73Å; L102-V140 HydrophobicContact CD1-CG2 4.45Å; L102-C186 HydrophobicContact CD2-CB 3.99Å
103	K	95.2	Very high	95.7	Very high	89 Å²	89	43.3 Å²	43.3	39%	0.387	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-7.8	177.5	-75.4	164.2	-174.2	165.2	0	113.4	E99 E100 L101 P139 V140	E99-K103 WeakPolarHBondContact O-CB 3.37Å; E99-K103 VanDerWaalsContact O-CD 3.32Å; E99-K103 WeakPolarHBondContact O-CD 3.43Å; E99-K103 WeakPolarHBondContact O-CG 3.34Å; E99-K103 PolarHBondContact O-N 2.86Å; E99-K103 IonicContact OE2-NZ 4Å; E99-K103 PolarHBondContact OE2-NZ 2.75Å; E100-K103 PolarHBondContact O-N 2.82Å; L101-K103 VanDerWaalsContact C-N 3.31Å; L101-K103 PolarHBondContact O-N 2.84Å; K103-P139 HydrophobicContact CG-CG 4.37Å; K103-V140 HydrophobicContact CG-CG2 4.38Å
104	H	94.7	Very high	95.9	Very high	47 Å²	47	43.2 Å²	43.2	22%	0.218	21%	0.214	C	C	.	.	S	Bend	trans	-50.9	137.2	176	-168.7	-86.7	0	0	0	111.9	L101 L102 S106 N107 F187	L101-H104 WeakPolarHBondContact O-CB 3.13Å; L101-H104 PolarHBondContact O-N 2.99Å; L102-H104 PolarHBondContact O-N 2.95Å; H104-S106 VanDerWaalsContact C-N 3.26Å; H104-S106 PolarHBondContact CE1-OG 2.91Å; H104-S106 WeakPolarHBondContact ND1-CB 3.3Å; H104-S106 PolarHBondContact ND1-N 2.95Å; H104-S106 PolarHBondContact ND1-OG 2.97Å; H104-S106 PolarHBondContact O-N 2.79Å; H104-N107 WeakPolarHBondContact O-CB 3.49Å; H104-N107 PolarHBondContact O-N 2.9Å; H104-F187 AromaticContact CE1-CD1 3.68Å; H104-F187 AromaticContact CE1-CE1 3.62Å; H104-F187 AromaticContact ND1-CD1 3.53Å; H104-F187 AromaticContact ND1-CE1 3.96Å
105	P	93.2	Very high	96	Very high	109 Å²	109	42.5 Å²	42.5	71%	0.708	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-30.2	-173	21.9	-34.4	0	0	0	114.1	N107	P105-N107 PolarHBondContact O-N 2.99Å
106	S	94.2	Very high	95.9	Very high	61 Å²	61	39.7 Å²	39.7	43%	0.427	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-16.5	175.4	-49.6	0	0	0	0	113.8	H104	H104-S106 VanDerWaalsContact C-N 3.26Å; H104-S106 PolarHBondContact CE1-OG 2.91Å; H104-S106 WeakPolarHBondContact ND1-CB 3.3Å; H104-S106 PolarHBondContact ND1-N 2.95Å; H104-S106 PolarHBondContact ND1-OG 2.97Å; H104-S106 PolarHBondContact O-N 2.79Å
107	N	95.4	Very high	95.1	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.011	18%	0.177	C	C	.	.			trans	-81.6	137.5	175.6	-72.4	-45.3	0	0	0	111.6	L101 L102 H104 P105 A111 L129 R131 F187	L101-N107 PolarHBondContact O-ND2 3.16Å; L102-N107 WeakPolarHBondContact O-CB 3.44Å; L102-N107 PolarHBondContact O-ND2 3.33Å; H104-N107 WeakPolarHBondContact O-CB 3.49Å; H104-N107 PolarHBondContact O-N 2.9Å; P105-N107 PolarHBondContact O-N 2.99Å; N107-A111 HydrophobicContact CB-CB 3.84Å; N107-L129 HydrophobicContact CB-CD2 3.81Å; N107-R131 PolarHBondContact O-NH1 3.45Å; N107-R131 PolarHBondContact O-NH2 2.83Å; N107-F187 VanDerWaalsContact OD1-CB 3.23Å; N107-F187 WeakPolarHBondContact OD1-CB 3.36Å; N107-F187 PolarHBondContact OD1-N 3.26Å
108	Q	94.4	Very high	93.9	Very high	142 Å²	142	39.7 Å²	39.7	66%	0.664	21%	0.206	S	C	*	.			trans	-106.8	167.1	175.9	-59.4	-177.4	28.4	0	0	110.9	G110 A111	Q108-G110 PolarHBondContact O-N 3.2Å; Q108-A111 WeakPolarHBondContact O-CB 3.26Å; Q108-A111 PolarHBondContact O-N 3.27Å
109	T	95.2	Very high	92.6	Very high	59 Å²	59	45.3 Å²	45.3	36%	0.362	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	134.4	174.2	-68.1	0	0	0	0	110.7	R130 R131 T183	T109-R130 HydrophobicContact CG2-CB 4.47Å; T109-R130 HydrophobicContact CG2-CG 4.18Å; T109-R131 WeakPolarHBondContact OG1-CB 3.49Å; T109-R131 PolarHBondContact OG1-N 3.41Å; T109-R131 PolarHBondContact OG1-O 3.07Å; T109-T183 PolarHBondContact O-OG1 3.33Å
110	G	96.1	Very high	91.5	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.8	-6.8	-172.4	0	0	0	0	0	114.4	Q108 F112 L129 R181 T183	Q108-G110 PolarHBondContact O-N 3.2Å; G110-F112 PolarHBondContact O-N 2.94Å; G110-L129 PolarHBondContact N-O 3.36Å; G110-R181 WeakPolarHBondContact CA-O 3.2Å; G110-T183 VanDerWaalsContact CA-OG1 3.31Å; G110-T183 WeakPolarHBondContact CA-OG1 3.24Å; G110-T183 PolarHBondContact O-N 3.14Å; G110-T183 PolarHBondContact O-OG1 3.14Å
111	A	97.8	Very high	90.1	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.291	C	S	.	.			trans	-59.7	136.8	171.1	0	0	0	0	0	110.1	L102 N107 Q108 L129 T183 V184	L102-A111 HydrophobicContact CD2-CB 4.36Å; N107-A111 HydrophobicContact CB-CB 3.84Å; Q108-A111 WeakPolarHBondContact O-CB 3.26Å; Q108-A111 PolarHBondContact O-N 3.27Å; A111-L129 HydrophobicContact CB-CB 4.34Å; A111-L129 PolarHBondContact O-N 2.88Å; A111-T183 PolarHBondContact N-OG1 3.38Å; A111-V184 VanDerWaalsContact CA-O 3.27Å; A111-V184 WeakPolarHBondContact CA-O 3.45Å; A111-V184 HydrophobicContact CB-CG2 4.27Å
112	F	98.5	Very high	89	Confident	5 Å²	5	63.1 Å²	63.1	2%	0.022	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	159.5	-171.2	75.3	-81.8	0	0	0	113.4	W88 G110 L126 S127 I128 V168 L182 V184 P185 C186	W88-F112 HydrophobicContact CB-CD2 4.4Å; W88-F112 HydrophobicContact CB-CE2 3.71Å; W88-F112 HydrophobicContact CB-CZ 4.14Å; W88-F112 HydrophobicContact CD2-CE2 4.39Å; W88-F112 AromaticContact CG-CE2 3.9Å; W88-F112 HydrophobicContact CG-CE2 3.9Å; W88-F112 HydrophobicContact CG-CZ 4.2Å; G110-F112 PolarHBondContact O-N 2.94Å; F112-L126 HydrophobicContact CB-CD1 4.13Å; F112-L126 HydrophobicContact CD2-CD1 3.82Å; F112-L126 HydrophobicContact CG-CD1 4.36Å; F112-S127 VanDerWaalsContact CA-O 3.22Å; F112-S127 WeakPolarHBondContact CA-O 3.4Å; F112-S127 WeakPolarHBondContact CB-O 3.32Å; F112-I128 HydrophobicContact CB-CG1 4.33Å; F112-V168 HydrophobicContact CE2-CG1 3.86Å; F112-V168 HydrophobicContact CE2-CG2 4Å; F112-V168 HydrophobicContact CZ-CG1 3.54Å; F112-L182 HydrophobicContact CB-CD2 3.78Å; F112-L182 HydrophobicContact CD1-CB 3.73Å; F112-L182 HydrophobicContact CD1-CD1 4.46Å; F112-L182 HydrophobicContact CD1-CD2 4.1Å; F112-L182 HydrophobicContact CD1-CG 4.3Å; F112-L182 HydrophobicContact CD2-CD1 4.17Å; F112-L182 HydrophobicContact CD2-CD2 4.34Å; F112-L182 HydrophobicContact CE1-CB 3.86Å; F112-L182 HydrophobicContact CE2-CD1 4.22Å; F112-L182 HydrophobicContact CG-CB 4.27Å; F112-L182 HydrophobicContact CG-CD1 4.31Å; F112-L182 HydrophobicContact CG-CD2 3.81Å; F112-L182 HydrophobicContact CG-CG 4.34Å; F112-L182 HydrophobicContact CZ-CB 4.49Å; F112-L182 HydrophobicContact CZ-CD1 4.39Å; F112-V184 WeakPolarHBondContact CD1-O 3.41Å; F112-V184 WeakPolarHBondContact CE1-O 3.26Å; F112-V184 PolarHBondContact N-O 2.9Å; F112-P185 CarbonylContact O-C 3.55Å; F112-P185 WeakPolarHBondContact O-CA 3.12Å; F112-C186 PolarHBondContact O-N 2.85Å
113	L	98.1	Very high	88.4	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	153.4	163.9	64.2	81.7	0	0	0	109.6	Y90 I93 A98 L102 R115 S127 C186	Y90-L113 HydrophobicContact CD2-CB 3.73Å; Y90-L113 HydrophobicContact CD2-CD1 4.45Å; Y90-L113 HydrophobicContact CD2-CD2 4.29Å; Y90-L113 HydrophobicContact CD2-CG 4.38Å; Y90-L113 HydrophobicContact CE2-CB 3.72Å; Y90-L113 HydrophobicContact CE2-CD2 4.18Å; I93-L113 HydrophobicContact CD1-CD1 3.84Å; I93-L113 HydrophobicContact CD1-CD2 4.26Å; A98-L113 HydrophobicContact CB-CD1 3.83Å; A98-L113 HydrophobicContact CB-CD2 4.2Å; A98-L113 HydrophobicContact CB-CG 4.45Å; L102-L113 HydrophobicContact CD1-CD2 4.37Å; L102-L113 HydrophobicContact CD1-CG 4.22Å; L102-L113 HydrophobicContact CD2-CD2 4.43Å; L102-L113 HydrophobicContact CG-CD2 4.02Å; L102-L113 HydrophobicContact CG-CG 4.32Å; L113-R115 HydrophobicContact CD1-CB 4.14Å; L113-R115 HydrophobicContact CD1-CG 4.48Å; L113-S127 PolarHBondContact N-O 2.84Å; L113-S127 PolarHBondContact O-N 3.07Å; L113-C186 HydrophobicContact CB-CB 4.07Å; L113-C186 HydrophobicContact CD2-CB 4.02Å
114	I	97.9	Very high	88.4	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	130	169.7	-63.3	179.9	0	0	0	106.9	W88 L89 Y90 Y124 S125 L126 I145 L164 L167 V168	W88-I114 HydrophobicContact CE3-CB 3.95Å; W88-I114 HydrophobicContact CE3-CD1 3.77Å; W88-I114 HydrophobicContact CE3-CG1 4.02Å; W88-I114 HydrophobicContact CZ3-CB 4.18Å; W88-I114 HydrophobicContact CZ3-CD1 3.67Å; W88-I114 HydrophobicContact CZ3-CG1 4.3Å; W88-I114 PolarHBondContact O-N 2.75Å; L89-I114 CarbonylContact C-O 3.53Å; L89-I114 WeakPolarHBondContact CA-O 3.41Å; L89-I114 HydrophobicContact CD1-CB 4.23Å; L89-I114 HydrophobicContact CD1-CG2 3.84Å; Y90-I114 PolarHBondContact N-O 2.8Å; I114-Y124 HydrophobicContact CG2-CD1 4.17Å; I114-Y124 HydrophobicContact CG2-CG 4.25Å; I114-S125 WeakPolarHBondContact CA-O 3.31Å; I114-L126 HydrophobicContact CD1-CD1 4.33Å; I114-L126 HydrophobicContact CG1-CB 4.35Å; I114-L126 HydrophobicContact CG1-CD1 3.72Å; I114-I145 HydrophobicContact CD1-CD1 3.93Å; I114-I145 HydrophobicContact CG1-CD1 4.22Å; I114-I145 HydrophobicContact CG2-CD1 4Å; I114-L164 HydrophobicContact CD1-CD2 4.34Å; I114-L164 HydrophobicContact CG2-CD1 4.43Å; I114-L167 HydrophobicContact CD1-CD2 4.49Å; I114-V168 HydrophobicContact CD1-CG2 3.58Å
115	R	96.3	Very high	88.5	Confident	18 Å²	18	60.1 Å²	60.1	7%	0.068	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	146.5	175.4	62.4	-179	177.9	75.7	7.8	111.1	Y90 I93 L113 Y124 S125	Y90-R115 VanDerWaalsContact O-CA 3.31Å; Y90-R115 WeakPolarHBondContact O-CA 3.12Å; I93-R115 HydrophobicContact CD1-CB 3.97Å; I93-R115 HydrophobicContact CG1-CB 3.66Å; L113-R115 HydrophobicContact CD1-CB 4.14Å; L113-R115 HydrophobicContact CD1-CG 4.48Å; R115-Y124 CarbonylContact O-C 3.59Å; R115-Y124 WeakPolarHBondContact O-CA 3.27Å; R115-S125 PolarHBondContact N-O 2.93Å; R115-S125 PolarHBondContact NH2-OG 2.82Å; R115-S125 PolarHBondContact O-N 3.13Å
