G4VCR6_SCHMA Loading...

Putative establishment of cohesion 1 (Eco1) homolog

AlphaFold DB , UniProt , Accession G4VCR6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 267 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	40.9	Very low	54.1	Low	225 Å²	225	182.9 Å²	182.9	100%	1.108	82%	0.824	S	S	*	*				0	104.9	0	-103.9	163.2	166.1	0	0	108.2	Y3	M1-Y3 PolarHBondContact O-N 3.09Å
2	R	41	Very low	55.7	Low	228 Å²	228	179.7 Å²	179.7	86%	0.86	82%	0.818	S	S	*	*			trans	-83.7	106.9	177.9	-71.9	-177.3	177.3	175.2	-0.7	107.7	F4	R2-F4 VanDerWaalsContact C-N 3.33Å; R2-F4 HydrophobicContact CB-CD2 4.48Å; R2-F4 HydrophobicContact CB-CE2 4.29Å; R2-F4 PolarHBondContact O-N 3.31Å
3	Y	45	Very low	56.2	Low	211 Å²	211	176.1 Å²	176.1	83%	0.827	82%	0.818	S	S	*	*			trans	-67	94.4	169.6	-80.5	-94.6	0	0	0	107.7	M1 N5	M1-Y3 PolarHBondContact O-N 3.09Å; Y3-N5 PolarHBondContact O-N 2.81Å
4	F	48.5	Very low	56.9	Low	172 Å²	172	172.3 Å²	172.3	75%	0.754	81%	0.806	S	S	*	*			trans	-71.6	88	159.4	-76.9	-83.8	0	0	0	106.1	R2 Q6	R2-F4 VanDerWaalsContact C-N 3.33Å; R2-F4 HydrophobicContact CB-CD2 4.48Å; R2-F4 HydrophobicContact CB-CE2 4.29Å; R2-F4 PolarHBondContact O-N 3.31Å; F4-Q6 PolarHBondContact O-N 2.63Å
5	N	49.5	Very low	57	Low	128 Å²	128	169.1 Å²	169.1	68%	0.684	80%	0.796	S	S	*	*			trans	-61.7	93.6	159.6	-114.1	-10.1	0	0	0	105	Y3 E7	Y3-N5 PolarHBondContact O-N 2.81Å; N5-E7 HydrophobicContact CB-CG 4.32Å; N5-E7 PolarHBondContact O-N 2.9Å
6	Q	53.2	Low	57.8	Low	177 Å²	177	165.4 Å²	165.4	83%	0.827	79%	0.793	S	S	*	*			trans	-66.2	73	162.1	-77.7	172.3	-28.5	0	0	105.9	F4 K8	F4-Q6 PolarHBondContact O-N 2.63Å; Q6-K8 VanDerWaalsContact C-N 3.25Å; Q6-K8 PolarHBondContact O-N 2.81Å
7	E	56.4	Low	58.4	Low	158 Å²	158	159.6 Å²	159.6	74%	0.738	79%	0.787	S	S	*	*			trans	-57.6	100.5	164.5	-75.8	178.7	-179.5	0	0	104.9	N5 K9	N5-E7 HydrophobicContact CB-CG 4.32Å; N5-E7 PolarHBondContact O-N 2.9Å; E7-K9 PolarHBondContact O-N 3.22Å
8	K	57.1	Low	58.9	Low	192 Å²	192	156.1 Å²	156.1	84%	0.835	77%	0.768	S	S	*	*			trans	-50.3	110.4	168.5	-78.3	180	176	178	0	105	Q6 I10	Q6-K8 VanDerWaalsContact C-N 3.25Å; Q6-K8 PolarHBondContact O-N 2.81Å; K8-I10 VanDerWaalsContact C-N 3.27Å; K8-I10 PolarHBondContact O-N 2.97Å
9	K	65	Low	59.6	Low	209 Å²	209	159 Å²	159	91%	0.909	78%	0.776	S	S	*	*			trans	-61.8	98.4	172.6	-71.5	-176.3	178.4	-178	0	106.2	E7 Q11	E7-K9 PolarHBondContact O-N 3.22Å; K9-Q11 PolarHBondContact O-N 3Å
10	I	69.1	Low	60.1	Low	145 Å²	145	158.1 Å²	158.1	74%	0.744	77%	0.77	S	S	*	*			trans	-73.2	115	172.8	-60.7	169.3	0	0	0	104.9	K8 L12	K8-I10 VanDerWaalsContact C-N 3.27Å; K8-I10 PolarHBondContact O-N 2.97Å; I10-L12 PolarHBondContact O-N 2.73Å
11	Q	69.4	Low	60.6	Low	167 Å²	167	157.8 Å²	157.8	78%	0.78	77%	0.765	S	S	*	*			trans	-70.7	115.5	174.2	-179.8	173.4	-37	0	0	108.2	K9	K9-Q11 PolarHBondContact O-N 3Å
12	L	73	Confident	62.5	Low	144 Å²	144	148.7 Å²	148.7	75%	0.754	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-75.9	154.7	167.9	-61.8	173	0	0	0	109.4	I10 L14	I10-L12 PolarHBondContact O-N 2.73Å; L12-L14 PolarHBondContact O-N 3.44Å
13	T	62.9	Low	64.6	Low	133 Å²	133	142.1 Å²	142.1	82%	0.816	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-57.2	123.6	174.5	-49.6	0	0	0	0	109.8	D15	T13-D15 PolarHBondContact O-N 2.67Å
14	L	66	Low	66.6	Low	123 Å²	123	134.4 Å²	134.4	64%	0.644	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-79	116.2	177.4	-71.4	164.9	0	0	0	109.3	L12 C16	L12-L14 PolarHBondContact O-N 3.44Å; L14-C16 PolarHBondContact O-N 2.67Å
15	D	57.5	Low	68.6	Low	124 Å²	124	134 Å²	134	66%	0.663	69%	0.686	S	S	*	*			trans	-83.8	110	171.3	-169.8	-3.3	0	0	0	109.5	T13 G17	T13-D15 PolarHBondContact O-N 2.67Å; D15-G17 PolarHBondContact OD1-N 2.76Å
16	C	70.9	Confident	70.3	Confident	111 Å²	111	128.5 Å²	128.5	75%	0.75	66%	0.658	S	S	*	*	S	Bend	trans	-120.4	28.1	179.2	-63	0	0	0	0	111.9	L14	L14-C16 PolarHBondContact O-N 2.67Å
17	G	67.9	Low	71.8	Confident	66 Å²	66	128.1 Å²	128.1	68%	0.68	66%	0.656	S	S	*	*			trans	82	39.7	-179.8	0	0	0	0	0	113.5	D15	D15-G17 PolarHBondContact OD1-N 2.76Å
18	Q	67.8	Low	73	Confident	96 Å²	96	127.1 Å²	127.1	45%	0.449	65%	0.651	S	S	.	*			trans	-64.1	139.3	173.9	-59.6	-177	-6.4	0	0	110	E20	Q18-E20 VanDerWaalsContact C-N 3.31Å; Q18-E20 PolarHBondContact O-N 3.41Å
19	K	71.8	Confident	74.1	Confident	212 Å²	212	118.7 Å²	118.7	92%	0.922	62%	0.616	S	S	*	*	S	Bend	trans	-66.4	-31.3	-176.4	-69.7	-174.5	178	-177.9	0	113.6
20	E	69.3	Low	75	Confident	141 Å²	141	114.6 Å²	114.6	66%	0.659	60%	0.6	S	S	*	*	S	Bend	trans	-129.7	124.8	177.6	-64	-175.1	176.5	0	0	107.9	Q18 V35	Q18-E20 VanDerWaalsContact C-N 3.31Å; Q18-E20 PolarHBondContact O-N 3.41Å; E20-V35 HydrophobicContact CB-CG1 3.85Å
21	F	70.4	Confident	75.8	Confident	151 Å²	151	109.5 Å²	109.5	66%	0.662	57%	0.574	S	S	*	*			trans	-142.4	157.3	-177.7	63.2	-89.7	0	0	0	110.9
22	G	82	Confident	76.8	Confident	34 Å²	34	105.2 Å²	105.2	35%	0.351	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	79.9	-167.5	177	0	0	0	0	0	114.3	T34 V35	G22-T34 WeakPolarHBondContact O-CA 3.49Å; G22-V35 PolarHBondContact O-N 2.89Å
23	S	84.8	Confident	77.6	Confident	90 Å²	90	100.5 Å²	100.5	63%	0.629	53%	0.531	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82	129.9	-178.6	-52.1	0	0	0	0	111.5	Y33 T34	S23-Y33 CarbonylContact C-O 3.56Å; S23-Y33 WeakPolarHBondContact CA-O 3.23Å; S23-T34 PolarHBondContact OG-OG1 3.5Å