116	E	92.2	Very high	88.7	Confident	72 Å²	72	55 Å²	55	34%	0.336	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	145.1	165.6	-73.6	175.8	179.6	0	0	110.4	Y90 T91 Y124	Y90-E116 PolarHBondContact O-N 3.32Å; T91-E116 VanDerWaalsContact CG2-CD 3.49Å; T91-E116 HydrophobicContact CG2-CG 4.29Å; T91-E116 WeakPolarHBondContact CG2-OE1 3.24Å; T91-E116 WeakPolarHBondContact CG2-OE2 3.31Å; E116-Y124 HydrophobicContact CG-CD1 3.84Å; E116-Y124 HydrophobicContact CG-CE1 3.56Å
117	S	79.8	Confident	88.9	Confident	21 Å²	21	52 Å²	52	15%	0.147	26%	0.256	C	S	.	.			trans	-79	128.8	174.9	-174.3	0	0	0	0	110.6	T119 N120 S123	S117-T119 PolarHBondContact O-N 2.82Å; S117-T119 PolarHBondContact OG-OG1 2.76Å; S117-N120 WeakPolarHBondContact CB-O 3.23Å; S117-S123 VanDerWaalsContact CB-O 3.22Å; S117-S123 WeakPolarHBondContact CB-O 3.38Å; S117-S123 WeakPolarHBondContact CB-OG 3.37Å; S117-S123 PolarHBondContact N-O 3.3Å
118	E	69.8	Low	89	Confident	135 Å²	135	52 Å²	52	63%	0.631	26%	0.255	S	S	*	.	S	Bend	trans	-62	-29.4	177.1	-65.1	171.1	127.4	0	0	112.4	S94	S94-E118 WeakPolarHBondContact CB-OE1 3.38Å
119	T	69.4	Low	89.1	Confident	118 Å²	118	45.2 Å²	45.2	72%	0.724	22%	0.224	S	C	*	.	S	Bend	trans	-98.1	-21.9	-174.3	53.3	0	0	0	0	114.3	S117	S117-T119 PolarHBondContact O-N 2.82Å; S117-T119 PolarHBondContact OG-OG1 2.76Å
120	N	73.5	Confident	89	Confident	99 Å²	99	44.1 Å²	44.1	53%	0.529	21%	0.213	S	C	.	.			trans	-139.5	99.4	-172.8	-76.7	-34.2	0	0	0	109.1	S117 D122 S123	S117-N120 WeakPolarHBondContact CB-O 3.23Å; N120-D122 PolarHBondContact O-N 2.97Å; N120-S123 WeakPolarHBondContact CB-OG 3.42Å; N120-S123 PolarHBondContact O-N 2.77Å; N120-S123 PolarHBondContact O-OG 3.15Å
121	R	67.1	Low	88.6	Confident	230 Å²	230	50.2 Å²	50.2	87%	0.868	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	-23.8	-173.5	-68.3	-173.9	178.5	-119	1.4	114.1
122	D	72.4	Confident	87.8	Confident	119 Å²	119	53.3 Å²	53.3	64%	0.636	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	19.4	179.5	-50.7	-42.4	0	0	0	113.2	N120	N120-D122 PolarHBondContact O-N 2.97Å
123	S	85.6	Confident	86.4	Confident	14 Å²	14	56.4 Å²	56.4	10%	0.098	29%	0.288	C	S	.	.			trans	-131.5	142.5	178.5	71.3	0	0	0	0	111.9	S117 N120	S117-S123 VanDerWaalsContact CB-O 3.22Å; S117-S123 WeakPolarHBondContact CB-O 3.38Å; S117-S123 WeakPolarHBondContact CB-OG 3.37Å; S117-S123 PolarHBondContact N-O 3.3Å; N120-S123 WeakPolarHBondContact CB-OG 3.42Å; N120-S123 PolarHBondContact O-N 2.77Å; N120-S123 PolarHBondContact O-OG 3.15Å
124	Y	95.2	Very high	84.7	Confident	44 Å²	44	62.5 Å²	62.5	17%	0.173	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	162.8	176.9	-55.1	-88.1	0	0	0	110	L89 I114 R115 E116 I145 L164	L89-Y124 HydrophobicContact CD1-CD1 4.03Å; L89-Y124 HydrophobicContact CD1-CE1 4.06Å; I114-Y124 HydrophobicContact CG2-CD1 4.17Å; I114-Y124 HydrophobicContact CG2-CG 4.25Å; R115-Y124 CarbonylContact O-C 3.59Å; R115-Y124 WeakPolarHBondContact O-CA 3.27Å; E116-Y124 HydrophobicContact CG-CD1 3.84Å; E116-Y124 HydrophobicContact CG-CE1 3.56Å; Y124-I145 PolarHBondContact N-O 2.86Å; Y124-I145 VanDerWaalsContact N-O 3.13Å; Y124-I145 PolarHBondContact O-N 3.37Å; Y124-L164 HydrophobicContact CD1-CD1 4.07Å; Y124-L164 HydrophobicContact CD2-CD1 4.11Å; Y124-L164 HydrophobicContact CD2-CD2 4.05Å; Y124-L164 HydrophobicContact CD2-CG 4.48Å; Y124-L164 HydrophobicContact CE1-CD1 3.97Å; Y124-L164 HydrophobicContact CE2-CD1 4.01Å; Y124-L164 HydrophobicContact CG-CD1 4.14Å; Y124-L164 HydrophobicContact CG-CD2 4.31Å
125	S	96	Very high	83	Confident	15 Å²	15	67.2 Å²	67.2	11%	0.105	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	125.2	171	-65.4	0	0	0	0	109.5	I114 R115 Y143	I114-S125 WeakPolarHBondContact CA-O 3.31Å; R115-S125 PolarHBondContact N-O 2.93Å; R115-S125 PolarHBondContact NH2-OG 2.82Å; R115-S125 PolarHBondContact O-N 3.13Å; S125-Y143 CarbonylContact C-O 3.57Å; S125-Y143 WeakPolarHBondContact CA-O 3.14Å
126	L	97.5	Very high	81.6	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	121.1	171.2	172.1	65.1	0	0	0	109	F112 I114 I128 H142 Y143 I145 I155 L178 L182	F112-L126 HydrophobicContact CB-CD1 4.13Å; F112-L126 HydrophobicContact CD2-CD1 3.82Å; F112-L126 HydrophobicContact CG-CD1 4.36Å; I114-L126 HydrophobicContact CD1-CD1 4.33Å; I114-L126 HydrophobicContact CG1-CB 4.35Å; I114-L126 HydrophobicContact CG1-CD1 3.72Å; L126-I128 HydrophobicContact CD1-CG1 4.13Å; L126-I128 HydrophobicContact CD2-CD1 3.85Å; L126-I128 HydrophobicContact CD2-CG1 4.2Å; L126-I128 HydrophobicContact CG-CD1 4.02Å; L126-I128 HydrophobicContact CG-CG1 3.81Å; L126-H142 CarbonylContact O-C 3.6Å; L126-H142 WeakPolarHBondContact O-CA 2.7Å; L126-Y143 PolarHBondContact N-O 2.99Å; L126-Y143 PolarHBondContact O-N 2.8Å; L126-I145 HydrophobicContact CB-CD1 3.83Å; L126-I145 HydrophobicContact CB-CG1 4.26Å; L126-I155 HydrophobicContact CB-CD1 4.42Å; L126-I155 HydrophobicContact CD2-CD1 3.62Å; L126-L178 HydrophobicContact CD2-CD1 3.91Å; L126-L182 HydrophobicContact CD1-CD1 4.45Å; L126-L182 HydrophobicContact CD1-CD2 4.17Å; L126-L182 HydrophobicContact CD2-CD2 4.26Å
127	S	98	Very high	80.7	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	127.3	176	-54.9	0	0	0	0	108.8	F112 L113 K141 H142	F112-S127 VanDerWaalsContact CA-O 3.22Å; F112-S127 WeakPolarHBondContact CA-O 3.4Å; F112-S127 WeakPolarHBondContact CB-O 3.32Å; L113-S127 PolarHBondContact N-O 2.84Å; L113-S127 PolarHBondContact O-N 3.07Å; S127-K141 CarbonylContact C-O 3.48Å; S127-K141 WeakPolarHBondContact CA-O 3.42Å; S127-H142 PolarHBondContact OG-ND1 3.21Å
128	I	97.7	Very high	80.9	Confident	0 Å²	0	76 Å²	76	0%	0	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	129.6	-175.4	-48.8	173.2	0	0	0	109.8	F112 L126 V140 K141 Y143 L178 L182	F112-I128 HydrophobicContact CB-CG1 4.33Å; L126-I128 HydrophobicContact CD1-CG1 4.13Å; L126-I128 HydrophobicContact CD2-CD1 3.85Å; L126-I128 HydrophobicContact CD2-CG1 4.2Å; L126-I128 HydrophobicContact CG-CD1 4.02Å; L126-I128 HydrophobicContact CG-CG1 3.81Å; I128-V140 CarbonylContact O-C 3.6Å; I128-V140 WeakPolarHBondContact O-CA 3.5Å; I128-K141 PolarHBondContact N-O 3.01Å; I128-K141 PolarHBondContact O-N 3.26Å; I128-Y143 HydrophobicContact CD1-CD2 3.94Å; I128-Y143 HydrophobicContact CD1-CE2 3.83Å; I128-Y143 HydrophobicContact CG1-CD2 4.47Å; I128-L178 HydrophobicContact CD1-CB 4.38Å; I128-L178 HydrophobicContact CD1-CD1 3.84Å; I128-L182 HydrophobicContact CD1-CD2 3.6Å; I128-L182 HydrophobicContact CG1-CD2 3.81Å; I128-L182 HydrophobicContact CG2-CD2 4.4Å
129	L	96.9	Very high	81.9	Confident	1 Å²	1	71 Å²	71	1%	0.005	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	128.3	171.9	-175.7	70.8	0	0	0	111	L102 N107 G110 A111 P139 V140	L102-L129 HydrophobicContact CB-CB 4.44Å; L102-L129 WeakPolarHBondContact O-CD2 3.45Å; N107-L129 HydrophobicContact CB-CD2 3.81Å; G110-L129 PolarHBondContact N-O 3.36Å; A111-L129 HydrophobicContact CB-CB 4.34Å; A111-L129 PolarHBondContact O-N 2.88Å; L129-P139 HydrophobicContact CD1-CB 3.96Å; L129-P139 HydrophobicContact CD1-CG 4.2Å; L129-V140 HydrophobicContact CD1-CG2 3.93Å
130	R	93.7	Very high	83.2	Confident	36 Å²	36	65.5 Å²	65.5	14%	0.136	36%	0.358	C	S	.	.			trans	-129.2	110.3	163.7	-176.8	-177.8	-60.5	67.9	37.8	110.7	T109 T132 P139 C179 C180	T109-R130 HydrophobicContact CG2-CB 4.47Å; T109-R130 HydrophobicContact CG2-CG 4.18Å; R130-T132 PolarHBondContact O-N 3.01Å; R130-P139 PolarHBondContact N-O 2.94Å; R130-P139 WeakPolarHBondContact O-CA 3.09Å; R130-P139 VanDerWaalsContact O-CB 3.22Å; R130-P139 WeakPolarHBondContact O-CB 3.19Å; R130-C179 PolarHBondContact NE-O 2.8Å; R130-C179 PolarHBondContact NH1-SG 3.02Å; R130-C179 PolarHBondContact NH2-O 2.97Å; R130-C179 PolarHBondContact NH2-SG 3.27Å; R130-C180 PolarHBondContact NH2-SG 3.49Å
131	R	88.3	Confident	84.2	Confident	127 Å²	127	64.4 Å²	64.4	48%	0.479	35%	0.348	S	S	.	.			trans	-87.2	99.5	170.3	-159.8	173	-73.4	132.1	-1.4	107.4	N107 T109	N107-R131 PolarHBondContact O-NH1 3.45Å; N107-R131 PolarHBondContact O-NH2 2.83Å; T109-R131 WeakPolarHBondContact OG1-CB 3.49Å; T109-R131 PolarHBondContact OG1-N 3.41Å; T109-R131 PolarHBondContact OG1-O 3.07Å
132	T	80.7	Confident	85.6	Confident	65 Å²	65	55.4 Å²	55.4	40%	0.399	32%	0.316	S	S	.	.			trans	-95.5	131.3	173.6	-27.9	0	0	0	0	108	R130 S134 D136	R130-T132 PolarHBondContact O-N 3.01Å; T132-S134 PolarHBondContact O-N 3.15Å; T132-S134 VanDerWaalsContact O-N 3.12Å; T132-D136 WeakPolarHBondContact CB-OD2 3.4Å; T132-D136 PolarHBondContact OG1-OD2 2.9Å
133	G	69.1	Low	86.7	Confident	70 Å²	70	52 Å²	52	72%	0.722	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	115.1	178.5	0	0	0	0	0	110.4
134	S	61.9	Low	87.1	Confident	129 Å²	129	59.7 Å²	59.7	90%	0.902	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.6	5.4	159.8	72	0	0	0	0	123.1	T132	T132-S134 PolarHBondContact O-N 3.15Å; T132-S134 VanDerWaalsContact O-N 3.12Å
135	S	61.4	Low	87.1	Confident	98 Å²	98	57.6 Å²	57.6	69%	0.685	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-151.6	-7.7	172.8	73.9	0	0	0	0	119.2	L137	S135-L137 PolarHBondContact O-N 2.66Å; S135-L137 VanDerWaalsContact O-N 3.13Å
136	D	67.6	Low	87	Confident	65 Å²	65	57.8 Å²	57.8	35%	0.348	32%	0.315	S	S	.	.			trans	-82.1	100	-176.1	-83.1	-35.2	0	0	0	111.7	T132 N138	T132-D136 WeakPolarHBondContact CB-OD2 3.4Å; T132-D136 PolarHBondContact OG1-OD2 2.9Å; D136-N138 PolarHBondContact O-N 3.36Å
137	L	73.9	Confident	86.7	Confident	182 Å²	182	61.4 Å²	61.4	95%	0.953	33%	0.331	S	S	*	.	S	Bend	trans	-57.2	-28.4	173.4	-70	168	0	0	0	112.7	S135	S135-L137 PolarHBondContact O-N 2.66Å; S135-L137 VanDerWaalsContact O-N 3.13Å
138	N	82.3	Confident	86.4	Confident	50 Å²	50	64.7 Å²	64.7	27%	0.267	35%	0.348	S	S	.	.			trans	-126.5	101.4	172.8	-167.4	0.5	0	0	0	111	E99 D136 V140	E99-N138 PolarHBondContact OE1-ND2 2.74Å; D136-N138 PolarHBondContact O-N 3.36Å; N138-V140 PolarHBondContact O-N 2.93Å; N138-V140 PolarHBondContact OD1-N 2.85Å; N138-V140 VanDerWaalsContact OD1-N 3.17Å; N138-V140 PolarHBondContact OD1-O 2.96Å
139	P	91.6	Very high	86.1	Confident	30 Å²	30	74.5 Å²	74.5	20%	0.195	39%	0.394	C	S	.	.			trans	-73.8	-11.6	-179.2	31.1	-35.4	0	0	0	112.5	K103 L129 R130	K103-P139 HydrophobicContact CG-CG 4.37Å; L129-P139 HydrophobicContact CD1-CB 3.96Å; L129-P139 HydrophobicContact CD1-CG 4.2Å; R130-P139 PolarHBondContact N-O 2.94Å; R130-P139 WeakPolarHBondContact O-CA 3.09Å; R130-P139 VanDerWaalsContact O-CB 3.22Å; R130-P139 WeakPolarHBondContact O-CB 3.19Å
140	V	95.9	Very high	85.8	Confident	2 Å²	2	79 Å²	79	1%	0.012	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	124.3	-178.6	-175.8	0	0	0	0	110.4	E99 L102 K103 I128 L129 N138	E99-V140 HydrophobicContact CB-CB 4.48Å; E99-V140 HydrophobicContact CB-CG2 4.31Å; E99-V140 HydrophobicContact CG-CB 3.96Å; E99-V140 HydrophobicContact CG-CG1 4Å; E99-V140 HydrophobicContact CG-CG2 4.34Å; L102-V140 HydrophobicContact CB-CG2 4.05Å; L102-V140 HydrophobicContact CD1-CG1 3.73Å; L102-V140 HydrophobicContact CD1-CG2 4.45Å; K103-V140 HydrophobicContact CG-CG2 4.38Å; I128-V140 CarbonylContact O-C 3.6Å; I128-V140 WeakPolarHBondContact O-CA 3.5Å; L129-V140 HydrophobicContact CD1-CG2 3.93Å; N138-V140 PolarHBondContact O-N 2.93Å; N138-V140 PolarHBondContact OD1-N 2.85Å; N138-V140 VanDerWaalsContact OD1-N 3.17Å; N138-V140 PolarHBondContact OD1-O 2.96Å
141	K	95.6	Very high	85.7	Confident	75 Å²	75	80.8 Å²	80.8	33%	0.326	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	142.2	174.6	-57.7	-57.1	-177.1	-168.9	0	110	S127 I128 Y143 C179	S127-K141 CarbonylContact C-O 3.48Å; S127-K141 WeakPolarHBondContact CA-O 3.42Å; I128-K141 PolarHBondContact N-O 3.01Å; I128-K141 PolarHBondContact O-N 3.26Å; K141-Y143 HydrophobicContact CB-CE2 3.97Å; K141-C179 VanDerWaalsContact CB-SG 3.57Å; K141-C179 HydrophobicContact CG-CB 4.42Å
142	H	95.7	Very high	86	Confident	42 Å²	42	79.8 Å²	79.8	19%	0.194	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	132.8	-175.8	-59.1	-100.1	0	0	0	109.9	R95 E99 L126 S127	R95-H142 WeakPolarHBondContact CG-CE1 3.48Å; R95-H142 PolarHBondContact NE-CD2 3.25Å; R95-H142 PolarHBondContact NE-NE2 3.36Å; R95-H142 PolarHBondContact NH2-CD2 2.87Å; E99-H142 WeakPolarHBondContact CG-NE2 3.3Å; E99-H142 IonicContact OE1-CD2 3.3Å; E99-H142 IonicContact OE1-CE1 3.73Å; E99-H142 IonicContact OE1-NE2 3.68Å; E99-H142 PolarHBondContact OE1-NE2 2.79Å; L126-H142 CarbonylContact O-C 3.6Å; L126-H142 WeakPolarHBondContact O-CA 2.7Å; S127-H142 PolarHBondContact OG-ND1 3.21Å
143	Y	95.9	Very high	86.7	Confident	48 Å²	48	76.9 Å²	76.9	19%	0.188	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	129.9	178.4	-65	-89.9	0	0	0	109.5	S125 L126 I128 K141 I145 I155 L178 C179	S125-Y143 CarbonylContact C-O 3.57Å; S125-Y143 WeakPolarHBondContact CA-O 3.14Å; L126-Y143 PolarHBondContact N-O 2.99Å; L126-Y143 PolarHBondContact O-N 2.8Å; I128-Y143 HydrophobicContact CD1-CD2 3.94Å; I128-Y143 HydrophobicContact CD1-CE2 3.83Å; I128-Y143 HydrophobicContact CG1-CD2 4.47Å; K141-Y143 HydrophobicContact CB-CE2 3.97Å; Y143-I145 PolarHBondContact O-N 2.97Å; Y143-I155 HydrophobicContact CD1-CG2 4.05Å; Y143-I155 HydrophobicContact CG-CG2 4.45Å; Y143-L178 HydrophobicContact CD1-CD2 3.49Å; Y143-L178 VanDerWaalsContact CD1-CD2 3.49Å; Y143-L178 HydrophobicContact CD2-CD2 3.82Å; Y143-L178 HydrophobicContact CE1-CD2 3.55Å; Y143-L178 HydrophobicContact CE2-CD2 3.88Å; Y143-L178 HydrophobicContact CG-CD2 3.62Å; Y143-C179 VanDerWaalsContact CE2-SG 3.58Å; Y143-C179 WeakPolarHBondContact OH-CB 3.31Å; Y143-C179 PolarHBondContact OH-N 3.19Å; Y143-C179 PolarHBondContact OH-SG 2.93Å
144	R	94.4	Very high	88	Confident	175 Å²	175	75.8 Å²	75.8	66%	0.66	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.3	127	174	-170.7	175.4	76.9	178.1	2.9	108.8	S146	R144-S146 PolarHBondContact NE-OG 2.96Å
145	I	95.6	Very high	89.6	Confident	0 Å²	0	71 Å²	71	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	115.7	167.6	-59.9	162.6	0	0	0	106.5	I114 Y124 L126 Y143 V153 Y154 I155 L164 L167	I114-I145 HydrophobicContact CD1-CD1 3.93Å; I114-I145 HydrophobicContact CG1-CD1 4.22Å; I114-I145 HydrophobicContact CG2-CD1 4Å; Y124-I145 PolarHBondContact N-O 2.86Å; Y124-I145 VanDerWaalsContact N-O 3.13Å; Y124-I145 PolarHBondContact O-N 3.37Å; L126-I145 HydrophobicContact CB-CD1 3.83Å; L126-I145 HydrophobicContact CB-CG1 4.26Å; Y143-I145 PolarHBondContact O-N 2.97Å; I145-V153 HydrophobicContact CG2-CB 3.88Å; I145-V153 HydrophobicContact CG2-CG1 4.41Å; I145-Y154 WeakPolarHBondContact CA-O 3.39Å; I145-I155 HydrophobicContact CG1-CD1 4.01Å; I145-I155 HydrophobicContact CG1-CG1 3.67Å; I145-L164 HydrophobicContact CD1-CD2 4.06Å; I145-L164 HydrophobicContact CG2-CD2 4.06Å; I145-L167 HydrophobicContact CD1-CD1 4.4Å; I145-L167 HydrophobicContact CD1-CD2 4.37Å; I145-L167 HydrophobicContact CG1-CD1 4.25Å; I145-L167 HydrophobicContact CG2-CD1 3.97Å
146	S	92.8	Very high	91	Very high	19 Å²	19	68.8 Å²	68.8	13%	0.133	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	151.1	176.7	-73	0	0	0	0	110.1	R144 V153 Y154	R144-S146 PolarHBondContact NE-OG 2.96Å; S146-V153 CarbonylContact O-C 3.56Å; S146-V153 WeakPolarHBondContact O-CA 3.43Å; S146-Y154 PolarHBondContact N-O 3.48Å; S146-Y154 WeakPolarHBondContact O-CD1 3.38Å; S146-Y154 PolarHBondContact O-N 2.89Å
147	Q	91.8	Very high	91.9	Very high	75 Å²	75	70.6 Å²	70.6	35%	0.35	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	139.2	176.4	-165.9	171.8	27.9	0	0	110	S151 W152 V153	Q147-S151 PolarHBondContact NE2-O 2.77Å; Q147-S151 VanDerWaalsContact NE2-O 3.13Å; Q147-W152 CarbonylContact C-O 3.47Å; Q147-W152 WeakPolarHBondContact CA-O 3.47Å; Q147-V153 HydrophobicContact CG-CG1 4.28Å
148	L	91.4	Very high	92.6	Very high	69 Å²	69	65.7 Å²	65.7	36%	0.361	35%	0.347	S	S	.	.			trans	-88.7	165.1	174.3	-70.7	162.3	0	0	0	110.5	N150 S151 W152 Y154 T160	L148-N150 WeakPolarHBondContact CB-OD1 3.49Å; L148-N150 PolarHBondContact O-N 3.26Å; L148-S151 WeakPolarHBondContact O-CA 3.16Å; L148-S151 PolarHBondContact O-N 2.66Å; L148-W152 HydrophobicContact CD1-CB 4.13Å; L148-W152 PolarHBondContact N-O 3.4Å; L148-Y154 HydrophobicContact CD1-CD1 4.08Å; L148-Y154 HydrophobicContact CD1-CE1 4.38Å; L148-Y154 HydrophobicContact CD2-CD1 4.43Å; L148-Y154 HydrophobicContact CD2-CE1 3.91Å; L148-Y154 HydrophobicContact CG-CD1 3.88Å; L148-Y154 HydrophobicContact CG-CE1 3.76Å; L148-T160 HydrophobicContact CD1-CG2 3.8Å
149	E	91.1	Very high	93.2	Very high	207 Å²	207	66 Å²	66	97%	0.967	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-31.3	177.9	-63.7	178.9	-179.3	0	0	112.9	S151	E149-S151 PolarHBondContact O-N 3.06Å
150	N	92.1	Very high	93.5	Very high	94 Å²	94	67.1 Å²	67.1	50%	0.503	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	13.4	174.9	70.4	-6	0	0	0	113.5	L148 W152	L148-N150 WeakPolarHBondContact CB-OD1 3.49Å; L148-N150 PolarHBondContact O-N 3.26Å; N150-W152 PolarHBondContact O-N 2.99Å; N150-W152 VanDerWaalsContact OD1-CB 3.25Å; N150-W152 WeakPolarHBondContact OD1-CB 3.45Å; N150-W152 PolarHBondContact OD1-N 3.24Å
151	S	91.1	Very high	93.5	Very high	75 Å²	75	68 Å²	68	52%	0.524	36%	0.358	S	S	.	.	S	Bend	trans	67.2	2.7	-176.4	-54.8	0	0	0	0	116.4	Q147 L148 E149	Q147-S151 PolarHBondContact NE2-O 2.77Å; Q147-S151 VanDerWaalsContact NE2-O 3.13Å; L148-S151 WeakPolarHBondContact O-CA 3.16Å; L148-S151 PolarHBondContact O-N 2.66Å; E149-S151 PolarHBondContact O-N 3.06Å
152	W	94.9	Very high	93.6	Very high	105 Å²	105	67.6 Å²	67.6	40%	0.398	36%	0.363	S	S	.	.			trans	-71.6	150.1	175.1	-71.9	33.6	0	0	0	110.8	Q147 L148 N150 F161 P162	Q147-W152 CarbonylContact C-O 3.47Å; Q147-W152 WeakPolarHBondContact CA-O 3.47Å; L148-W152 HydrophobicContact CD1-CB 4.13Å; L148-W152 PolarHBondContact N-O 3.4Å; N150-W152 PolarHBondContact O-N 2.99Å; N150-W152 VanDerWaalsContact OD1-CB 3.25Å; N150-W152 WeakPolarHBondContact OD1-CB 3.45Å; N150-W152 PolarHBondContact OD1-N 3.24Å; W152-F161 CarbonylContact C-O 3.57Å; W152-F161 VanDerWaalsContact CA-O 3.25Å; W152-F161 WeakPolarHBondContact CA-O 3.42Å; W152-F161 VanDerWaalsContact CB-O 3.31Å; W152-F161 WeakPolarHBondContact CB-O 3.36Å; W152-P162 HydrophobicContact CD2-CB 4.48Å; W152-P162 HydrophobicContact CZ2-CB 4.44Å
153	V	95.6	Very high	93.6	Very high	4 Å²	4	67.5 Å²	67.5	2%	0.024	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	149.2	-176.5	-62.6	0	0	0	0	111.3	I145 S146 Q147 F161 L164 L167	I145-V153 HydrophobicContact CG2-CB 3.88Å; I145-V153 HydrophobicContact CG2-CG1 4.41Å; S146-V153 CarbonylContact O-C 3.56Å; S146-V153 WeakPolarHBondContact O-CA 3.43Å; Q147-V153 HydrophobicContact CG-CG1 4.28Å; V153-F161 HydrophobicContact CG2-CB 4.12Å; V153-F161 PolarHBondContact N-O 3.23Å; V153-F161 PolarHBondContact O-N 2.79Å; V153-L164 HydrophobicContact CG1-CD2 4.42Å; V153-L164 HydrophobicContact CG2-CD2 4.31Å; V153-L167 HydrophobicContact CB-CD1 4.46Å; V153-L167 HydrophobicContact CG2-CB 4.28Å; V153-L167 HydrophobicContact CG2-CD1 3.91Å