24	T	87.2	Confident	78.7	Confident	50 Å²	50	96.5 Å²	96.5	31%	0.307	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	151.7	174.6	-169.6	0	0	0	0	110.6	V32 Y33 V35	T24-V32 CarbonylContact O-C 3.55Å; T24-V32 WeakPolarHBondContact O-CA 3.46Å; T24-Y33 HydrophobicContact CG2-CD1 4.1Å; T24-Y33 HydrophobicContact CG2-CD2 4.24Å; T24-Y33 HydrophobicContact CG2-CE1 3.6Å; T24-Y33 HydrophobicContact CG2-CE2 3.74Å; T24-Y33 HydrophobicContact CG2-CG 4.4Å; T24-Y33 PolarHBondContact N-O 3Å; T24-Y33 PolarHBondContact O-N 3.08Å; T24-Y33 VanDerWaalsContact O-O 3.1Å; T24-V35 HydrophobicContact CG2-CG2 3.38Å
25	R	89.4	Confident	79.5	Confident	162 Å²	162	92 Å²	92	61%	0.611	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	126.8	174.1	-178.3	179.1	-77.2	172.4	-2.5	109.1	H27 H30 V32	R25-H27 PolarHBondContact O-N 3Å; R25-H30 WeakPolarHBondContact CG-O 3.22Å; R25-V32 HydrophobicContact CB-CG2 4.13Å; R25-V32 HydrophobicContact CG-CG2 4.21Å
26	C	85.5	Confident	80.5	Confident	13 Å²	13	88.9 Å²	88.9	9%	0.088	48%	0.481	C	S	.	.			trans	-64.8	135.6	175.2	-177.2	0	0	0	0	112	Q28 C29 H30 M31 Y33 H44 H48	C26-Q28 VanDerWaalsContact C-N 3.3Å; C26-Q28 PolarHBondContact O-N 2.97Å; C26-Q28 PolarHBondContact SG-N 2.95Å; C26-Q28 VanDerWaalsContact SG-N 3.38Å; C26-C29 WeakPolarHBondContact CB-SG 3.45Å; C26-C29 VanDerWaalsContact SG-SG 3.69Å; C26-H30 WeakPolarHBondContact O-CA 3.17Å; C26-H30 PolarHBondContact O-N 2.71Å; C26-H30 PolarHBondContact O-ND1 3.47Å; C26-M31 PolarHBondContact N-O 3.2Å; C26-Y33 HydrophobicContact CB-CE1 4.25Å; C26-H44 VanDerWaalsContact CB-NE2 3.27Å; C26-H44 WeakPolarHBondContact CB-NE2 3.18Å; C26-H44 PolarHBondContact SG-NE2 2.96Å; C26-H48 VanDerWaalsContact SG-CE1 3.54Å; C26-H48 PolarHBondContact SG-NE2 3.45Å
27	H	84.4	Confident	81.2	Confident	170 Å²	170	87 Å²	87	79%	0.787	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-21.2	179.4	-62.5	83.8	0	0	0	113.4	R25 H30	R25-H27 PolarHBondContact O-N 3Å; H27-H30 PolarHBondContact O-CE1 3.01Å
28	Q	80.9	Confident	82	Confident	137 Å²	137	92.5 Å²	92.5	64%	0.64	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-46.4	-176.9	-44.3	177.8	-53.6	0	0	112.4	C26 H48 L52	C26-Q28 VanDerWaalsContact C-N 3.3Å; C26-Q28 PolarHBondContact O-N 2.97Å; C26-Q28 PolarHBondContact SG-N 2.95Å; C26-Q28 VanDerWaalsContact SG-N 3.38Å; Q28-H48 PolarHBondContact OE1-CE1 3.12Å; Q28-H48 VanDerWaalsContact OE1-CE1 3.26Å; Q28-L52 HydrophobicContact CB-CD2 3.71Å
29	C	81.5	Confident	83	Confident	14 Å²	14	95.6 Å²	95.6	10%	0.095	48%	0.483	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-9	-179.1	79.1	0	0	0	0	113.6	C26 M31 Y47 H48 L52	C26-C29 WeakPolarHBondContact CB-SG 3.45Å; C26-C29 VanDerWaalsContact SG-SG 3.69Å; C29-M31 PolarHBondContact O-N 3.1Å; C29-M31 WeakPolarHBondContact SG-CB 3.33Å; C29-M31 PolarHBondContact SG-N 2.88Å; C29-Y47 HydrophobicContact CB-CD1 3.9Å; C29-Y47 HydrophobicContact CB-CE1 3.88Å; C29-H48 VanDerWaalsContact SG-CD2 3.53Å; C29-H48 PolarHBondContact SG-NE2 3.47Å; C29-L52 HydrophobicContact CB-CD1 3.44Å; C29-L52 VanDerWaalsContact CB-CD1 3.44Å
30	H	84.3	Confident	83.9	Confident	123 Å²	123	87.5 Å²	87.5	57%	0.569	45%	0.45	S	S	*	.			trans	57	8.1	-177.4	-57.6	-51.1	0	0	0	116.1	R25 C26 H27	R25-H30 WeakPolarHBondContact CG-O 3.22Å; C26-H30 WeakPolarHBondContact O-CA 3.17Å; C26-H30 PolarHBondContact O-N 2.71Å; C26-H30 PolarHBondContact O-ND1 3.47Å; H27-H30 PolarHBondContact O-CE1 3.01Å
31	M	86.1	Confident	84.7	Confident	39 Å²	39	83.1 Å²	83.1	19%	0.192	43%	0.43	C	S	.	.			trans	-66.6	135.5	171.1	-160.3	-174.4	100.6	0	0	109.7	C26 C29 H44 Y47	C26-M31 PolarHBondContact N-O 3.2Å; C29-M31 PolarHBondContact O-N 3.1Å; C29-M31 WeakPolarHBondContact SG-CB 3.33Å; C29-M31 PolarHBondContact SG-N 2.88Å; M31-H44 HydrophobicContact CE-CB 3.49Å; M31-H44 VanDerWaalsContact CE-CB 3.49Å; M31-Y47 HydrophobicContact CB-CD1 4.05Å; M31-Y47 HydrophobicContact CB-CE1 4.16Å; M31-Y47 HydrophobicContact CG-CD1 4.39Å; M31-Y47 HydrophobicContact SD-CD1 3.94Å; M31-Y47 HydrophobicContact SD-CD2 4.17Å; M31-Y47 HydrophobicContact SD-CG 3.66Å
32	V	89.6	Confident	85.6	Confident	76 Å²	76	81.9 Å²	81.9	46%	0.461	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	128.9	172.5	-179.2	0	0	0	0	107.8	T24 R25	T24-V32 CarbonylContact O-C 3.55Å; T24-V32 WeakPolarHBondContact O-CA 3.46Å; R25-V32 HydrophobicContact CB-CG2 4.13Å; R25-V32 HydrophobicContact CG-CG2 4.21Å
33	Y	89.2	Confident	86	Confident	46 Å²	46	82.3 Å²	82.3	18%	0.18	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	158.5	177.7	69.7	-82.9	0	0	0	110.5	S23 T24 C26 V35 D40 I41 H44	S23-Y33 CarbonylContact C-O 3.56Å; S23-Y33 WeakPolarHBondContact CA-O 3.23Å; T24-Y33 HydrophobicContact CG2-CD1 4.1Å; T24-Y33 HydrophobicContact CG2-CD2 4.24Å; T24-Y33 HydrophobicContact CG2-CE1 3.6Å; T24-Y33 HydrophobicContact CG2-CE2 3.74Å; T24-Y33 HydrophobicContact CG2-CG 4.4Å; T24-Y33 PolarHBondContact N-O 3Å; T24-Y33 PolarHBondContact O-N 3.08Å; T24-Y33 VanDerWaalsContact O-O 3.1Å; C26-Y33 HydrophobicContact CB-CE1 4.25Å; Y33-V35 HydrophobicContact CE2-CG2 4.32Å; Y33-D40 WeakPolarHBondContact CA-OD2 3.29Å; Y33-I41 HydrophobicContact CD2-CG1 4.2Å; Y33-I41 HydrophobicContact CE2-CG1 4.24Å; Y33-H44 HydrophobicContact CD1-CB 4.12Å; Y33-H44 AromaticContact CD1-CD2 3.54Å; Y33-H44 AromaticContact CD1-CG 3.63Å; Y33-H44 AromaticContact CD1-ND1 3.98Å; Y33-H44 AromaticContact CD1-NE2 3.83Å; Y33-H44 HydrophobicContact CD2-CB 4.43Å; Y33-H44 AromaticContact CE1-CD2 3.68Å; Y33-H44 AromaticContact CE1-CE1 3.43Å; Y33-H44 VanDerWaalsContact CE1-CE1 3.43Å; Y33-H44 WeakPolarHBondContact CE1-CE1 3.4Å; Y33-H44 AromaticContact CE1-CG 3.77Å; Y33-H44 AromaticContact CE1-ND1 3.62Å; Y33-H44 AromaticContact CE1-NE2 3.45Å; Y33-H44 WeakPolarHBondContact CE1-NE2 3.34Å; Y33-H44 HydrophobicContact CG-CB 4.01Å; Y33-H44 AromaticContact CZ-CE1 3.76Å; Y33-H44 AromaticContact CZ-ND1 3.76Å