154	Y	95.4	Very high	93.6	Very high	48 Å²	48	66 Å²	66	19%	0.188	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	154.8	177.7	69.3	-83.8	0	0	0	112.2	I145 S146 L148 P157 L159 T160	I145-Y154 WeakPolarHBondContact CA-O 3.39Å; S146-Y154 PolarHBondContact N-O 3.48Å; S146-Y154 WeakPolarHBondContact O-CD1 3.38Å; S146-Y154 PolarHBondContact O-N 2.89Å; L148-Y154 HydrophobicContact CD1-CD1 4.08Å; L148-Y154 HydrophobicContact CD1-CE1 4.38Å; L148-Y154 HydrophobicContact CD2-CD1 4.43Å; L148-Y154 HydrophobicContact CD2-CE1 3.91Å; L148-Y154 HydrophobicContact CG-CD1 3.88Å; L148-Y154 HydrophobicContact CG-CE1 3.76Å; Y154-P157 HydrophobicContact CD2-CB 4.48Å; Y154-P157 HydrophobicContact CD2-CG 4.33Å; Y154-P157 HydrophobicContact CE2-CB 4.28Å; Y154-P157 HydrophobicContact CE2-CG 3.92Å; Y154-L159 VanDerWaalsContact CB-O 3.3Å; Y154-L159 WeakPolarHBondContact CB-O 3.48Å; Y154-T160 HydrophobicContact CG-CG2 4.42Å
155	I	95.4	Very high	93.6	Very high	27 Å²	27	61.4 Å²	61.4	14%	0.138	35%	0.348	C	S	.	.	S	Bend	trans	-102.4	-50.6	165.5	-65.9	174.9	0	0	0	108.9	L126 Y143 I145 L167 Y171 L178	L126-I155 HydrophobicContact CB-CD1 4.42Å; L126-I155 HydrophobicContact CD2-CD1 3.62Å; Y143-I155 HydrophobicContact CD1-CG2 4.05Å; Y143-I155 HydrophobicContact CG-CG2 4.45Å; I145-I155 HydrophobicContact CG1-CD1 4.01Å; I145-I155 HydrophobicContact CG1-CG1 3.67Å; I155-L167 HydrophobicContact CD1-CD2 4.31Å; I155-L167 HydrophobicContact CG1-CD1 4.27Å; I155-Y171 HydrophobicContact CB-CE2 4.48Å; I155-Y171 HydrophobicContact CD1-CD2 4.3Å; I155-Y171 HydrophobicContact CD1-CE2 3.76Å; I155-Y171 HydrophobicContact CG1-CE2 4.34Å; I155-L178 HydrophobicContact CD1-CD2 4.03Å; I155-L178 HydrophobicContact CG2-CD2 4.29Å
156	S	91.8	Very high	93.7	Very high	52 Å²	52	67.8 Å²	67.8	36%	0.364	37%	0.373	S	S	.	.	S	Bend	trans	-102.1	128.5	173.3	-69	0	0	0	0	109.7	G158 L159	S156-G158 PolarHBondContact O-N 3.19Å; S156-L159 CarbonylContact O-C 3.59Å; S156-L159 PolarHBondContact O-N 3.49Å; S156-L159 VanDerWaalsContact O-O 3.12Å
157	P	85	Confident	94	Very high	104 Å²	104	66.9 Å²	66.9	68%	0.675	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-25.8	-175	-27.3	33	0	0	0	115.8	Y154 L159	Y154-P157 HydrophobicContact CD2-CB 4.48Å; Y154-P157 HydrophobicContact CD2-CG 4.33Å; Y154-P157 HydrophobicContact CE2-CB 4.28Å; Y154-P157 HydrophobicContact CE2-CG 3.92Å; P157-L159 VanDerWaalsContact C-N 3.27Å; P157-L159 PolarHBondContact O-N 3.32Å
158	G	90.4	Very high	94.2	Very high	79 Å²	79	64 Å²	64	81%	0.814	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-6.6	176.5	0	0	0	0	0	114.8	S156	S156-G158 PolarHBondContact O-N 3.19Å
159	L	94.6	Very high	94.5	Very high	57 Å²	57	65.9 Å²	65.9	30%	0.298	36%	0.361	S	S	.	.			trans	-135.3	98.3	-174.3	-143.5	73.2	0	0	0	110	Y154 S156 P157 F161 H170 D176	Y154-L159 VanDerWaalsContact CB-O 3.3Å; Y154-L159 WeakPolarHBondContact CB-O 3.48Å; S156-L159 CarbonylContact O-C 3.59Å; S156-L159 PolarHBondContact O-N 3.49Å; S156-L159 VanDerWaalsContact O-O 3.12Å; P157-L159 VanDerWaalsContact C-N 3.27Å; P157-L159 PolarHBondContact O-N 3.32Å; L159-F161 HydrophobicContact CD2-CE2 4.47Å; L159-F161 HydrophobicContact CD2-CZ 3.84Å; L159-F161 HydrophobicContact CG-CE2 4.38Å; L159-F161 HydrophobicContact CG-CZ 3.87Å; L159-H170 WeakPolarHBondContact CD2-NE2 3.33Å; L159-D176 HydrophobicContact CD2-CB 4.24Å
160	T	96.5	Very high	94.8	Very high	53 Å²	53	57.9 Å²	57.9	33%	0.325	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	147.3	-173.1	60.8	0	0	0	0	110.6	L148 Y154	L148-T160 HydrophobicContact CD1-CG2 3.8Å; Y154-T160 HydrophobicContact CG-CG2 4.42Å
161	F	97	Very high	95.1	Very high	20 Å²	20	53.4 Å²	53.4	9%	0.088	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	145.3	-174.1	-54.3	-81.1	0	0	0	110.9	W152 V153 L159 S163 L167 H170 Y171	W152-F161 CarbonylContact C-O 3.57Å; W152-F161 VanDerWaalsContact CA-O 3.25Å; W152-F161 WeakPolarHBondContact CA-O 3.42Å; W152-F161 VanDerWaalsContact CB-O 3.31Å; W152-F161 WeakPolarHBondContact CB-O 3.36Å; V153-F161 HydrophobicContact CG2-CB 4.12Å; V153-F161 PolarHBondContact N-O 3.23Å; V153-F161 PolarHBondContact O-N 2.79Å; L159-F161 HydrophobicContact CD2-CE2 4.47Å; L159-F161 HydrophobicContact CD2-CZ 3.84Å; L159-F161 HydrophobicContact CG-CE2 4.38Å; L159-F161 HydrophobicContact CG-CZ 3.87Å; F161-S163 VanDerWaalsContact C-N 3.26Å; F161-S163 PolarHBondContact O-N 2.68Å; F161-L167 HydrophobicContact CB-CB 4.16Å; F161-L167 HydrophobicContact CD2-CB 3.71Å; F161-L167 HydrophobicContact CD2-CD1 4Å; F161-L167 HydrophobicContact CD2-CG 3.87Å; F161-L167 HydrophobicContact CE2-CB 4.29Å; F161-L167 HydrophobicContact CE2-CD1 4.45Å; F161-L167 HydrophobicContact CE2-CG 4.11Å; F161-L167 HydrophobicContact CG-CB 3.93Å; F161-H170 HydrophobicContact CD1-CB 4.4Å; F161-H170 HydrophobicContact CE1-CB 3.49Å; F161-H170 VanDerWaalsContact CE1-CB 3.49Å; F161-H170 AromaticContact CE1-CG 3.59Å; F161-H170 HydrophobicContact CZ-CB 3.83Å; F161-H170 AromaticContact CZ-CD2 3.51Å; F161-H170 AromaticContact CZ-CG 3.6Å; F161-Y171 HydrophobicContact CE2-CE2 4.03Å; F161-Y171 HydrophobicContact CZ-CE2 4.41Å
162	P	96.6	Very high	95.4	Very high	67 Å²	67	51.5 Å²	51.5	44%	0.435	29%	0.287	S	S	.	.	S	Bend	trans	-73.1	-16.2	-179.9	28.2	-34	0	0	0	113.5	W152 Y166	W152-P162 HydrophobicContact CD2-CB 4.48Å; W152-P162 HydrophobicContact CZ2-CB 4.44Å; P162-Y166 HydrophobicContact CG-CD2 3.54Å; P162-Y166 HydrophobicContact CG-CE2 3.95Å; P162-Y166 HydrophobicContact CG-CG 4.01Å
163	S	95.5	Very high	95.5	Very high	39 Å²	39	51.8 Å²	51.8	27%	0.273	29%	0.293	S	S	.	.	S	Bend	trans	-157.2	165.1	174.2	80.1	0	0	0	0	112.3	F161 H165 Y166 L167	F161-S163 VanDerWaalsContact C-N 3.26Å; F161-S163 PolarHBondContact O-N 2.68Å; S163-H165 PolarHBondContact O-N 3.28Å; S163-H165 PolarHBondContact OG-N 2.73Å; S163-Y166 PolarHBondContact O-N 3.26Å; S163-Y166 WeakPolarHBondContact OG-CD2 3.13Å; S163-L167 PolarHBondContact O-N 2.92Å; S163-L167 VanDerWaalsContact O-N 3.14Å
164	L	95.9	Very high	95.5	Very high	17 Å²	17	55.8 Å²	55.8	9%	0.089	31%	0.313	C	S	.	.	H	α-helix	trans	-57	-30.8	173	-68.1	176.1	0	0	0	112.7	W88 L89 I114 Y124 I145 V153 L167 V168	W88-L164 HydrophobicContact CH2-CB 3.65Å; W88-L164 HydrophobicContact CZ3-CB 3.97Å; W88-L164 HydrophobicContact CZ3-CD1 4.24Å; L89-L164 HydrophobicContact CD1-CD1 4.1Å; L89-L164 HydrophobicContact CD2-CD1 4.42Å; I114-L164 HydrophobicContact CD1-CD2 4.34Å; I114-L164 HydrophobicContact CG2-CD1 4.43Å; Y124-L164 HydrophobicContact CD1-CD1 4.07Å; Y124-L164 HydrophobicContact CD2-CD1 4.11Å; Y124-L164 HydrophobicContact CD2-CD2 4.05Å; Y124-L164 HydrophobicContact CD2-CG 4.48Å; Y124-L164 HydrophobicContact CE1-CD1 3.97Å; Y124-L164 HydrophobicContact CE2-CD1 4.01Å; Y124-L164 HydrophobicContact CG-CD1 4.14Å; Y124-L164 HydrophobicContact CG-CD2 4.31Å; I145-L164 HydrophobicContact CD1-CD2 4.06Å; I145-L164 HydrophobicContact CG2-CD2 4.06Å; V153-L164 HydrophobicContact CG1-CD2 4.42Å; V153-L164 HydrophobicContact CG2-CD2 4.31Å; L164-L167 WeakPolarHBondContact O-CB 3.32Å; L164-L167 PolarHBondContact O-N 3.15Å; L164-V168 VanDerWaalsContact O-CG2 3.31Å; L164-V168 WeakPolarHBondContact O-CG2 3.4Å; L164-V168 PolarHBondContact O-N 3.19Å
165	H	96.4	Very high	95.4	Very high	79 Å²	79	55.8 Å²	55.8	37%	0.366	32%	0.319	S	S	.	.	H	α-helix	trans	-65.2	-45.5	178	-76.4	71.5	0	0	0	111.6	D86 W88 S163 L167 V168 Q169	D86-H165 IonicContact OD1-CE1 3.07Å; D86-H165 IonicContact OD1-NE2 3.77Å; D86-H165 IonicContact OD2-CE1 2.73Å; D86-H165 PolarHBondContact OD2-CE1 3.21Å; D86-H165 IonicContact OD2-NE2 3.63Å; W88-H165 AromaticContact CZ2-CE1 3.81Å; W88-H165 AromaticContact CZ2-ND1 3.88Å; W88-H165 AromaticContact CZ2-NE2 3.96Å; S163-H165 PolarHBondContact O-N 3.28Å; S163-H165 PolarHBondContact OG-N 2.73Å; H165-L167 VanDerWaalsContact C-N 3.31Å; H165-L167 PolarHBondContact O-N 3.22Å; H165-V168 PolarHBondContact O-N 2.78Å; H165-Q169 WeakPolarHBondContact O-CB 3.45Å; H165-Q169 PolarHBondContact O-N 3.41Å
166	Y	97.4	Very high	95.3	Very high	134 Å²	134	57.9 Å²	57.9	53%	0.525	33%	0.33	S	S	.	.	H	α-helix	trans	-66.2	-36.4	177	-75.9	-77.3	0	0	0	111.8	P162 S163 Q169 H170	P162-Y166 HydrophobicContact CG-CD2 3.54Å; P162-Y166 HydrophobicContact CG-CE2 3.95Å; P162-Y166 HydrophobicContact CG-CG 4.01Å; S163-Y166 PolarHBondContact O-N 3.26Å; S163-Y166 WeakPolarHBondContact OG-CD2 3.13Å; Y166-Q169 PolarHBondContact O-N 3.02Å; Y166-H170 WeakPolarHBondContact O-CB 3.22Å; Y166-H170 PolarHBondContact O-N 3.02Å
167	L	97.4	Very high	95.3	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-60.5	-49.5	173	-177.5	154.9	0	0	0	111.2	I114 I145 V153 I155 F161 S163 L164 H165 H170 Y171	I114-L167 HydrophobicContact CD1-CD2 4.49Å; I145-L167 HydrophobicContact CD1-CD1 4.4Å; I145-L167 HydrophobicContact CD1-CD2 4.37Å; I145-L167 HydrophobicContact CG1-CD1 4.25Å; I145-L167 HydrophobicContact CG2-CD1 3.97Å; V153-L167 HydrophobicContact CB-CD1 4.46Å; V153-L167 HydrophobicContact CG2-CB 4.28Å; V153-L167 HydrophobicContact CG2-CD1 3.91Å; I155-L167 HydrophobicContact CD1-CD2 4.31Å; I155-L167 HydrophobicContact CG1-CD1 4.27Å; F161-L167 HydrophobicContact CB-CB 4.16Å; F161-L167 HydrophobicContact CD2-CB 3.71Å; F161-L167 HydrophobicContact CD2-CD1 4Å; F161-L167 HydrophobicContact CD2-CG 3.87Å; F161-L167 HydrophobicContact CE2-CB 4.29Å; F161-L167 HydrophobicContact CE2-CD1 4.45Å; F161-L167 HydrophobicContact CE2-CG 4.11Å; F161-L167 HydrophobicContact CG-CB 3.93Å; S163-L167 PolarHBondContact O-N 2.92Å; S163-L167 VanDerWaalsContact O-N 3.14Å; L164-L167 WeakPolarHBondContact O-CB 3.32Å; L164-L167 PolarHBondContact O-N 3.15Å; H165-L167 VanDerWaalsContact C-N 3.31Å; H165-L167 PolarHBondContact O-N 3.22Å; L167-H170 PolarHBondContact O-N 2.94Å; L167-Y171 HydrophobicContact CD2-CD2 3.74Å; L167-Y171 HydrophobicContact CD2-CE2 4.15Å; L167-Y171 HydrophobicContact CG-CD2 3.87Å; L167-Y171 HydrophobicContact CG-CE2 3.94Å; L167-Y171 VanDerWaalsContact O-CD2 3.27Å; L167-Y171 WeakPolarHBondContact O-CD2 3.35Å; L167-Y171 PolarHBondContact O-N 2.89Å
168	V	97.6	Very high	95.8	Very high	13 Å²	13	54.3 Å²	54.3	8%	0.079	32%	0.318	C	S	.	.	H	α-helix	trans	-63	-44.1	178.7	169.3	0	0	0	0	111	W88 F112 I114 L164 H165 H170 Y171 S172 L182	W88-V168 HydrophobicContact CD2-CG2 4.25Å; W88-V168 HydrophobicContact CE3-CG2 4.23Å; W88-V168 HydrophobicContact CH2-CG2 4.31Å; W88-V168 HydrophobicContact CZ2-CG2 4.31Å; W88-V168 HydrophobicContact CZ3-CG2 4.26Å; F112-V168 HydrophobicContact CE2-CG1 3.86Å; F112-V168 HydrophobicContact CE2-CG2 4Å; F112-V168 HydrophobicContact CZ-CG1 3.54Å; I114-V168 HydrophobicContact CD1-CG2 3.58Å; L164-V168 VanDerWaalsContact O-CG2 3.31Å; L164-V168 WeakPolarHBondContact O-CG2 3.4Å; L164-V168 PolarHBondContact O-N 3.19Å; H165-V168 PolarHBondContact O-N 2.78Å; V168-H170 PolarHBondContact O-N 3.02Å; V168-Y171 PolarHBondContact O-N 3.01Å; V168-S172 WeakPolarHBondContact O-CB 3.32Å; V168-S172 PolarHBondContact O-N 2.81Å; V168-S172 PolarHBondContact O-OG 2.84Å; V168-L182 HydrophobicContact CG1-CD1 4.32Å
169	Q	97.4	Very high	95.9	Very high	110 Å²	110	52.8 Å²	52.8	51%	0.514	29%	0.294	S	S	.	.	H	α-helix	trans	-57.7	-51.3	177.9	-179	-179.6	-24.3	0	0	111.2	H165 Y166 Y171 S172 E173	H165-Q169 WeakPolarHBondContact O-CB 3.45Å; H165-Q169 PolarHBondContact O-N 3.41Å; Y166-Q169 PolarHBondContact O-N 3.02Å; Q169-Y171 PolarHBondContact O-N 3.48Å; Q169-S172 WeakPolarHBondContact O-CB 3.31Å; Q169-S172 PolarHBondContact O-N 3.18Å; Q169-E173 PolarHBondContact O-N 3.23Å
170	H	97.6	Very high	95.9	Very high	38 Å²	38	51.2 Å²	51.2	18%	0.176	29%	0.288	C	S	.	.	H	α-helix	trans	-58.7	-50.1	179	171.5	80	0	0	0	111.9	L159 F161 Y166 L167 V168 S172 E173 L174 D176	L159-H170 WeakPolarHBondContact CD2-NE2 3.33Å; F161-H170 HydrophobicContact CD1-CB 4.4Å; F161-H170 HydrophobicContact CE1-CB 3.49Å; F161-H170 VanDerWaalsContact CE1-CB 3.49Å; F161-H170 AromaticContact CE1-CG 3.59Å; F161-H170 HydrophobicContact CZ-CB 3.83Å; F161-H170 AromaticContact CZ-CD2 3.51Å; F161-H170 AromaticContact CZ-CG 3.6Å; Y166-H170 WeakPolarHBondContact O-CB 3.22Å; Y166-H170 PolarHBondContact O-N 3.02Å; L167-H170 PolarHBondContact O-N 2.94Å; V168-H170 PolarHBondContact O-N 3.02Å; H170-S172 PolarHBondContact O-N 3.38Å; H170-E173 PolarHBondContact O-N 3.47Å; H170-L174 PolarHBondContact O-N 3.4Å; H170-D176 IonicContact CE1-OD2 3.9Å; H170-D176 PolarHBondContact CE1-OD2 2.99Å; H170-D176 IonicContact NE2-OD2 3.11Å; H170-D176 PolarHBondContact NE2-OD2 3.49Å; H170-D176 VanDerWaalsContact NE2-OD2 3.07Å
171	Y	97.9	Very high	96	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-72	-10.3	-178.2	-75	-60.9	0	0	0	114.4	I155 F161 L167 V168 Q169 L174 P175 D176 L178 R181 L182	I155-Y171 HydrophobicContact CB-CE2 4.48Å; I155-Y171 HydrophobicContact CD1-CD2 4.3Å; I155-Y171 HydrophobicContact CD1-CE2 3.76Å; I155-Y171 HydrophobicContact CG1-CE2 4.34Å; F161-Y171 HydrophobicContact CE2-CE2 4.03Å; F161-Y171 HydrophobicContact CZ-CE2 4.41Å; L167-Y171 HydrophobicContact CD2-CD2 3.74Å; L167-Y171 HydrophobicContact CD2-CE2 4.15Å; L167-Y171 HydrophobicContact CG-CD2 3.87Å; L167-Y171 HydrophobicContact CG-CE2 3.94Å; L167-Y171 VanDerWaalsContact O-CD2 3.27Å; L167-Y171 WeakPolarHBondContact O-CD2 3.35Å; L167-Y171 PolarHBondContact O-N 2.89Å; V168-Y171 PolarHBondContact O-N 3.01Å; Q169-Y171 PolarHBondContact O-N 3.48Å; Y171-L174 CarbonylContact C-O 3.51Å; Y171-L174 VanDerWaalsContact CA-O 3.24Å; Y171-L174 WeakPolarHBondContact CA-O 3.49Å; Y171-P175 WeakPolarHBondContact CD1-O 3.39Å; Y171-P175 WeakPolarHBondContact CE1-O 3.1Å; Y171-D176 HydrophobicContact CE1-CB 3.95Å; Y171-L178 HydrophobicContact CD1-CD1 3.23Å; Y171-L178 HydrophobicContact CD1-CG 3.59Å; Y171-L178 HydrophobicContact CD2-CD1 4.01Å; Y171-L178 HydrophobicContact CE1-CD1 3.73Å; Y171-L178 HydrophobicContact CE1-CD2 4.33Å; Y171-L178 HydrophobicContact CE1-CG 3.59Å; Y171-L178 HydrophobicContact CE2-CD1 4.42Å; Y171-L178 HydrophobicContact CG-CD1 3.39Å; Y171-L178 HydrophobicContact CG-CG 4.22Å; Y171-R181 WeakPolarHBondContact O-CA 3.49Å; Y171-L182 PolarHBondContact O-N 3.27Å
172	S	97.1	Very high	96	Very high	36 Å²	36	54.2 Å²	54.2	25%	0.252	29%	0.293	S	S	.	.	H	α-helix	trans	-77.8	-31.4	169.2	-56.6	0	0	0	0	111.9	V168 Q169 H170 R181 L182	V168-S172 WeakPolarHBondContact O-CB 3.32Å; V168-S172 PolarHBondContact O-N 2.81Å; V168-S172 PolarHBondContact O-OG 2.84Å; Q169-S172 WeakPolarHBondContact O-CB 3.31Å; Q169-S172 PolarHBondContact O-N 3.18Å; H170-S172 PolarHBondContact O-N 3.38Å; S172-R181 PolarHBondContact O-NE 3.42Å; S172-R181 PolarHBondContact O-NH2 3.06Å; S172-L182 WeakPolarHBondContact CA-O 3.33Å
173	E	96.7	Very high	96	Very high	111 Å²	111	54.9 Å²	54.9	52%	0.519	30%	0.296	S	S	.	.	H	α-helix	trans	-82.6	-46.3	177.9	-66.7	174.8	-165.4	0	0	111.4	Q169 H170 R181	Q169-E173 PolarHBondContact O-N 3.23Å; H170-E173 PolarHBondContact O-N 3.47Å; E173-R181 WeakPolarHBondContact O-CD 3.22Å; E173-R181 VanDerWaalsContact O-CZ 3.28Å; E173-R181 PolarHBondContact O-NE 3.04Å
174	L	95.4	Very high	96.1	Very high	88 Å²	88	56.5 Å²	56.5	46%	0.461	30%	0.304	S	S	.	.			trans	-134.7	142.3	-174.4	-65.3	171.1	0	0	0	111.5	H170 Y171	H170-L174 PolarHBondContact O-N 3.4Å; Y171-L174 CarbonylContact C-O 3.51Å; Y171-L174 VanDerWaalsContact CA-O 3.24Å; Y171-L174 WeakPolarHBondContact CA-O 3.49Å
175	P	93.3	Very high	96.2	Very high	48 Å²	48	58 Å²	58	31%	0.312	31%	0.314	S	S	.	.			trans	-74.9	-32.7	179.2	29.1	-31.5	0	0	0	112.8	Y171 G177 L178 R181	Y171-P175 WeakPolarHBondContact CD1-O 3.39Å; Y171-P175 WeakPolarHBondContact CE1-O 3.1Å; P175-G177 VanDerWaalsContact C-N 3.33Å; P175-G177 PolarHBondContact O-N 3.18Å; P175-G177 VanDerWaalsContact O-N 3.11Å; P175-L178 WeakPolarHBondContact O-CA 3.37Å; P175-L178 WeakPolarHBondContact O-CB 3.16Å; P175-L178 VanDerWaalsContact O-CG 3.26Å; P175-L178 WeakPolarHBondContact O-CG 3.35Å; P175-L178 PolarHBondContact O-N 3.45Å; P175-R181 HydrophobicContact CB-CG 4.15Å; P175-R181 HydrophobicContact CG-CG 4.25Å
176	D	93.4	Very high	96.2	Very high	70 Å²	70	54.4 Å²	54.4	37%	0.374	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	39.2	53.1	174.9	-73.8	8.8	0	0	0	115.5	L159 H170 Y171	L159-D176 HydrophobicContact CD2-CB 4.24Å; H170-D176 IonicContact CE1-OD2 3.9Å; H170-D176 PolarHBondContact CE1-OD2 2.99Å; H170-D176 IonicContact NE2-OD2 3.11Å; H170-D176 PolarHBondContact NE2-OD2 3.49Å; H170-D176 VanDerWaalsContact NE2-OD2 3.07Å; Y171-D176 HydrophobicContact CE1-CB 3.95Å
177	G	91.8	Very high	96.1	Very high	70 Å²	70	51.2 Å²	51.2	72%	0.722	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.4	-10.2	179.7	0	0	0	0	0	114.5	P175	P175-G177 VanDerWaalsContact C-N 3.33Å; P175-G177 PolarHBondContact O-N 3.18Å; P175-G177 VanDerWaalsContact O-N 3.11Å
178	L	95.3	Very high	96	Very high	12 Å²	12	51.7 Å²	51.7	6%	0.063	29%	0.29	C	S	.	.	S	Bend	trans	-70	156.8	161.4	-55	-175.1	0	0	0	109.8	L126 I128 Y143 I155 Y171 P175 C180	L126-L178 HydrophobicContact CD2-CD1 3.91Å; I128-L178 HydrophobicContact CD1-CB 4.38Å; I128-L178 HydrophobicContact CD1-CD1 3.84Å; Y143-L178 HydrophobicContact CD1-CD2 3.49Å; Y143-L178 VanDerWaalsContact CD1-CD2 3.49Å; Y143-L178 HydrophobicContact CD2-CD2 3.82Å; Y143-L178 HydrophobicContact CE1-CD2 3.55Å; Y143-L178 HydrophobicContact CE2-CD2 3.88Å; Y143-L178 HydrophobicContact CG-CD2 3.62Å; I155-L178 HydrophobicContact CD1-CD2 4.03Å; I155-L178 HydrophobicContact CG2-CD2 4.29Å; Y171-L178 HydrophobicContact CD1-CD1 3.23Å; Y171-L178 HydrophobicContact CD1-CG 3.59Å; Y171-L178 HydrophobicContact CD2-CD1 4.01Å; Y171-L178 HydrophobicContact CE1-CD1 3.73Å; Y171-L178 HydrophobicContact CE1-CD2 4.33Å; Y171-L178 HydrophobicContact CE1-CG 3.59Å; Y171-L178 HydrophobicContact CE2-CD1 4.42Å; Y171-L178 HydrophobicContact CG-CD1 3.39Å; Y171-L178 HydrophobicContact CG-CG 4.22Å; P175-L178 WeakPolarHBondContact O-CA 3.37Å; P175-L178 WeakPolarHBondContact O-CB 3.16Å; P175-L178 VanDerWaalsContact O-CG 3.26Å; P175-L178 WeakPolarHBondContact O-CG 3.35Å; P175-L178 PolarHBondContact O-N 3.45Å; L178-C180 PolarHBondContact O-N 3.02Å
179	C	93.7	Very high	95.9	Very high	46 Å²	46	53.9 Å²	53.9	31%	0.311	30%	0.299	S	S	.	.	S	Bend	trans	-73	-21.3	-174.4	52.9	0	0	0	0	112.4	R130 K141 Y143	R130-C179 PolarHBondContact NE-O 2.8Å; R130-C179 PolarHBondContact NH1-SG 3.02Å; R130-C179 PolarHBondContact NH2-O 2.97Å; R130-C179 PolarHBondContact NH2-SG 3.27Å; K141-C179 VanDerWaalsContact CB-SG 3.57Å; K141-C179 HydrophobicContact CG-CB 4.42Å; Y143-C179 VanDerWaalsContact CE2-SG 3.58Å; Y143-C179 WeakPolarHBondContact OH-CB 3.31Å; Y143-C179 PolarHBondContact OH-N 3.19Å; Y143-C179 PolarHBondContact OH-SG 2.93Å