34	T	87.3	Confident	86.1	Confident	48 Å²	48	78.9 Å²	78.9	29%	0.294	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	121.4	-177.9	-55	0	0	0	0	110.5	G22 S23 G36 D37 D40	G22-T34 WeakPolarHBondContact O-CA 3.49Å; S23-T34 PolarHBondContact OG-OG1 3.5Å; T34-G36 PolarHBondContact O-N 2.85Å; T34-D37 HydrophobicContact CG2-CB 4.47Å; T34-D37 PolarHBondContact O-N 2.85Å; T34-D40 PolarHBondContact N-OD2 2.95Å
35	V	81.3	Confident	86.1	Confident	30 Å²	30	83.2 Å²	83.2	18%	0.182	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	128.1	173.3	-172.2	0	0	0	0	108.3	E20 G22 T24 Y33	E20-V35 HydrophobicContact CB-CG1 3.85Å; G22-V35 PolarHBondContact O-N 2.89Å; T24-V35 HydrophobicContact CG2-CG2 3.38Å; Y33-V35 HydrophobicContact CE2-CG2 4.32Å
36	G	80	Confident	85.9	Confident	58 Å²	58	79.6 Å²	79.6	60%	0.598	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.9	-21.3	-176.1	0	0	0	0	0	114.2	T34 K38	T34-G36 PolarHBondContact O-N 2.85Å; G36-K38 PolarHBondContact O-N 2.77Å
37	D	84.5	Confident	85.8	Confident	70 Å²	70	83.4 Å²	83.4	37%	0.374	42%	0.417	S	S	.	.			trans	-82.7	113.6	172.5	-168.2	-35.7	0	0	0	110.3	T34 E39 D40 I41	T34-D37 HydrophobicContact CG2-CB 4.47Å; T34-D37 PolarHBondContact O-N 2.85Å; D37-E39 VanDerWaalsContact C-N 3.32Å; D37-E39 PolarHBondContact O-N 3.15Å; D37-E39 WeakPolarHBondContact OD1-CB 3.43Å; D37-E39 PolarHBondContact OD1-N 3.42Å; D37-D40 HydrophobicContact CB-CB 3.86Å; D37-D40 PolarHBondContact O-N 3.28Å; D37-D40 PolarHBondContact OD1-N 3.45Å; D37-I41 WeakPolarHBondContact O-CB 3.31Å; D37-I41 WeakPolarHBondContact O-CD1 3.36Å; D37-I41 WeakPolarHBondContact O-CG1 3.47Å; D37-I41 PolarHBondContact O-N 3.22Å
38	K	85.2	Confident	85.6	Confident	183 Å²	183	76.5 Å²	76.5	80%	0.796	39%	0.385	S	S	*	.	H	α-helix	trans	-64.5	-36.3	-178.6	-175.2	-178.3	176	-174.8	0	112.4	G36 K42	G36-K38 PolarHBondContact O-N 2.77Å; K38-K42 WeakPolarHBondContact O-CB 3.32Å; K38-K42 PolarHBondContact O-N 3.11Å; K38-K42 VanDerWaalsContact O-N 3.13Å
39	E	88.6	Confident	85.4	Confident	160 Å²	160	75.9 Å²	75.9	75%	0.748	38%	0.382	S	S	*	.	H	α-helix	trans	-70.7	-42.8	-179.5	-63.4	-171.1	171.4	0	0	110.1	D37 K42 A43	D37-E39 VanDerWaalsContact C-N 3.32Å; D37-E39 PolarHBondContact O-N 3.15Å; D37-E39 WeakPolarHBondContact OD1-CB 3.43Å; D37-E39 PolarHBondContact OD1-N 3.42Å; E39-K42 WeakPolarHBondContact O-CB 3.4Å; E39-K42 PolarHBondContact O-N 2.95Å; E39-A43 PolarHBondContact O-N 3.32Å
40	D	90.1	Very high	85.1	Confident	43 Å²	43	80.5 Å²	80.5	23%	0.23	41%	0.405	C	S	.	.	H	α-helix	trans	-69.7	-39.8	179.8	-152.3	7.6	0	0	0	112.1	Y33 T34 D37 K42 A43 H44	Y33-D40 WeakPolarHBondContact CA-OD2 3.29Å; T34-D40 PolarHBondContact N-OD2 2.95Å; D37-D40 HydrophobicContact CB-CB 3.86Å; D37-D40 PolarHBondContact O-N 3.28Å; D37-D40 PolarHBondContact OD1-N 3.45Å; D40-K42 VanDerWaalsContact C-N 3.26Å; D40-K42 PolarHBondContact O-N 3.08Å; D40-A43 PolarHBondContact O-N 3.11Å; D40-H44 VanDerWaalsContact O-CB 3.32Å; D40-H44 WeakPolarHBondContact O-CB 3.49Å; D40-H44 PolarHBondContact O-N 3.09Å
41	I	87.3	Confident	84.5	Confident	48 Å²	48	80.9 Å²	80.9	25%	0.246	41%	0.405	C	S	.	.	H	α-helix	trans	-61.5	-36.4	171.9	-68.3	164.7	0	0	0	111.2	Y33 D37 K45	Y33-I41 HydrophobicContact CD2-CG1 4.2Å; Y33-I41 HydrophobicContact CE2-CG1 4.24Å; D37-I41 WeakPolarHBondContact O-CB 3.31Å; D37-I41 WeakPolarHBondContact O-CD1 3.36Å; D37-I41 WeakPolarHBondContact O-CG1 3.47Å; D37-I41 PolarHBondContact O-N 3.22Å; I41-K45 HydrophobicContact CG2-CD 4.38Å; I41-K45 WeakPolarHBondContact O-CG 3.47Å; I41-K45 PolarHBondContact O-N 2.88Å; I41-K45 VanDerWaalsContact O-N 3.08Å
42	K	89.6	Confident	83.7	Confident	126 Å²	126	81.5 Å²	81.5	55%	0.548	41%	0.408	S	S	.	.	H	α-helix	trans	-68.2	-47.6	176.1	-170.5	-173.4	-178.4	-107.7	0	110.6	K38 E39 D40 H44 K45 E46	K38-K42 WeakPolarHBondContact O-CB 3.32Å; K38-K42 PolarHBondContact O-N 3.11Å; K38-K42 VanDerWaalsContact O-N 3.13Å; E39-K42 WeakPolarHBondContact O-CB 3.4Å; E39-K42 PolarHBondContact O-N 2.95Å; D40-K42 VanDerWaalsContact C-N 3.26Å; D40-K42 PolarHBondContact O-N 3.08Å; K42-H44 VanDerWaalsContact C-N 3.28Å; K42-H44 PolarHBondContact O-N 2.86Å; K42-K45 PolarHBondContact O-N 2.96Å; K42-K45 VanDerWaalsContact O-N 3.16Å; K42-E46 VanDerWaalsContact CE-OE1 3.24Å; K42-E46 WeakPolarHBondContact CE-OE1 3.41Å; K42-E46 IonicContact NZ-OE1 2.7Å; K42-E46 PolarHBondContact NZ-OE1 3.08Å; K42-E46 WeakPolarHBondContact O-CG 3.38Å; K42-E46 PolarHBondContact O-N 2.94Å
43	A	88.4	Confident	82.9	Confident	43 Å²	43	82.4 Å²	82.4	36%	0.355	41%	0.406	S	S	.	.	H	α-helix	trans	-58.1	-41.8	176.2	0	0	0	0	0	111.6	E39 D40 E46 Y47	E39-A43 PolarHBondContact O-N 3.32Å; D40-A43 PolarHBondContact O-N 3.11Å; A43-E46 PolarHBondContact O-N 3Å; A43-Y47 WeakPolarHBondContact O-CB 3.27Å; A43-Y47 PolarHBondContact O-N 3.36Å