180	C	94.8	Very high	95.3	Very high	24 Å²	24	49.7 Å²	49.7	16%	0.162	29%	0.286	C	S	.	.	S	Bend	trans	-162.2	169.3	167.4	69.4	0	0	0	0	109	R130 L178	R130-C180 PolarHBondContact NH2-SG 3.49Å; L178-C180 PolarHBondContact O-N 3.02Å
181	R	97.1	Very high	94.6	Very high	134 Å²	134	49.8 Å²	49.8	51%	0.506	29%	0.287	S	S	.	.			trans	-66.8	151	173.3	-66	168.8	56	-170.8	2.9	111.2	G110 Y171 S172 E173 P175	G110-R181 WeakPolarHBondContact CA-O 3.2Å; Y171-R181 WeakPolarHBondContact O-CA 3.49Å; S172-R181 PolarHBondContact O-NE 3.42Å; S172-R181 PolarHBondContact O-NH2 3.06Å; E173-R181 WeakPolarHBondContact O-CD 3.22Å; E173-R181 VanDerWaalsContact O-CZ 3.28Å; E173-R181 PolarHBondContact O-NE 3.04Å; P175-R181 HydrophobicContact CB-CG 4.15Å; P175-R181 HydrophobicContact CG-CG 4.25Å
182	L	98.1	Very high	93	Very high	3 Å²	3	55.9 Å²	55.9	2%	0.016	32%	0.32	C	S	.	.			trans	-74.4	129.3	168.9	-53.5	-176.8	0	0	0	108.6	F112 L126 I128 V168 Y171 S172	F112-L182 HydrophobicContact CB-CD2 3.78Å; F112-L182 HydrophobicContact CD1-CB 3.73Å; F112-L182 HydrophobicContact CD1-CD1 4.46Å; F112-L182 HydrophobicContact CD1-CD2 4.1Å; F112-L182 HydrophobicContact CD1-CG 4.3Å; F112-L182 HydrophobicContact CD2-CD1 4.17Å; F112-L182 HydrophobicContact CD2-CD2 4.34Å; F112-L182 HydrophobicContact CE1-CB 3.86Å; F112-L182 HydrophobicContact CE2-CD1 4.22Å; F112-L182 HydrophobicContact CG-CB 4.27Å; F112-L182 HydrophobicContact CG-CD1 4.31Å; F112-L182 HydrophobicContact CG-CD2 3.81Å; F112-L182 HydrophobicContact CG-CG 4.34Å; F112-L182 HydrophobicContact CZ-CB 4.49Å; F112-L182 HydrophobicContact CZ-CD1 4.39Å; L126-L182 HydrophobicContact CD1-CD1 4.45Å; L126-L182 HydrophobicContact CD1-CD2 4.17Å; L126-L182 HydrophobicContact CD2-CD2 4.26Å; I128-L182 HydrophobicContact CD1-CD2 3.6Å; I128-L182 HydrophobicContact CG1-CD2 3.81Å; I128-L182 HydrophobicContact CG2-CD2 4.4Å; V168-L182 HydrophobicContact CG1-CD1 4.32Å; Y171-L182 PolarHBondContact O-N 3.27Å; S172-L182 WeakPolarHBondContact CA-O 3.33Å
183	T	96.7	Very high	91.1	Very high	81 Å²	81	61.6 Å²	61.6	50%	0.497	34%	0.342	S	S	.	.			trans	-109.4	-62	-177.6	54	0	0	0	0	111.1	T109 G110 A111	T109-T183 PolarHBondContact O-OG1 3.33Å; G110-T183 VanDerWaalsContact CA-OG1 3.31Å; G110-T183 WeakPolarHBondContact CA-OG1 3.24Å; G110-T183 PolarHBondContact O-N 3.14Å; G110-T183 PolarHBondContact O-OG1 3.14Å; A111-T183 PolarHBondContact N-OG1 3.38Å
184	V	96.7	Very high	88.7	Confident	72 Å²	72	61.2 Å²	61.2	44%	0.436	35%	0.35	S	S	.	.	S	Bend	trans	-137.2	149.7	-178.1	-65.7	0	0	0	0	110.7	A111 F112	A111-V184 VanDerWaalsContact CA-O 3.27Å; A111-V184 WeakPolarHBondContact CA-O 3.45Å; A111-V184 HydrophobicContact CB-CG2 4.27Å; F112-V184 WeakPolarHBondContact CD1-O 3.41Å; F112-V184 WeakPolarHBondContact CE1-O 3.26Å; F112-V184 PolarHBondContact N-O 2.9Å
185	P	97.4	Very high	86.6	Confident	48 Å²	48	68 Å²	68	31%	0.312	37%	0.369	S	S	.	.	B	Isolated β-bridge	trans	-54.2	155.5	166	-26.3	36.8	0	0	0	111.8	K87 W88 F112 F187	K87-P185 HydrophobicContact CB-CB 4.28Å; K87-P185 HydrophobicContact CB-CG 4.34Å; W88-P185 HydrophobicContact CB-CB 4.04Å; W88-P185 HydrophobicContact CB-CG 4.33Å; F112-P185 CarbonylContact O-C 3.55Å; F112-P185 WeakPolarHBondContact O-CA 3.12Å; P185-F187 PolarHBondContact O-N 3.37Å
186	C	97.3	Very high	84.6	Confident	4 Å²	4	71.4 Å²	71.4	3%	0.027	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-52.9	132.4	172.6	-175.7	0	0	0	0	110.1	Y90 L102 F112 L113 I188	Y90-C186 HydrophobicContact CE2-CB 4.41Å; L102-C186 HydrophobicContact CD2-CB 3.99Å; F112-C186 PolarHBondContact O-N 2.85Å; L113-C186 HydrophobicContact CB-CB 4.07Å; L113-C186 HydrophobicContact CD2-CB 4.02Å; C186-I188 PolarHBondContact O-N 3.26Å
187	F	96.3	Very high	82.7	Confident	68 Å²	68	73.9 Å²	73.9	30%	0.298	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-56.1	133	178.4	177.6	-103.3	0	0	0	111.3	H104 N107 P185 Q189	H104-F187 AromaticContact CE1-CD1 3.68Å; H104-F187 AromaticContact CE1-CE1 3.62Å; H104-F187 AromaticContact ND1-CD1 3.53Å; H104-F187 AromaticContact ND1-CE1 3.96Å; N107-F187 VanDerWaalsContact OD1-CB 3.23Å; N107-F187 WeakPolarHBondContact OD1-CB 3.36Å; N107-F187 PolarHBondContact OD1-N 3.26Å; P185-F187 PolarHBondContact O-N 3.37Å; F187-Q189 HydrophobicContact CE1-CB 3.9Å; F187-Q189 HydrophobicContact CZ-CB 4.2Å
188	I	95.6	Very high	80.9	Confident	10 Å²	10	75.8 Å²	75.8	5%	0.051	41%	0.408	C	S	.	.			trans	-125.1	116.2	172.2	-61.6	167.4	0	0	0	107.3	V30 V32 G50 R52 V84 Y90 C186 L191	V30-I188 HydrophobicContact CG2-CD1 4.23Å; V32-I188 HydrophobicContact CG2-CD1 3.91Å; V32-I188 HydrophobicContact CG2-CG1 4.09Å; V32-I188 HydrophobicContact CG2-CG2 3.7Å; G50-I188 CarbonylContact O-C 3.59Å; G50-I188 WeakPolarHBondContact O-CA 3.37Å; R52-I188 HydrophobicContact CB-CG2 4.09Å; V84-I188 HydrophobicContact CB-CD1 4.42Å; V84-I188 HydrophobicContact CG1-CD1 4.11Å; V84-I188 HydrophobicContact CG2-CD1 4.38Å; Y90-I188 WeakPolarHBondContact OH-CG1 3.22Å; C186-I188 PolarHBondContact O-N 3.26Å; I188-L191 HydrophobicContact CB-CB 4.07Å; I188-L191 HydrophobicContact CB-CD1 4.19Å; I188-L191 HydrophobicContact CD1-CD1 3.99Å; I188-L191 HydrophobicContact CG2-CB 4.08Å; I188-L191 HydrophobicContact CG2-CD1 4.02Å; I188-L191 WeakPolarHBondContact O-CB 3.39Å; I188-L191 PolarHBondContact O-N 3.03Å
189	Q	93.6	Very high	78.8	Confident	59 Å²	59	81 Å²	81	28%	0.276	44%	0.441	S	S	.	.	B	Isolated β-bridge	trans	-66	136.5	178.4	-179.9	176.4	13.2	0	0	110.3	G50 E51 R52 F187 L191	G50-Q189 PolarHBondContact O-N 3.06Å; E51-Q189 CarbonylContact C-O 3.54Å; E51-Q189 HydrophobicContact CB-CB 4.04Å; E51-Q189 HydrophobicContact CB-CG 4.4Å; R52-Q189 WeakPolarHBondContact CB-O 3.27Å; R52-Q189 PolarHBondContact N-O 3.42Å; F187-Q189 HydrophobicContact CE1-CB 3.9Å; F187-Q189 HydrophobicContact CZ-CB 4.2Å; Q189-L191 VanDerWaalsContact C-N 3.33Å; Q189-L191 PolarHBondContact O-N 3.44Å
190	G	85.7	Confident	77.1	Confident	22 Å²	22	84.8 Å²	84.8	23%	0.227	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.2	5.2	-178.3	0	0	0	0	0	115.4
191	L	82.3	Confident	75.5	Confident	39 Å²	39	88.6 Å²	88.6	20%	0.204	49%	0.485	C	S	.	.	S	Bend	trans	-88	-31.9	174.4	-155.9	125	0	0	0	113.2	V30 K87 I188 Q189	V30-L191 HydrophobicContact CB-CD1 4.24Å; V30-L191 HydrophobicContact CG1-CD1 3.84Å; V30-L191 HydrophobicContact CG2-CD1 3.74Å; K87-L191 HydrophobicContact CD-CD2 3.9Å; K87-L191 HydrophobicContact CG-CD2 4.24Å; I188-L191 HydrophobicContact CB-CB 4.07Å; I188-L191 HydrophobicContact CB-CD1 4.19Å; I188-L191 HydrophobicContact CD1-CD1 3.99Å; I188-L191 HydrophobicContact CG2-CB 4.08Å; I188-L191 HydrophobicContact CG2-CD1 4.02Å; I188-L191 WeakPolarHBondContact O-CB 3.39Å; I188-L191 PolarHBondContact O-N 3.03Å; Q189-L191 VanDerWaalsContact C-N 3.33Å; Q189-L191 PolarHBondContact O-N 3.44Å
192	D	65.4	Low	73.8	Confident	129 Å²	129	93.4 Å²	93.4	69%	0.69	50%	0.503	S	S	*	.	S	Bend	trans	-103.9	9.1	-177.7	-83.4	-17.2	0	0	0	113.9	P194	D192-P194 WeakPolarHBondContact O-CD 3.42Å
193	E	56.7	Low	71.9	Confident	156 Å²	156	101.6 Å²	101.6	73%	0.729	53%	0.534	S	S	*	.			trans	-60.4	111	171.5	-87.8	-78	135.4	0	0	108.6	R195	E193-R195 PolarHBondContact O-N 3.12Å
194	P	45.7	Very low	70.4	Confident	103 Å²	103	102.3 Å²	102.3	67%	0.669	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-62.1	120.5	175.6	25.5	-29.7	0	0	0	106.2	D192 P196	D192-P194 WeakPolarHBondContact O-CD 3.42Å; P194-P196 WeakPolarHBondContact O-CD 3.36Å
195	R	51.5	Low	68.9	Low	230 Å²	230	105.8 Å²	105.8	87%	0.868	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-46.9	124.2	165.4	-67.5	-176.9	-176.5	-143.4	2.1	105.8	E193 V197	E193-R195 PolarHBondContact O-N 3.12Å; R195-V197 PolarHBondContact O-N 3.45Å
196	P	51.4	Low	67.4	Low	120 Å²	120	105.9 Å²	105.9	78%	0.779	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-53.5	117.5	176.5	18.8	-29.1	0	0	0	105.9	P194 P198	P194-P196 WeakPolarHBondContact O-CD 3.36Å; P196-P198 VanDerWaalsContact O-N 3.08Å
197	V	53.4	Low	66.3	Low	121 Å²	121	109.3 Å²	109.3	73%	0.733	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-51.6	124.6	176.8	-167.9	0	0	0	0	104.3	R195 T199	R195-V197 PolarHBondContact O-N 3.45Å; V197-T199 VanDerWaalsContact C-N 3.29Å; V197-T199 PolarHBondContact O-N 3.22Å
198	P	54.6	Low	65	Low	111 Å²	111	113.9 Å²	113.9	72%	0.721	59%	0.592	S	S	*	*			trans	-54.9	104.8	-178.9	19.2	-29.5	0	0	0	106.1	P196 T200	P196-P198 VanDerWaalsContact O-N 3.08Å; P198-T200 PolarHBondContact O-N 2.82Å
199	T	51.9	Low	63.7	Low	121 Å²	121	124.8 Å²	124.8	74%	0.742	63%	0.633	S	S	*	*			trans	-64.1	111.9	176.8	-65.2	0	0	0	0	102.2	V197 V201	V197-T199 VanDerWaalsContact C-N 3.29Å; V197-T199 PolarHBondContact O-N 3.22Å; T199-V201 HydrophobicContact CG2-CG2 4.3Å; T199-V201 PolarHBondContact O-N 3.33Å
200	T	57.4	Low	62.4	Low	126 Å²	126	129.2 Å²	129.2	77%	0.773	65%	0.654	S	S	*	*			trans	-65.6	86.3	172.2	-63.7	0	0	0	0	105.1	P198 R202	P198-T200 PolarHBondContact O-N 2.82Å; T200-R202 VanDerWaalsContact C-N 3.34Å; T200-R202 PolarHBondContact O-N 3.18Å
201	V	60.7	Low	61.5	Low	104 Å²	104	129.5 Å²	129.5	63%	0.63	65%	0.65	S	S	*	*			trans	-65.1	106.3	167.5	-178.2	0	0	0	0	103.2	T199 R203	T199-V201 HydrophobicContact CG2-CG2 4.3Å; T199-V201 PolarHBondContact O-N 3.33Å; V201-R203 PolarHBondContact O-N 2.83Å