44	H	88.5	Confident	82.6	Confident	18 Å²	18	82.2 Å²	82.2	8%	0.083	41%	0.411	C	S	.	.	H	α-helix	trans	-59.4	-46.4	174.2	174.3	-119.7	0	0	0	112.7	C26 M31 Y33 D40 K42 Y47 H48	C26-H44 VanDerWaalsContact CB-NE2 3.27Å; C26-H44 WeakPolarHBondContact CB-NE2 3.18Å; C26-H44 PolarHBondContact SG-NE2 2.96Å; M31-H44 HydrophobicContact CE-CB 3.49Å; M31-H44 VanDerWaalsContact CE-CB 3.49Å; Y33-H44 HydrophobicContact CD1-CB 4.12Å; Y33-H44 AromaticContact CD1-CD2 3.54Å; Y33-H44 AromaticContact CD1-CG 3.63Å; Y33-H44 AromaticContact CD1-ND1 3.98Å; Y33-H44 AromaticContact CD1-NE2 3.83Å; Y33-H44 HydrophobicContact CD2-CB 4.43Å; Y33-H44 AromaticContact CE1-CD2 3.68Å; Y33-H44 AromaticContact CE1-CE1 3.43Å; Y33-H44 VanDerWaalsContact CE1-CE1 3.43Å; Y33-H44 WeakPolarHBondContact CE1-CE1 3.4Å; Y33-H44 AromaticContact CE1-CG 3.77Å; Y33-H44 AromaticContact CE1-ND1 3.62Å; Y33-H44 AromaticContact CE1-NE2 3.45Å; Y33-H44 WeakPolarHBondContact CE1-NE2 3.34Å; Y33-H44 HydrophobicContact CG-CB 4.01Å; Y33-H44 AromaticContact CZ-CE1 3.76Å; Y33-H44 AromaticContact CZ-ND1 3.76Å; D40-H44 VanDerWaalsContact O-CB 3.32Å; D40-H44 WeakPolarHBondContact O-CB 3.49Å; D40-H44 PolarHBondContact O-N 3.09Å; K42-H44 VanDerWaalsContact C-N 3.28Å; K42-H44 PolarHBondContact O-N 2.86Å; H44-Y47 PolarHBondContact O-N 2.85Å; H44-H48 AromaticContact CD2-CD2 3.52Å; H44-H48 AromaticContact CD2-NE2 3.86Å; H44-H48 AromaticContact CE1-CD2 3.44Å; H44-H48 PolarHBondContact CE1-CD2 3Å; H44-H48 VanDerWaalsContact CE1-CD2 3.44Å; H44-H48 AromaticContact CE1-NE2 3.42Å; H44-H48 PolarHBondContact CE1-NE2 3.47Å; H44-H48 AromaticContact NE2-CD2 3.07Å; H44-H48 PolarHBondContact NE2-CD2 3.5Å; H44-H48 AromaticContact NE2-NE2 2.97Å; H44-H48 PolarHBondContact NE2-NE2 2.98Å; H44-H48 WeakPolarHBondContact O-CB 3.17Å; H44-H48 PolarHBondContact O-CD2 3.15Å; H44-H48 PolarHBondContact O-N 2.79Å
45	K	86.1	Confident	82.5	Confident	140 Å²	140	83 Å²	83	61%	0.609	42%	0.415	S	S	*	.	H	α-helix	trans	-63.4	-42.8	176.7	-74.2	173.5	-178.6	179	0	112.1	I41 K42 H48 Q49	I41-K45 HydrophobicContact CG2-CD 4.38Å; I41-K45 WeakPolarHBondContact O-CG 3.47Å; I41-K45 PolarHBondContact O-N 2.88Å; I41-K45 VanDerWaalsContact O-N 3.08Å; K42-K45 PolarHBondContact O-N 2.96Å; K42-K45 VanDerWaalsContact O-N 3.16Å; K45-H48 WeakPolarHBondContact O-CB 3.45Å; K45-H48 PolarHBondContact O-N 3Å; K45-Q49 PolarHBondContact O-N 3.25Å
46	E	85.8	Confident	83	Confident	87 Å²	87	82 Å²	82	41%	0.407	41%	0.409	S	S	.	.	H	α-helix	trans	-63	-44.5	176.2	-71.7	177.3	-174.5	0	0	110.9	K42 A43 H48 Q49 I50	K42-E46 VanDerWaalsContact CE-OE1 3.24Å; K42-E46 WeakPolarHBondContact CE-OE1 3.41Å; K42-E46 IonicContact NZ-OE1 2.7Å; K42-E46 PolarHBondContact NZ-OE1 3.08Å; K42-E46 WeakPolarHBondContact O-CG 3.38Å; K42-E46 PolarHBondContact O-N 2.94Å; A43-E46 PolarHBondContact O-N 3Å; E46-H48 PolarHBondContact O-N 2.93Å; E46-Q49 PolarHBondContact O-N 3.26Å; E46-I50 VanDerWaalsContact O-CG1 3.27Å; E46-I50 WeakPolarHBondContact O-CG1 3.42Å; E46-I50 PolarHBondContact O-N 2.89Å
47	Y	82.5	Confident	83.6	Confident	92 Å²	92	87.1 Å²	87.1	36%	0.361	41%	0.411	S	S	.	.	H	α-helix	trans	-60.4	-44.6	175.2	-173.2	-94.6	0	0	0	111.9	C29 M31 A43 H44 Q49 I50 K51	C29-Y47 HydrophobicContact CB-CD1 3.9Å; C29-Y47 HydrophobicContact CB-CE1 3.88Å; M31-Y47 HydrophobicContact CB-CD1 4.05Å; M31-Y47 HydrophobicContact CB-CE1 4.16Å; M31-Y47 HydrophobicContact CG-CD1 4.39Å; M31-Y47 HydrophobicContact SD-CD1 3.94Å; M31-Y47 HydrophobicContact SD-CD2 4.17Å; M31-Y47 HydrophobicContact SD-CG 3.66Å; A43-Y47 WeakPolarHBondContact O-CB 3.27Å; A43-Y47 PolarHBondContact O-N 3.36Å; H44-Y47 PolarHBondContact O-N 2.85Å; Y47-Q49 VanDerWaalsContact C-N 3.34Å; Y47-Q49 PolarHBondContact O-N 2.84Å; Y47-I50 PolarHBondContact O-N 3.26Å; Y47-K51 HydrophobicContact CD1-CB 4.39Å; Y47-K51 HydrophobicContact CD1-CG 4.1Å; Y47-K51 HydrophobicContact CD2-CG 4Å; Y47-K51 HydrophobicContact CE1-CB 4.15Å; Y47-K51 HydrophobicContact CE1-CG 3.78Å; Y47-K51 HydrophobicContact CE2-CD 4.4Å; Y47-K51 HydrophobicContact CE2-CG 3.69Å; Y47-K51 HydrophobicContact CG-CG 4.21Å; Y47-K51 VanDerWaalsContact O-CB 3.29Å; Y47-K51 WeakPolarHBondContact O-CB 3.41Å; Y47-K51 WeakPolarHBondContact O-CG 3.27Å; Y47-K51 PolarHBondContact O-N 3.02Å
48	H	81.5	Confident	84.1	Confident	26 Å²	26	83.8 Å²	83.8	12%	0.12	39%	0.393	C	S	.	.	H	α-helix	trans	-56.2	-47.7	174.4	-102.9	-84.6	0	0	0	112.7	C26 Q28 C29 H44 K45 E46 I50 L52	C26-H48 VanDerWaalsContact SG-CE1 3.54Å; C26-H48 PolarHBondContact SG-NE2 3.45Å; Q28-H48 PolarHBondContact OE1-CE1 3.12Å; Q28-H48 VanDerWaalsContact OE1-CE1 3.26Å; C29-H48 VanDerWaalsContact SG-CD2 3.53Å; C29-H48 PolarHBondContact SG-NE2 3.47Å; H44-H48 AromaticContact CD2-CD2 3.52Å; H44-H48 AromaticContact CD2-NE2 3.86Å; H44-H48 AromaticContact CE1-CD2 3.44Å; H44-H48 PolarHBondContact CE1-CD2 3Å; H44-H48 VanDerWaalsContact CE1-CD2 3.44Å; H44-H48 AromaticContact CE1-NE2 3.42Å; H44-H48 PolarHBondContact CE1-NE2 3.47Å; H44-H48 AromaticContact NE2-CD2 3.07Å; H44-H48 PolarHBondContact NE2-CD2 3.5Å; H44-H48 AromaticContact NE2-NE2 2.97Å; H44-H48 PolarHBondContact NE2-NE2 2.98Å; H44-H48 WeakPolarHBondContact O-CB 3.17Å; H44-H48 PolarHBondContact O-CD2 3.15Å; H44-H48 PolarHBondContact O-N 2.79Å; K45-H48 WeakPolarHBondContact O-CB 3.45Å; K45-H48 PolarHBondContact O-N 3Å; E46-H48 PolarHBondContact O-N 2.93Å; H48-I50 VanDerWaalsContact C-N 3.34Å; H48-L52 WeakPolarHBondContact O-CB 3.28Å; H48-L52 PolarHBondContact O-N 3.33Å
49	Q	76.6	Confident	84.5	Confident	123 Å²	123	78.1 Å²	78.1	58%	0.575	38%	0.375	S	S	*	.	H	α-helix	trans	-63.2	-44	180	-173.7	173.2	34.6	0	0	111	K45 E46 Y47 F53	K45-Q49 PolarHBondContact O-N 3.25Å; E46-Q49 PolarHBondContact O-N 3.26Å; Y47-Q49 VanDerWaalsContact C-N 3.34Å; Y47-Q49 PolarHBondContact O-N 2.84Å; Q49-F53 CarbonylContact O-C 3.59Å; Q49-F53 PolarHBondContact O-N 2.76Å