202	R	61.6	Low	60.7	Low	234 Å²	234	131 Å²	131	88%	0.883	66%	0.663	S	S	*	*			trans	-60.3	92.2	163.7	-81.4	-174	162.2	-171.2	-3.9	105.8	T200 P204	T200-R202 VanDerWaalsContact C-N 3.34Å; T200-R202 PolarHBondContact O-N 3.18Å; R202-P204 WeakPolarHBondContact O-CD 3.49Å
203	R	58.3	Low	60.6	Low	175 Å²	175	135 Å²	135	66%	0.66	67%	0.669	S	S	*	*			trans	-58.6	125.7	170.5	-70.6	-173.3	179.3	179.4	0.4	105.9	V201 T205	V201-R203 PolarHBondContact O-N 2.83Å; R203-T205 PolarHBondContact O-N 3.12Å
204	P	64.6	Low	60.8	Low	97 Å²	97	131.6 Å²	131.6	63%	0.63	66%	0.662	S	S	*	*			trans	-53	143.2	177.1	12.9	-21.6	0	0	0	109.4	R202 I206	R202-P204 WeakPolarHBondContact O-CD 3.49Å; P204-I206 PolarHBondContact O-N 2.99Å
205	T	64.8	Low	61.7	Low	144 Å²	144	129.6 Å²	129.6	88%	0.883	65%	0.648	S	S	*	*			trans	-56.1	110.8	-179.1	-46	0	0	0	0	108.5	R203 N207	R203-T205 PolarHBondContact O-N 3.12Å; T205-N207 PolarHBondContact O-N 3.37Å
206	I	67	Low	62.2	Low	50 Å²	50	120.3 Å²	120.3	26%	0.256	62%	0.615	S	S	.	*			trans	-64.3	111	-176.4	-70.6	177.3	0	0	0	108.2	P204 W208 I211	P204-I206 PolarHBondContact O-N 2.99Å; I206-W208 HydrophobicContact CB-CZ2 4.47Å; I206-W208 HydrophobicContact CG2-CD2 3.81Å; I206-W208 HydrophobicContact CG2-CE3 4.15Å; I206-W208 HydrophobicContact CG2-CG 4.3Å; I206-W208 HydrophobicContact CG2-CH2 4.23Å; I206-W208 HydrophobicContact CG2-CZ2 3.89Å; I206-W208 HydrophobicContact CG2-CZ3 4.35Å; I206-W208 PolarHBondContact O-N 2.53Å; I206-I211 HydrophobicContact CG2-CD1 3.15Å; I206-I211 HydrophobicContact CG2-CG1 4.39Å
207	N	74.1	Confident	62.8	Low	77 Å²	77	119.2 Å²	119.2	41%	0.412	60%	0.602	S	S	.	*			trans	-83.5	93.7	173.8	-170.1	-19.9	0	0	0	109.4	T205 R209 E210	T205-N207 PolarHBondContact O-N 3.37Å; N207-R209 PolarHBondContact O-N 3.11Å; N207-R209 WeakPolarHBondContact OD1-CB 3.5Å; N207-R209 PolarHBondContact OD1-N 2.78Å; N207-E210 PolarHBondContact O-N 2.99Å
208	W	68.6	Low	63	Low	163 Å²	163	114.8 Å²	114.8	62%	0.617	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	-15.8	-177.3	-61.8	99.5	0	0	0	114.8	I206 I211	I206-W208 HydrophobicContact CB-CZ2 4.47Å; I206-W208 HydrophobicContact CG2-CD2 3.81Å; I206-W208 HydrophobicContact CG2-CE3 4.15Å; I206-W208 HydrophobicContact CG2-CG 4.3Å; I206-W208 HydrophobicContact CG2-CH2 4.23Å; I206-W208 HydrophobicContact CG2-CZ2 3.89Å; I206-W208 HydrophobicContact CG2-CZ3 4.35Å; I206-W208 PolarHBondContact O-N 2.53Å; W208-I211 HydrophobicContact CD2-CD1 4.28Å; W208-I211 HydrophobicContact CE3-CD1 3.8Å; W208-I211 HydrophobicContact CZ3-CD1 4.23Å
209	R	69.4	Low	63.1	Low	240 Å²	240	120.8 Å²	120.8	91%	0.906	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-23.7	177.5	-65.1	-176	164.6	-139.4	-3.4	113.3	N207	N207-R209 PolarHBondContact O-N 3.11Å; N207-R209 WeakPolarHBondContact OD1-CB 3.5Å; N207-R209 PolarHBondContact OD1-N 2.78Å
210	E	66.2	Low	62.9	Low	152 Å²	152	123.3 Å²	123.3	71%	0.71	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	-10.5	-176.1	-67.8	178.1	179.6	0	0	112.5	N207 S212	N207-E210 PolarHBondContact O-N 2.99Å; E210-S212 PolarHBondContact O-N 3.34Å
211	I	67	Low	62.7	Low	28 Å²	28	129.2 Å²	129.2	14%	0.144	60%	0.598	C	S	.	*			trans	-76.4	111.5	178.5	-60.6	164.5	0	0	0	109.6	I206 W208 V215 I216	I206-I211 HydrophobicContact CG2-CD1 3.15Å; I206-I211 HydrophobicContact CG2-CG1 4.39Å; W208-I211 HydrophobicContact CD2-CD1 4.28Å; W208-I211 HydrophobicContact CE3-CD1 3.8Å; W208-I211 HydrophobicContact CZ3-CD1 4.23Å; I211-V215 HydrophobicContact CG2-CB 4.35Å; I211-I216 HydrophobicContact CG2-CD1 3.79Å; I211-I216 HydrophobicContact CG2-CG1 3.83Å
212	S	65.4	Low	61.9	Low	70 Å²	70	128.6 Å²	128.6	49%	0.49	60%	0.595	S	S	.	*			trans	-69.3	141.2	174.2	-68.4	0	0	0	0	111.4	E210 S214 V215	E210-S212 PolarHBondContact O-N 3.34Å; S212-S214 WeakPolarHBondContact CB-OG 3.4Å; S212-S214 PolarHBondContact O-N 2.88Å; S212-V215 WeakPolarHBondContact O-CB 3.4Å; S212-V215 PolarHBondContact O-N 2.99Å
213	R	63.3	Low	61.3	Low	213 Å²	213	127.5 Å²	127.5	80%	0.804	60%	0.6	S	S	*	*	H	α-helix	trans	-52.5	-29.7	176.1	-77	-177.6	169.4	173.9	-4.6	113.3	V215 I216 L217	R213-V215 VanDerWaalsContact C-N 3.28Å; R213-V215 PolarHBondContact O-N 2.73Å; R213-I216 PolarHBondContact O-N 3.33Å; R213-L217 WeakPolarHBondContact O-CB 3.33Å; R213-L217 PolarHBondContact O-N 2.98Å
214	S	60.5	Low	60.9	Low	84 Å²	84	123.2 Å²	123.2	59%	0.587	60%	0.596	S	S	*	*	H	α-helix	trans	-65.8	-22.8	176.2	49.3	0	0	0	0	114.4	S212 G218	S212-S214 WeakPolarHBondContact CB-OG 3.4Å; S212-S214 PolarHBondContact O-N 2.88Å; S214-G218 WeakPolarHBondContact O-CA 3.35Å; S214-G218 PolarHBondContact O-N 2.96Å
215	V	63.3	Low	60.4	Low	61 Å²	61	126.4 Å²	126.4	37%	0.37	61%	0.608	S	S	.	*	H	α-helix	trans	-80.4	-32.1	176.3	-179.1	0	0	0	0	111.2	I211 S212 R213	I211-V215 HydrophobicContact CG2-CB 4.35Å; S212-V215 WeakPolarHBondContact O-CB 3.4Å; S212-V215 PolarHBondContact O-N 2.99Å; R213-V215 VanDerWaalsContact C-N 3.28Å; R213-V215 PolarHBondContact O-N 2.73Å
216	I	63	Low	59.9	Low	35 Å²	35	126.7 Å²	126.7	18%	0.179	60%	0.604	C	S	.	*	H	α-helix	trans	-81.3	-41.6	-179.7	-61.6	170.6	0	0	0	110.6	I211 R213 I237	I211-I216 HydrophobicContact CG2-CD1 3.79Å; I211-I216 HydrophobicContact CG2-CG1 3.83Å; R213-I216 PolarHBondContact O-N 3.33Å; I216-I237 HydrophobicContact CG2-CD1 4.05Å; I216-I237 HydrophobicContact CG2-CG2 3.94Å
217	L	63.6	Low	59.7	Low	97 Å²	97	128.4 Å²	128.4	51%	0.508	62%	0.62	S	S	.	*	H	α-helix	trans	-101.8	-7.3	-174.7	-65	165.5	0	0	0	113.5	R213 R219 L241	R213-L217 WeakPolarHBondContact O-CB 3.33Å; R213-L217 PolarHBondContact O-N 2.98Å; L217-R219 PolarHBondContact O-N 3.17Å; L217-L241 HydrophobicContact CD2-CD1 3.76Å
218	G	58	Low	59.3	Low	28 Å²	28	129.6 Å²	129.6	29%	0.289	63%	0.626	S	S	.	*			trans	-65.9	116.3	-175.6	0	0	0	0	0	112.2	S214 K220 R234	S214-G218 WeakPolarHBondContact O-CA 3.35Å; S214-G218 PolarHBondContact O-N 2.96Å; G218-K220 PolarHBondContact O-N 3.07Å; G218-K220 VanDerWaalsContact O-N 3.1Å; G218-R234 VanDerWaalsContact O-CZ 3.23Å; G218-R234 PolarHBondContact O-NH2 2.83Å
219	R	55.9	Low	59.4	Low	237 Å²	237	122.1 Å²	122.1	89%	0.894	60%	0.598	S	S	*	*			trans	-77.5	18.8	176.8	-150.3	-179.7	-176.5	-178.2	1.6	114.2	L217 R221	L217-R219 PolarHBondContact O-N 3.17Å; R219-R221 PolarHBondContact O-N 3.11Å
220	K	49.1	Very low	59.7	Low	175 Å²	175	112.8 Å²	112.8	76%	0.761	57%	0.57	S	S	*	*			trans	-92.2	106.9	-170.3	-139.4	176.7	-176	-178.4	0	110.9	G218 T222	G218-K220 PolarHBondContact O-N 3.07Å; G218-K220 VanDerWaalsContact O-N 3.1Å; K220-T222 HydrophobicContact CD-CG2 4.46Å; K220-T222 HydrophobicContact CG-CG2 4.38Å; K220-T222 PolarHBondContact O-N 2.86Å
221	R	51.9	Low	60.3	Low	249 Å²	249	111.1 Å²	111.1	94%	0.94	57%	0.566	S	S	*	*			trans	-64.8	111	159.9	-73.5	-179.4	173.8	170.5	-2.6	107.5	R219	R219-R221 PolarHBondContact O-N 3.11Å
222	T	44.8	Very low	60.9	Low	92 Å²	92	112.5 Å²	112.5	56%	0.564	59%	0.587	S	S	*	*			trans	-132.2	127.2	161.3	48.6	0	0	0	0	107.8	K220 S224	K220-T222 HydrophobicContact CD-CG2 4.46Å; K220-T222 HydrophobicContact CG-CG2 4.38Å; K220-T222 PolarHBondContact O-N 2.86Å; T222-S224 PolarHBondContact O-N 2.89Å
223	E	49.4	Very low	61.7	Low	211 Å²	211	112.3 Å²	112.3	99%	0.986	58%	0.58	S	S	*	*			trans	-63.4	24	-178.5	-72.8	174.3	133.7	0	0	115
224	S	48.7	Very low	62.6	Low	84 Å²	84	104.9 Å²	104.9	59%	0.587	55%	0.552	S	S	*	*			trans	-103.4	112	175.5	70.8	0	0	0	0	110.1	T222 N226	T222-S224 PolarHBondContact O-N 2.89Å; S224-N226 PolarHBondContact O-N 3.48Å
225	D	54.2	Low	63.5	Low	164 Å²	164	106.9 Å²	106.9	88%	0.877	55%	0.552	S	S	*	*	S	Bend	trans	-70.6	50.3	-166.4	-148.2	10	0	0	0	115.4
226	N	55	Low	64.4	Low	151 Å²	151	106.7 Å²	106.7	81%	0.807	56%	0.557	S	S	*	*			trans	-136.3	36.9	-179.8	-81	-33.8	0	0	0	113.2	S224 L228	S224-N226 PolarHBondContact O-N 3.48Å; N226-L228 PolarHBondContact O-N 2.78Å
227	S	63.5	Low	65.2	Low	85 Å²	85	107.2 Å²	107.2	59%	0.594	56%	0.56	S	S	*	*			trans	-72	119.5	170.3	-176.7	0	0	0	0	110.3	V229	S227-V229 PolarHBondContact O-N 3.37Å; S227-V229 PolarHBondContact OG-N 3.3Å; S227-V229 PolarHBondContact OG-O 2.84Å
228	L	65	Low	65.9	Low	102 Å²	102	104.2 Å²	104.2	53%	0.534	55%	0.547	S	S	.	.	S	Bend	trans	-67.1	-14.7	175.6	-66.4	173.2	0	0	0	113	N226	N226-L228 PolarHBondContact O-N 2.78Å
229	V	70.1	Confident	67	Low	6 Å²	6	105.8 Å²	105.8	4%	0.036	55%	0.553	C	S	.	*	S	Bend	trans	-119.2	125.3	-175.9	-177.8	0	0	0	0	108.8	S227 L233 R234	S227-V229 PolarHBondContact O-N 3.37Å; S227-V229 PolarHBondContact OG-N 3.3Å; S227-V229 PolarHBondContact OG-O 2.84Å; V229-L233 HydrophobicContact CG1-CB 4.16Å; V229-L233 HydrophobicContact CG1-CD2 3.98Å; V229-L233 HydrophobicContact CG1-CG 4.04Å; V229-R234 HydrophobicContact CG1-CB 4.2Å
230	S	76.8	Confident	68.3	Low	44 Å²	44	101.9 Å²	101.9	31%	0.308	54%	0.54	S	S	.	.			trans	-72.6	149	175.4	55.1	0	0	0	0	111.7	G232 L233 R234	S230-G232 VanDerWaalsContact C-N 3.3Å; S230-G232 PolarHBondContact O-N 3.25Å; S230-L233 WeakPolarHBondContact O-CB 3.25Å; S230-L233 PolarHBondContact O-N 2.8Å; S230-R234 PolarHBondContact O-N 3.44Å
231	D	78.2	Confident	69.7	Low	117 Å²	117	96 Å²	96	63%	0.626	52%	0.516	S	S	*	.	H	α-helix	trans	-54.2	-42.3	180	-67.3	-36.5	0	0	0	113.2	L233 R234 E235	D231-L233 VanDerWaalsContact C-N 3.31Å; D231-L233 PolarHBondContact O-N 2.89Å; D231-R234 WeakPolarHBondContact O-CB 3.45Å; D231-R234 PolarHBondContact O-N 3.4Å; D231-R234 VanDerWaalsContact O-N 3.12Å; D231-E235 WeakPolarHBondContact O-CG 3.31Å; D231-E235 PolarHBondContact O-N 3.49Å