50	I	74.3	Confident	84.7	Confident	111 Å²	111	75.5 Å²	75.5	57%	0.569	36%	0.358	S	S	*	.	H	α-helix	trans	-71.3	-40.8	-177	-67.4	166	0	0	0	111.8	E46 Y47 H48	E46-I50 VanDerWaalsContact O-CG1 3.27Å; E46-I50 WeakPolarHBondContact O-CG1 3.42Å; E46-I50 PolarHBondContact O-N 2.89Å; Y47-I50 PolarHBondContact O-N 3.26Å; H48-I50 VanDerWaalsContact C-N 3.34Å
51	K	72	Confident	84.7	Confident	131 Å²	131	75.2 Å²	75.2	57%	0.57	37%	0.366	S	S	*	.	H	α-helix	trans	-92	-39.7	-170.9	-68.7	-66	-170.7	178.3	0	114.1	Y47	Y47-K51 HydrophobicContact CD1-CB 4.39Å; Y47-K51 HydrophobicContact CD1-CG 4.1Å; Y47-K51 HydrophobicContact CD2-CG 4Å; Y47-K51 HydrophobicContact CE1-CB 4.15Å; Y47-K51 HydrophobicContact CE1-CG 3.78Å; Y47-K51 HydrophobicContact CE2-CD 4.4Å; Y47-K51 HydrophobicContact CE2-CG 3.69Å; Y47-K51 HydrophobicContact CG-CG 4.21Å; Y47-K51 VanDerWaalsContact O-CB 3.29Å; Y47-K51 WeakPolarHBondContact O-CB 3.41Å; Y47-K51 WeakPolarHBondContact O-CG 3.27Å; Y47-K51 PolarHBondContact O-N 3.02Å
52	L	69.5	Low	84.8	Confident	52 Å²	52	84 Å²	84	27%	0.272	40%	0.396	S	S	.	.	H	α-helix	trans	-89.4	-31.4	-177.2	-80.4	74.1	0	0	0	112.1	Q28 C29 H48	Q28-L52 HydrophobicContact CB-CD2 3.71Å; C29-L52 HydrophobicContact CB-CD1 3.44Å; C29-L52 VanDerWaalsContact CB-CD1 3.44Å; H48-L52 WeakPolarHBondContact O-CB 3.28Å; H48-L52 PolarHBondContact O-N 3.33Å
53	F	73.4	Confident	84.8	Confident	95 Å²	95	78.4 Å²	78.4	42%	0.417	37%	0.372	S	S	.	.	S	Bend	trans	-138.4	59.2	-175.2	-52.2	-69.1	0	0	0	111.6	Q49 T55 K213	Q49-F53 CarbonylContact O-C 3.59Å; Q49-F53 PolarHBondContact O-N 2.76Å; F53-T55 WeakPolarHBondContact O-CG2 3.31Å; F53-T55 PolarHBondContact O-N 3.34Å; F53-K213 VanDerWaalsContact CD1-NZ 3.34Å; F53-K213 VanDerWaalsContact CG-NZ 3.33Å
54	P	81.3	Confident	85	Confident	43 Å²	43	77.1 Å²	77.1	28%	0.279	36%	0.358	S	S	.	.			trans	-55.8	131.1	176.3	22	-29.4	0	0	0	109.6	L96 L99	P54-L96 HydrophobicContact CB-CD1 4.17Å; P54-L96 HydrophobicContact CG-CD1 3.8Å; P54-L96 WeakPolarHBondContact O-CD1 3.48Å; P54-L99 HydrophobicContact CG-CD1 3.44Å; P54-L99 VanDerWaalsContact CG-CD1 3.44Å
55	T	87	Confident	85.3	Confident	63 Å²	63	80.2 Å²	80.2	39%	0.387	38%	0.375	S	S	.	.			trans	-118.1	140.2	178.4	60.5	0	0	0	0	110.4	F53 L137	F53-T55 WeakPolarHBondContact O-CG2 3.31Å; F53-T55 PolarHBondContact O-N 3.34Å; T55-L137 HydrophobicContact CG2-CD2 4.4Å
56	V	91.5	Very high	85.7	Confident	9 Å²	9	76.5 Å²	76.5	6%	0.055	36%	0.361	C	S	.	.			trans	-107.7	128.9	171.3	178.3	0	0	0	0	108.8	R92 I93 L96 V138	V56-R92 HydrophobicContact CG1-CB 4.31Å; V56-R92 HydrophobicContact CG2-CB 4.04Å; V56-I93 HydrophobicContact CB-CG1 4.41Å; V56-I93 HydrophobicContact CG1-CG1 3.95Å; V56-L96 HydrophobicContact CB-CD2 4.4Å; V56-L96 HydrophobicContact CG2-CB 4.39Å; V56-L96 HydrophobicContact CG2-CD2 4.05Å; V56-V138 HydrophobicContact CB-CB 4.34Å; V56-V138 HydrophobicContact CB-CG2 4.32Å; V56-V138 HydrophobicContact CG1-CG2 4.15Å; V56-V138 PolarHBondContact O-N 2.91Å
57	R	92.9	Very high	86.1	Confident	166 Å²	166	73.7 Å²	73.7	63%	0.626	35%	0.349	S	S	*	.	B	Isolated β-bridge	trans	-97.6	131.3	170.4	-71.3	-178.4	-176	177.9	1.3	109.7	P59 Q136 L137	R57-P59 WeakPolarHBondContact O-CD 3.47Å; R57-Q136 CarbonylContact C-O 3.52Å; R57-Q136 VanDerWaalsContact CA-O 3.25Å; R57-Q136 WeakPolarHBondContact CA-O 3.48Å; R57-L137 HydrophobicContact CG-CD2 3.7Å
58	L	94.4	Very high	86.7	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	34%	0.344	C	S	.	.			trans	-117.8	87.6	176.7	-169.2	67	0	0	0	109.4	H63 R75 T77 L79 F89 V129 V131 Q136 V138	L58-H63 VanDerWaalsContact CD1-NE2 3.34Å; L58-H63 WeakPolarHBondContact CD1-NE2 3.2Å; L58-R75 PolarHBondContact O-NH2 2.91Å; L58-T77 HydrophobicContact CD2-CG2 3.92Å; L58-L79 HydrophobicContact CD1-CD1 4.33Å; L58-F89 HydrophobicContact CD1-CB 3.93Å; L58-F89 HydrophobicContact CD1-CD1 3.54Å; L58-F89 HydrophobicContact CD1-CD2 3.76Å; L58-F89 HydrophobicContact CD1-CE1 3.92Å; L58-F89 HydrophobicContact CD1-CE2 4.13Å; L58-F89 HydrophobicContact CD1-CG 3.47Å; L58-F89 VanDerWaalsContact CD1-CG 3.47Å; L58-F89 HydrophobicContact CD1-CZ 4.2Å; L58-V129 HydrophobicContact CD2-CB 4.26Å; L58-V129 HydrophobicContact CD2-CG1 4.08Å; L58-V131 HydrophobicContact CB-CG2 4.02Å; L58-V131 HydrophobicContact CD2-CG2 3.74Å; L58-V131 HydrophobicContact CG-CG2 4.33Å; L58-Q136 PolarHBondContact N-O 2.71Å; L58-Q136 PolarHBondContact O-OE1 3.15Å; L58-V138 HydrophobicContact CB-CG2 3.68Å; L58-V138 HydrophobicContact CD2-CG2 4.49Å
59	P	93.2	Very high	87.3	Confident	64 Å²	64	76 Å²	76	42%	0.416	36%	0.364	S	S	.	.			trans	-69.6	154	178.6	30.7	-34.8	0	0	0	111.2	R57 G61 H63 F89	R57-P59 WeakPolarHBondContact O-CD 3.47Å; P59-G61 PolarHBondContact O-N 2.89Å; P59-H63 PolarHBondContact O-CE1 3.14Å; P59-H63 PolarHBondContact O-NE2 2.93Å; P59-F89 HydrophobicContact CG-CZ 4.38Å
60	R	91.9	Very high	88.1	Confident	105 Å²	105	72 Å²	72	40%	0.396	35%	0.346	S	S	.	.	S	Bend	trans	-62.2	133.6	177	-66.3	-174.1	-172.3	-129.5	4.4	112.5	E64 I66 E69	R60-E64 WeakPolarHBondContact CA-OE1 3.39Å; R60-I66 VanDerWaalsContact NH1-CD1 3.32Å; R60-E69 IonicContact CZ-OE1 2.91Å; R60-E69 IonicContact CZ-OE2 3.35Å; R60-E69 IonicContact NH1-OE1 2.82Å; R60-E69 PolarHBondContact NH1-OE1 3.29Å; R60-E69 IonicContact NH1-OE2 3.27Å; R60-E69 PolarHBondContact NH1-OE2 3.19Å; R60-E69 VanDerWaalsContact NH2-CD 3.29Å; R60-E69 IonicContact NH2-OE1 3.33Å; R60-E69 PolarHBondContact NH2-OE1 3.1Å; R60-E69 IonicContact NH2-OE2 3.46Å
61	G	90.6	Very high	88.8	Confident	38 Å²	38	77.5 Å²	77.5	39%	0.392	37%	0.367	S	S	.	.	S	Bend	trans	-176.1	-171.5	-179.9	0	0	0	0	0	114.3	P59 H63	P59-G61 PolarHBondContact O-N 2.89Å; G61-H63 PolarHBondContact O-N 3.42Å
62	R	89.2	Confident	89.7	Confident	231 Å²	231	75.8 Å²	75.8	87%	0.872	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	1	-176.4	-61	-169.4	-68.2	171	-2.3	115	L83	R62-L83 WeakPolarHBondContact O-CD1 3.49Å
63	H	89.7	Confident	90.7	Very high	10 Å²	10	74.3 Å²	74.3	5%	0.046	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	0.8	-178.5	58.7	-88.7	0	0	0	112.6	L58 P59 G61 L80 L85 F89	L58-H63 VanDerWaalsContact CD1-NE2 3.34Å; L58-H63 WeakPolarHBondContact CD1-NE2 3.2Å; P59-H63 PolarHBondContact O-CE1 3.14Å; P59-H63 PolarHBondContact O-NE2 2.93Å; G61-H63 PolarHBondContact O-N 3.42Å; H63-L80 WeakPolarHBondContact O-CB 3.35Å; H63-L80 PolarHBondContact O-N 3.02Å; H63-L85 HydrophobicContact CB-CB 3.86Å; H63-F89 AromaticContact CD2-CD2 3.38Å; H63-F89 WeakPolarHBondContact CD2-CD2 3.32Å; H63-F89 AromaticContact CD2-CE2 3.49Å; H63-F89 VanDerWaalsContact CD2-CE2 3.49Å; H63-F89 WeakPolarHBondContact CD2-CE2 3.38Å; H63-F89 AromaticContact CE1-CE2 3.5Å; H63-F89 AromaticContact CG-CD2 3.88Å; H63-F89 AromaticContact CG-CE2 3.78Å; H63-F89 AromaticContact ND1-CE2 3.78Å; H63-F89 AromaticContact NE2-CD2 3.6Å; H63-F89 AromaticContact NE2-CE2 3.29Å; H63-F89 VanDerWaalsContact NE2-CE2 3.29Å; H63-F89 WeakPolarHBondContact NE2-CE2 3.16Å; H63-F89 AromaticContact NE2-CZ 3.96Å
64	E	92.5	Very high	91.8	Very high	15 Å²	15	69.8 Å²	69.8	7%	0.07	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	152.2	-176.9	78.5	172.6	143	0	0	110	R60 I66 R75 T77 E78	R60-E64 WeakPolarHBondContact CA-OE1 3.39Å; E64-I66 HydrophobicContact CG-CG1 4.23Å; E64-R75 IonicContact OE1-CZ 3.73Å; E64-R75 IonicContact OE1-NE 2.93Å; E64-R75 PolarHBondContact OE1-NE 2.93Å; E64-R75 IonicContact OE1-NH2 2.71Å; E64-R75 PolarHBondContact OE1-NH2 2.83Å; E64-R75 IonicContact OE2-CZ 2.82Å; E64-R75 IonicContact OE2-NE 3.2Å; E64-R75 PolarHBondContact OE2-NE 2.73Å; E64-R75 IonicContact OE2-NH2 3.47Å; E64-R75 PolarHBondContact OE2-NH2 2.86Å; E64-T77 HydrophobicContact CB-CG2 4.26Å; E64-T77 VanDerWaalsContact CB-OG1 3.27Å; E64-T77 WeakPolarHBondContact CB-OG1 3.21Å; E64-T77 WeakPolarHBondContact CG-OG1 3.18Å; E64-T77 WeakPolarHBondContact OE2-CB 3.16Å; E64-T77 WeakPolarHBondContact OE2-CG2 3.37Å; E64-T77 PolarHBondContact OE2-OG1 3.45Å; E64-E78 CarbonylContact C-O 3.59Å; E64-E78 VanDerWaalsContact CA-O 3.3Å; E64-E78 WeakPolarHBondContact CA-O 3.35Å
65	N	94.7	Very high	92.5	Very high	83 Å²	83	67.7 Å²	67.7	44%	0.444	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	108	170.7	179.3	36.9	0	0	0	108.5	I67 T77 E78 L80	N65-I67 PolarHBondContact O-N 3.04Å; N65-T77 CarbonylContact O-C 3.53Å; N65-T77 WeakPolarHBondContact O-CA 3.49Å; N65-T77 PolarHBondContact O-OG1 2.94Å; N65-E78 HydrophobicContact CB-CB 4.26Å; N65-E78 PolarHBondContact N-O 3.27Å; N65-E78 PolarHBondContact O-N 2.86Å; N65-L80 HydrophobicContact CB-CD2 4.29Å
66	I	94.5	Very high	93	Very high	62 Å²	62	64.7 Å²	64.7	32%	0.318	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	117.1	-174	-56.3	177.9	0	0	0	108.8	R60 E64 R75	R60-I66 VanDerWaalsContact NH1-CD1 3.32Å; E64-I66 HydrophobicContact CG-CG1 4.23Å; I66-R75 HydrophobicContact CG2-CB 4.25Å
67	I	94.8	Very high	93.3	Very high	28 Å²	28	64.3 Å²	64.3	14%	0.144	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	-24.1	-177.9	62.1	165.4	0	0	0	113	N65 V76 E78 F128 A226 N230	N65-I67 PolarHBondContact O-N 3.04Å; I67-V76 HydrophobicContact CD1-CB 4.3Å; I67-V76 HydrophobicContact CD1-CG1 3.68Å; I67-V76 HydrophobicContact CG1-CB 3.96Å; I67-V76 HydrophobicContact CG1-CG1 3.8Å; I67-V76 VanDerWaalsContact CG1-O 3.26Å; I67-V76 WeakPolarHBondContact CG1-O 3.12Å; I67-V76 PolarHBondContact N-O 3.42Å; I67-E78 HydrophobicContact CG2-CB 4.49Å; I67-F128 HydrophobicContact CD1-CD1 3.65Å; I67-F128 HydrophobicContact CD1-CE1 3.81Å; I67-F128 HydrophobicContact CG2-CE1 4.46Å; I67-A226 HydrophobicContact CD1-CB 3.74Å; I67-A226 HydrophobicContact CG1-CB 4.28Å; I67-N230 HydrophobicContact CB-CB 4.3Å; I67-N230 HydrophobicContact CD1-CB 4.37Å; I67-N230 HydrophobicContact CG2-CB 4.18Å
68	M	95.3	Very high	93.4	Very high	54 Å²	54	57.5 Å²	57.5	27%	0.266	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	138.2	178.2	-177.8	-175.7	-73.7	0	0	109.8	R75 V76 N222 A226	M68-R75 CarbonylContact O-C 3.56Å; M68-R75 WeakPolarHBondContact O-CA 3.33Å; M68-R75 VanDerWaalsContact O-CB 3.23Å; M68-R75 WeakPolarHBondContact O-CB 3.29Å; M68-V76 HydrophobicContact CB-CB 4.15Å; M68-V76 HydrophobicContact CB-CG2 4.46Å; M68-V76 PolarHBondContact N-O 2.82Å; M68-V76 VanDerWaalsContact N-O 3.14Å; M68-V76 PolarHBondContact O-N 3.47Å; M68-N222 PolarHBondContact SD-ND2 2.82Å; M68-N222 VanDerWaalsContact SD-ND2 3.37Å; M68-A226 HydrophobicContact CB-CB 4.07Å; M68-A226 HydrophobicContact CE-CB 3.54Å; M68-A226 HydrophobicContact SD-CB 4.04Å