232	G	80.3	Confident	71	Confident	57 Å²	57	91.2 Å²	91.2	59%	0.588	51%	0.505	S	S	*	.	H	α-helix	trans	-62.2	-34.9	177.5	0	0	0	0	0	114.1	S230 A236	S230-G232 VanDerWaalsContact C-N 3.3Å; S230-G232 PolarHBondContact O-N 3.25Å; G232-A236 WeakPolarHBondContact O-CB 3.48Å; G232-A236 PolarHBondContact O-N 3.13Å; G232-A236 VanDerWaalsContact O-N 3.12Å
233	L	81.8	Confident	72.5	Confident	66 Å²	66	93.2 Å²	93.2	35%	0.346	51%	0.511	S	S	.	.	H	α-helix	trans	-71.7	-38.8	175	176.7	58.3	0	0	0	110.6	V229 S230 D231 A236 I237	V229-L233 HydrophobicContact CG1-CB 4.16Å; V229-L233 HydrophobicContact CG1-CD2 3.98Å; V229-L233 HydrophobicContact CG1-CG 4.04Å; S230-L233 WeakPolarHBondContact O-CB 3.25Å; S230-L233 PolarHBondContact O-N 2.8Å; D231-L233 VanDerWaalsContact C-N 3.31Å; D231-L233 PolarHBondContact O-N 2.89Å; L233-A236 PolarHBondContact O-N 3.43Å; L233-I237 HydrophobicContact CD1-CD1 3.9Å; L233-I237 HydrophobicContact CD1-CG1 4.17Å; L233-I237 HydrophobicContact CG-CD1 3.88Å; L233-I237 VanDerWaalsContact O-CG1 3.25Å; L233-I237 WeakPolarHBondContact O-CG1 3.34Å; L233-I237 PolarHBondContact O-N 3.48Å
234	R	81.3	Confident	73.7	Confident	58 Å²	58	86.3 Å²	86.3	22%	0.219	48%	0.484	C	S	.	.	H	α-helix	trans	-66.4	-41.7	178.3	-176.7	169.7	166.1	-133.2	-16.8	112.5	G218 V229 S230 D231 I237 S238	G218-R234 VanDerWaalsContact O-CZ 3.23Å; G218-R234 PolarHBondContact O-NH2 2.83Å; V229-R234 HydrophobicContact CG1-CB 4.2Å; S230-R234 PolarHBondContact O-N 3.44Å; D231-R234 WeakPolarHBondContact O-CB 3.45Å; D231-R234 PolarHBondContact O-N 3.4Å; D231-R234 VanDerWaalsContact O-N 3.12Å; R234-I237 PolarHBondContact O-N 3.4Å; R234-S238 WeakPolarHBondContact O-CB 3.25Å; R234-S238 PolarHBondContact O-N 2.92Å; R234-S238 PolarHBondContact O-OG 2.79Å
235	E	79.2	Confident	74.4	Confident	126 Å²	126	89.4 Å²	89.4	59%	0.589	49%	0.489	S	S	*	.	H	α-helix	trans	-64.1	-43.2	173.8	-71.8	-57.1	139.9	0	0	111.2	D231 I237 S238 S239	D231-E235 WeakPolarHBondContact O-CG 3.31Å; D231-E235 PolarHBondContact O-N 3.49Å; E235-I237 PolarHBondContact O-N 3.07Å; E235-S238 PolarHBondContact O-N 2.95Å; E235-S239 WeakPolarHBondContact O-CB 3.38Å; E235-S239 PolarHBondContact O-N 2.94Å
236	A	82	Confident	74.4	Confident	57 Å²	57	86.5 Å²	86.5	47%	0.471	48%	0.48	S	S	.	.	H	α-helix	trans	-62	-44	176.7	0	0	0	0	0	112.7	G232 L233 Y240	G232-A236 WeakPolarHBondContact O-CB 3.48Å; G232-A236 PolarHBondContact O-N 3.13Å; G232-A236 VanDerWaalsContact O-N 3.12Å; L233-A236 PolarHBondContact O-N 3.43Å; A236-Y240 WeakPolarHBondContact O-CB 3.2Å; A236-Y240 PolarHBondContact O-N 2.85Å
237	I	81.3	Confident	74.3	Confident	45 Å²	45	88 Å²	88	23%	0.231	48%	0.48	C	S	.	.	H	α-helix	trans	-64.8	-44.1	176.4	-68.3	166.1	0	0	0	110.6	I216 L233 R234 E235 S239 Y240 L241	I216-I237 HydrophobicContact CG2-CD1 4.05Å; I216-I237 HydrophobicContact CG2-CG2 3.94Å; L233-I237 HydrophobicContact CD1-CD1 3.9Å; L233-I237 HydrophobicContact CD1-CG1 4.17Å; L233-I237 HydrophobicContact CG-CD1 3.88Å; L233-I237 VanDerWaalsContact O-CG1 3.25Å; L233-I237 WeakPolarHBondContact O-CG1 3.34Å; L233-I237 PolarHBondContact O-N 3.48Å; R234-I237 PolarHBondContact O-N 3.4Å; E235-I237 PolarHBondContact O-N 3.07Å; I237-S239 VanDerWaalsContact C-N 3.34Å; I237-S239 PolarHBondContact O-N 2.8Å; I237-Y240 PolarHBondContact O-N 3.22Å; I237-L241 HydrophobicContact CG2-CD1 3.93Å; I237-L241 HydrophobicContact CG2-CG 4.43Å; I237-L241 WeakPolarHBondContact O-CG 3.08Å; I237-L241 PolarHBondContact O-N 3.13Å
238	S	77.9	Confident	73.8	Confident	34 Å²	34	91.5 Å²	91.5	24%	0.238	49%	0.492	C	S	.	.	H	α-helix	trans	-62.6	-42.3	179.9	-58.9	0	0	0	0	111.5	R234 E235 L241 Q242	R234-S238 WeakPolarHBondContact O-CB 3.25Å; R234-S238 PolarHBondContact O-N 2.92Å; R234-S238 PolarHBondContact O-OG 2.79Å; E235-S238 PolarHBondContact O-N 2.95Å; S238-L241 PolarHBondContact O-N 3.27Å; S238-Q242 WeakPolarHBondContact O-CG 3.37Å; S238-Q242 PolarHBondContact O-N 3.13Å; S238-Q242 VanDerWaalsContact O-N 3.08Å
239	S	80.9	Confident	73	Confident	61 Å²	61	96.6 Å²	96.6	43%	0.427	51%	0.505	S	S	.	.	H	α-helix	trans	-63.1	-43.7	175.2	-179.5	0	0	0	0	111.9	E235 I237 L241 Q242 L243	E235-S239 WeakPolarHBondContact O-CB 3.38Å; E235-S239 PolarHBondContact O-N 2.94Å; I237-S239 VanDerWaalsContact C-N 3.34Å; I237-S239 PolarHBondContact O-N 2.8Å; S239-L241 PolarHBondContact O-N 3.19Å; S239-Q242 PolarHBondContact O-N 2.93Å; S239-L243 VanDerWaalsContact O-CG 3.31Å; S239-L243 WeakPolarHBondContact O-CG 3.1Å; S239-L243 PolarHBondContact O-N 2.98Å; S239-L243 VanDerWaalsContact O-N 3.08Å
240	Y	82.3	Confident	71.5	Confident	156 Å²	156	101.4 Å²	101.4	61%	0.612	54%	0.539	S	S	*	.	H	α-helix	trans	-62.9	-42.4	177.7	-179.4	-97.6	0	0	0	112.6	A236 I237 L243 T244	A236-Y240 WeakPolarHBondContact O-CB 3.2Å; A236-Y240 PolarHBondContact O-N 2.85Å; I237-Y240 PolarHBondContact O-N 3.22Å; Y240-L243 PolarHBondContact O-N 3.05Å; Y240-T244 HydrophobicContact CD1-CG2 4.38Å; Y240-T244 HydrophobicContact CD2-CG2 4.38Å; Y240-T244 HydrophobicContact CE1-CG2 3.97Å; Y240-T244 HydrophobicContact CE2-CG2 3.96Å; Y240-T244 WeakPolarHBondContact O-CB 3.22Å; Y240-T244 WeakPolarHBondContact O-CG2 3.41Å; Y240-T244 PolarHBondContact O-N 3.33Å; Y240-T244 VanDerWaalsContact O-N 3.08Å; Y240-T244 PolarHBondContact O-OG1 3.46Å
241	L	80.4	Confident	70.3	Confident	51 Å²	51	111.1 Å²	111.1	27%	0.267	57%	0.569	S	S	.	*	H	α-helix	trans	-65.2	-43.7	177.8	-70.7	170.7	0	0	0	111.7	L217 I237 S238 S239 L243 T244 E245	L217-L241 HydrophobicContact CD2-CD1 3.76Å; I237-L241 HydrophobicContact CG2-CD1 3.93Å; I237-L241 HydrophobicContact CG2-CG 4.43Å; I237-L241 WeakPolarHBondContact O-CG 3.08Å; I237-L241 PolarHBondContact O-N 3.13Å; S238-L241 PolarHBondContact O-N 3.27Å; S239-L241 PolarHBondContact O-N 3.19Å; L241-L243 PolarHBondContact O-N 2.9Å; L241-T244 WeakPolarHBondContact CA-OG1 3.41Å; L241-T244 PolarHBondContact O-N 3.21Å; L241-T244 PolarHBondContact O-OG1 2.9Å; L241-E245 WeakPolarHBondContact O-CB 3.11Å; L241-E245 WeakPolarHBondContact O-CG 3.3Å; L241-E245 PolarHBondContact O-N 3.21Å
242	Q	78.2	Confident	68.6	Low	148 Å²	148	112.3 Å²	112.3	69%	0.692	58%	0.576	S	S	*	*	H	α-helix	trans	-59.3	-36.5	174.5	-75.2	175.6	-6.4	0	0	112.9	S238 S239 T244	S238-Q242 WeakPolarHBondContact O-CG 3.37Å; S238-Q242 PolarHBondContact O-N 3.13Å; S238-Q242 VanDerWaalsContact O-N 3.08Å; S239-Q242 PolarHBondContact O-N 2.93Å; Q242-T244 VanDerWaalsContact C-N 3.32Å
243	L	75.3	Confident	66.8	Low	134 Å²	134	120 Å²	120	70%	0.702	61%	0.612	S	S	*	*	H	α-helix	trans	-74.1	-22.4	177.5	-72.7	166.8	0	0	0	113.2	S239 Y240 L241	S239-L243 VanDerWaalsContact O-CG 3.31Å; S239-L243 WeakPolarHBondContact O-CG 3.1Å; S239-L243 PolarHBondContact O-N 2.98Å; S239-L243 VanDerWaalsContact O-N 3.08Å; Y240-L243 PolarHBondContact O-N 3.05Å; L241-L243 PolarHBondContact O-N 2.9Å
244	T	75.9	Confident	66	Low	67 Å²	67	122.7 Å²	122.7	41%	0.411	63%	0.625	S	S	.	*	H	α-helix	trans	-107.2	-20.4	-173.7	52.2	0	0	0	0	114.1	Y240 L241 Q242 C246	Y240-T244 HydrophobicContact CD1-CG2 4.38Å; Y240-T244 HydrophobicContact CD2-CG2 4.38Å; Y240-T244 HydrophobicContact CE1-CG2 3.97Å; Y240-T244 HydrophobicContact CE2-CG2 3.96Å; Y240-T244 WeakPolarHBondContact O-CB 3.22Å; Y240-T244 WeakPolarHBondContact O-CG2 3.41Å; Y240-T244 PolarHBondContact O-N 3.33Å; Y240-T244 VanDerWaalsContact O-N 3.08Å; Y240-T244 PolarHBondContact O-OG1 3.46Å; L241-T244 WeakPolarHBondContact CA-OG1 3.41Å; L241-T244 PolarHBondContact O-N 3.21Å; L241-T244 PolarHBondContact O-OG1 2.9Å; Q242-T244 VanDerWaalsContact C-N 3.32Å; T244-C246 VanDerWaalsContact C-N 3.25Å; T244-C246 PolarHBondContact O-N 3.02Å
245	E	62.5	Low	65.2	Low	148 Å²	148	126.1 Å²	126.1	69%	0.692	65%	0.646	S	S	*	*	S	Bend	trans	-79.2	1	175.6	-74.8	179.6	169.5	0	0	113.8	L241 K247	L241-E245 WeakPolarHBondContact O-CB 3.11Å; L241-E245 WeakPolarHBondContact O-CG 3.3Å; L241-E245 PolarHBondContact O-N 3.21Å; E245-K247 PolarHBondContact O-N 2.89Å; E245-K247 VanDerWaalsContact O-N 3.16Å
246	C	53.8	Low	64.4	Low	103 Å²	103	126.1 Å²	126.1	70%	0.696	65%	0.649	S	S	*	*			trans	-85.6	32.2	178.4	-143.1	0	0	0	0	114	T244	T244-C246 VanDerWaalsContact C-N 3.25Å; T244-C246 PolarHBondContact O-N 3.02Å
247	K	53.8	Low	63.4	Low	184 Å²	184	130.2 Å²	130.2	80%	0.8	66%	0.66	S	S	*	*			trans	-136.1	75.8	174.8	-86.6	-173.7	175.7	176.3	0	111.2	E245	E245-K247 PolarHBondContact O-N 2.89Å; E245-K247 VanDerWaalsContact O-N 3.16Å
248	D	52.5	Low	62.3	Low	158 Å²	158	135.5 Å²	135.5	85%	0.845	69%	0.687	S	S	*	*			trans	-145.4	69.4	151.8	-84.3	-36.6	0	0	0	108.3
249	Y	47.8	Very low	61.2	Low	208 Å²	208	142.3 Å²	142.3	82%	0.816	72%	0.717	S	S	*	*			trans	-108.6	94.6	156.1	-75.6	-71.8	0	0	0	108.1	W251	Y249-W251 PolarHBondContact O-N 3.26Å
250	S	39.6	Very low	59.8	Low	108 Å²	108	148.1 Å²	148.1	76%	0.755	74%	0.737	S	S	*	*			trans	-17.5	109.3	156	-173	0	0	0	0	113.2
251	W	51.3	Low	58.1	Low	248 Å²	248	147.5 Å²	147.5	94%	0.939	75%	0.747	S	S	*	*			trans	-84.4	102.1	153	-63	100	0	0	0	106.1	Y249	Y249-W251 PolarHBondContact O-N 3.26Å
252	D	42.8	Very low	56.3	Low	142 Å²	142	155.5 Å²	155.5	76%	0.759	79%	0.787	S	S	*	*			trans	-154.4	119.3	151.1	-99.1	-28.4	0	0	0	111.2
253	T	41.7	Very low	54.3	Low	218 Å²	218	156.2 Å²	156.2	100%	1.337	80%	0.796	S	S	*	*			trans	63.4	0	163.8	45.1	0	0	0	0	120.5

Retrieved 253 of 253 residues in 117.4 ms (Link to these results)

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