69	E	94.5	Very high	93.4	Very high	114 Å²	114	57.7 Å²	57.7	53%	0.533	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	124.8	173.1	-175.5	157.9	-169	0	0	109.7	R60	R60-E69 IonicContact CZ-OE1 2.91Å; R60-E69 IonicContact CZ-OE2 3.35Å; R60-E69 IonicContact NH1-OE1 2.82Å; R60-E69 PolarHBondContact NH1-OE1 3.29Å; R60-E69 IonicContact NH1-OE2 3.27Å; R60-E69 PolarHBondContact NH1-OE2 3.19Å; R60-E69 VanDerWaalsContact NH2-CD 3.29Å; R60-E69 IonicContact NH2-OE1 3.33Å; R60-E69 PolarHBondContact NH2-OE1 3.1Å; R60-E69 IonicContact NH2-OE2 3.46Å
70	N	92.1	Very high	93.4	Very high	37 Å²	37	56.9 Å²	56.9	20%	0.198	28%	0.275	C	S	.	.			trans	-93.6	155.7	-178.1	-65	-34	0	0	0	110.3	D72 G73 S74 Y130 N222	N70-D72 WeakPolarHBondContact CB-OD1 3.4Å; N70-D72 PolarHBondContact O-N 2.79Å; N70-G73 WeakPolarHBondContact O-CA 3.14Å; N70-G73 PolarHBondContact O-N 3.38Å; N70-S74 WeakPolarHBondContact CB-O 3.46Å; N70-S74 WeakPolarHBondContact CB-OG 3.03Å; N70-S74 PolarHBondContact N-O 2.86Å; N70-S74 PolarHBondContact ND2-OG 2.97Å; N70-Y130 PolarHBondContact ND2-OH 3.17Å; N70-N222 PolarHBondContact ND2-OD1 2.68Å
71	F	90	Very high	93.2	Very high	228 Å²	228	53.3 Å²	53.3	100%	1	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-22.7	-177.8	-63.9	-76.2	0	0	0	114.6	G73	F71-G73 PolarHBondContact O-N 3.39Å
72	D	90.5	Very high	93	Very high	95 Å²	95	57.5 Å²	57.5	51%	0.508	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-2.9	174.3	69.9	-22.4	0	0	0	112.9	N70 S74	N70-D72 WeakPolarHBondContact CB-OD1 3.4Å; N70-D72 PolarHBondContact O-N 2.79Å; D72-S74 VanDerWaalsContact C-N 3.28Å; D72-S74 VanDerWaalsContact OD1-CB 3.23Å; D72-S74 WeakPolarHBondContact OD1-CB 3.43Å; D72-S74 PolarHBondContact OD1-N 2.95Å; D72-S74 PolarHBondContact OD1-OG 3.44Å; D72-S74 WeakPolarHBondContact OD2-CB 3.47Å; D72-S74 PolarHBondContact OD2-OG 2.91Å; D72-S74 VanDerWaalsContact OD2-OG 3.09Å
73	G	91.4	Very high	93.1	Very high	20 Å²	20	49.9 Å²	49.9	21%	0.206	25%	0.254	C	S	.	.	S	Bend	trans	82.9	1.8	-174.4	0	0	0	0	0	113.7	N70 F71	N70-G73 WeakPolarHBondContact O-CA 3.14Å; N70-G73 PolarHBondContact O-N 3.38Å; F71-G73 PolarHBondContact O-N 3.39Å
74	S	95.5	Very high	93	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.293	C	S	.	.			trans	-71.5	156.1	167.6	70.6	0	0	0	0	110.4	N70 D72 Y130 V131	N70-S74 WeakPolarHBondContact CB-O 3.46Å; N70-S74 WeakPolarHBondContact CB-OG 3.03Å; N70-S74 PolarHBondContact N-O 2.86Å; N70-S74 PolarHBondContact ND2-OG 2.97Å; D72-S74 VanDerWaalsContact C-N 3.28Å; D72-S74 VanDerWaalsContact OD1-CB 3.23Å; D72-S74 WeakPolarHBondContact OD1-CB 3.43Å; D72-S74 PolarHBondContact OD1-N 2.95Å; D72-S74 PolarHBondContact OD1-OG 3.44Å; D72-S74 WeakPolarHBondContact OD2-CB 3.47Å; D72-S74 PolarHBondContact OD2-OG 2.91Å; D72-S74 VanDerWaalsContact OD2-OG 3.09Å; S74-Y130 PolarHBondContact OG-OH 3.03Å; S74-V131 CarbonylContact C-O 3.48Å; S74-V131 WeakPolarHBondContact CA-O 3.39Å; S74-V131 VanDerWaalsContact CB-O 3.28Å; S74-V131 WeakPolarHBondContact CB-O 3.33Å
75	R	96	Very high	92.9	Very high	0 Å²	0	65 Å²	65	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	154.4	-179.2	67.7	176.6	-174.5	-71.5	6.1	111.4	L58 E64 I66 M68 V131 Q136	L58-R75 PolarHBondContact O-NH2 2.91Å; E64-R75 IonicContact OE1-CZ 3.73Å; E64-R75 IonicContact OE1-NE 2.93Å; E64-R75 PolarHBondContact OE1-NE 2.93Å; E64-R75 IonicContact OE1-NH2 2.71Å; E64-R75 PolarHBondContact OE1-NH2 2.83Å; E64-R75 IonicContact OE2-CZ 2.82Å; E64-R75 IonicContact OE2-NE 3.2Å; E64-R75 PolarHBondContact OE2-NE 2.73Å; E64-R75 IonicContact OE2-NH2 3.47Å; E64-R75 PolarHBondContact OE2-NH2 2.86Å; I66-R75 HydrophobicContact CG2-CB 4.25Å; M68-R75 CarbonylContact O-C 3.56Å; M68-R75 WeakPolarHBondContact O-CA 3.33Å; M68-R75 VanDerWaalsContact O-CB 3.23Å; M68-R75 WeakPolarHBondContact O-CB 3.29Å; R75-V131 HydrophobicContact CG-CB 4.02Å; R75-V131 HydrophobicContact CG-CG2 4.49Å; R75-V131 PolarHBondContact N-O 2.96Å; R75-V131 PolarHBondContact O-N 2.93Å; R75-Q136 VanDerWaalsContact NH2-OE1 3.15Å
76	V	97.6	Very high	92.7	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	133.1	163.8	-172.9	0	0	0	0	108.2	I67 M68 V129 Y130 L223 A226	I67-V76 HydrophobicContact CD1-CB 4.3Å; I67-V76 HydrophobicContact CD1-CG1 3.68Å; I67-V76 HydrophobicContact CG1-CB 3.96Å; I67-V76 HydrophobicContact CG1-CG1 3.8Å; I67-V76 VanDerWaalsContact CG1-O 3.26Å; I67-V76 WeakPolarHBondContact CG1-O 3.12Å; I67-V76 PolarHBondContact N-O 3.42Å; M68-V76 HydrophobicContact CB-CB 4.15Å; M68-V76 HydrophobicContact CB-CG2 4.46Å; M68-V76 PolarHBondContact N-O 2.82Å; M68-V76 VanDerWaalsContact N-O 3.14Å; M68-V76 PolarHBondContact O-N 3.47Å; V76-V129 WeakPolarHBondContact CA-O 3.44Å; V76-Y130 HydrophobicContact CG2-CD2 3.78Å; V76-Y130 HydrophobicContact CG2-CE2 4.25Å; V76-L223 HydrophobicContact CG1-CD1 3.44Å; V76-L223 VanDerWaalsContact CG1-CD1 3.44Å; V76-L223 HydrophobicContact CG2-CD1 4.44Å; V76-A226 HydrophobicContact CB-CB 3.91Å; V76-A226 HydrophobicContact CG1-CB 3.92Å; V76-A226 HydrophobicContact CG2-CB 4Å
77	T	97.1	Very high	92.4	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	141.3	-173.4	-161.1	0	0	0	0	110.3	L58 E64 N65 F128 V129 V131	L58-T77 HydrophobicContact CD2-CG2 3.92Å; E64-T77 HydrophobicContact CB-CG2 4.26Å; E64-T77 VanDerWaalsContact CB-OG1 3.27Å; E64-T77 WeakPolarHBondContact CB-OG1 3.21Å; E64-T77 WeakPolarHBondContact CG-OG1 3.18Å; E64-T77 WeakPolarHBondContact OE2-CB 3.16Å; E64-T77 WeakPolarHBondContact OE2-CG2 3.37Å; E64-T77 PolarHBondContact OE2-OG1 3.45Å; N65-T77 CarbonylContact O-C 3.53Å; N65-T77 WeakPolarHBondContact O-CA 3.49Å; N65-T77 PolarHBondContact O-OG1 2.94Å; T77-F128 CarbonylContact O-C 3.46Å; T77-F128 WeakPolarHBondContact O-CA 3.29Å; T77-V129 HydrophobicContact CG2-CB 4.07Å; T77-V129 PolarHBondContact N-O 2.92Å; T77-V129 PolarHBondContact O-N 3.32Å; T77-V131 HydrophobicContact CG2-CG2 4.33Å
78	E	96.5	Very high	92.2	Very high	24 Å²	24	64 Å²	64	11%	0.112	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	127.2	168.6	-177.3	178.2	-171.1	0	0	109.3	E64 N65 I67 R126 F128	E64-E78 CarbonylContact C-O 3.59Å; E64-E78 VanDerWaalsContact CA-O 3.3Å; E64-E78 WeakPolarHBondContact CA-O 3.35Å; N65-E78 HydrophobicContact CB-CB 4.26Å; N65-E78 PolarHBondContact N-O 3.27Å; N65-E78 PolarHBondContact O-N 2.86Å; I67-E78 HydrophobicContact CG2-CB 4.49Å; E78-R126 IonicContact OE1-CZ 2.8Å; E78-R126 IonicContact OE1-NE 3.78Å; E78-R126 PolarHBondContact OE1-NE 3.05Å; E78-R126 IonicContact OE1-NH2 3.75Å; E78-R126 PolarHBondContact OE1-NH2 3.01Å; E78-R126 IonicContact OE2-CZ 2.68Å; E78-R126 IonicContact OE2-NH2 3.51Å; E78-R126 PolarHBondContact OE2-NH2 3.41Å; E78-F128 HydrophobicContact CB-CD1 3.76Å; E78-F128 HydrophobicContact CB-CE1 3.58Å; E78-F128 HydrophobicContact CB-CZ 4.31Å; E78-F128 HydrophobicContact CG-CD1 4.24Å; E78-F128 HydrophobicContact CG-CE1 3.86Å; E78-F128 HydrophobicContact CG-CZ 4.09Å
79	L	95	Very high	92.1	Very high	3 Å²	3	62.7 Å²	62.7	2%	0.016	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	120.7	177.7	-170.3	64.9	0	0	0	109.9	L58 T81 G86 F89 I93 V127 V129	L58-L79 HydrophobicContact CD1-CD1 4.33Å; L79-T81 HydrophobicContact CG-CG2 4.45Å; L79-T81 PolarHBondContact O-N 3.15Å; L79-G86 WeakPolarHBondContact CD2-O 3.28Å; L79-F89 HydrophobicContact CD1-CB 4.04Å; L79-F89 HydrophobicContact CD2-CB 4.14Å; L79-I93 HydrophobicContact CD2-CD1 4.36Å; L79-V127 HydrophobicContact CB-CB 4.23Å; L79-V127 HydrophobicContact CB-CG1 4.29Å; L79-V127 HydrophobicContact CD2-CG1 4.35Å; L79-V127 PolarHBondContact N-O 2.88Å; L79-V129 HydrophobicContact CB-CG2 4.38Å
80	L	93.3	Very high	92	Very high	47 Å²	47	58 Å²	58	25%	0.246	29%	0.285	C	S	.	.			trans	-79.6	83.1	-177.6	-61.9	-179	0	0	0	110.7	H63 N65 N82 L83 G86	H63-L80 WeakPolarHBondContact O-CB 3.35Å; H63-L80 PolarHBondContact O-N 3.02Å; N65-L80 HydrophobicContact CB-CD2 4.29Å; L80-N82 WeakPolarHBondContact CB-OD1 3.35Å; L80-N82 PolarHBondContact O-N 3.14Å; L80-N82 PolarHBondContact O-OD1 2.82Å; L80-L83 HydrophobicContact CB-CD1 3.94Å; L80-L83 HydrophobicContact CB-CG 4.31Å; L80-L83 HydrophobicContact CD1-CD1 3.94Å; L80-L83 WeakPolarHBondContact O-CB 3.44Å; L80-L83 PolarHBondContact O-N 3.36Å; L80-G86 WeakPolarHBondContact O-CA 3.31Å
81	T	87.5	Confident	91.9	Very high	31 Å²	31	60.4 Å²	60.4	19%	0.19	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-5.1	-176.3	60.4	0	0	0	0	114.3	L79 L83 Q87 Y90 L121 V127	L79-T81 HydrophobicContact CG-CG2 4.45Å; L79-T81 PolarHBondContact O-N 3.15Å; T81-L83 VanDerWaalsContact C-N 3.3Å; T81-Q87 WeakPolarHBondContact O-CG 3.16Å; T81-Q87 PolarHBondContact O-NE2 3.32Å; T81-Y90 HydrophobicContact CG2-CG 4.42Å; T81-L121 HydrophobicContact CG2-CD2 3.72Å; T81-L121 WeakPolarHBondContact OG1-CD2 3.32Å; T81-V127 HydrophobicContact CG2-CB 4.46Å; T81-V127 HydrophobicContact CG2-CG2 4.13Å
82	N	86.5	Confident	92	Very high	126 Å²	126	55 Å²	55	67%	0.674	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-24.1	165.6	60.7	-44.9	0	0	0	112.4	L80	L80-N82 WeakPolarHBondContact CB-OD1 3.35Å; L80-N82 PolarHBondContact O-N 3.14Å; L80-N82 PolarHBondContact O-OD1 2.82Å
83	L	90	Very high	92.1	Very high	70 Å²	70	50.4 Å²	50.4	37%	0.366	24%	0.244	S	C	.	.	S	Bend	trans	-89.6	138.7	177.3	-62.4	173.1	0	0	0	110.6	R62 L80 T81 L85 G86 Q87	R62-L83 WeakPolarHBondContact O-CD1 3.49Å; L80-L83 HydrophobicContact CB-CD1 3.94Å; L80-L83 HydrophobicContact CB-CG 4.31Å; L80-L83 HydrophobicContact CD1-CD1 3.94Å; L80-L83 WeakPolarHBondContact O-CB 3.44Å; L80-L83 PolarHBondContact O-N 3.36Å; T81-L83 VanDerWaalsContact C-N 3.3Å; L83-L85 PolarHBondContact O-N 3.13Å; L83-G86 WeakPolarHBondContact O-CA 3.36Å; L83-G86 PolarHBondContact O-N 2.7Å; L83-Q87 PolarHBondContact O-N 3.32Å
84	R	88.5	Confident	92	Very high	229 Å²	229	50.3 Å²	50.3	86%	0.864	24%	0.24	S	C	*	.	H	α-helix	trans	-53.4	-40.1	178.3	-69.5	-171.7	177.1	-147.1	0.3	113.4	Q87 S88	R84-Q87 PolarHBondContact O-N 2.92Å; R84-S88 PolarHBondContact O-N 3.21Å
85	L	90.2	Very high	91.6	Very high	114 Å²	114	53.6 Å²	53.6	60%	0.597	26%	0.26	S	S	*	.	H	α-helix	trans	-64.8	-43.2	175.9	-69.4	177.6	0	0	0	111.5	H63 L83 S88 F89	H63-L85 HydrophobicContact CB-CB 3.86Å; L83-L85 PolarHBondContact O-N 3.13Å; L85-S88 PolarHBondContact O-N 2.87Å; L85-F89 WeakPolarHBondContact O-CD2 3.5Å; L85-F89 PolarHBondContact O-N 2.72Å
86	G	90.2	Very high	91.3	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.6	-41.4	176.9	0	0	0	0	0	112.1	L79 L80 L83 F89 Y90	L79-G86 WeakPolarHBondContact CD2-O 3.28Å; L80-G86 WeakPolarHBondContact O-CA 3.31Å; L83-G86 WeakPolarHBondContact O-CA 3.36Å; L83-G86 PolarHBondContact O-N 2.7Å; G86-F89 PolarHBondContact O-N 3.41Å; G86-Y90 WeakPolarHBondContact O-CB 3.42Å; G86-Y90 PolarHBondContact O-N 2.76Å
87	Q	88.5	Confident	90.9	Very high	97 Å²	97	54.4 Å²	54.4	45%	0.453	26%	0.264	S	S	.	.	H	α-helix	trans	-60.6	-45.7	173	-67.1	-166.7	-13	0	0	112.5	T81 L83 R84 F89 Y90 E91	T81-Q87 WeakPolarHBondContact O-CG 3.16Å; T81-Q87 PolarHBondContact O-NE2 3.32Å; L83-Q87 PolarHBondContact O-N 3.32Å; R84-Q87 PolarHBondContact O-N 2.92Å; Q87-F89 VanDerWaalsContact C-N 3.3Å; Q87-F89 PolarHBondContact O-N 3.14Å; Q87-Y90 CarbonylContact O-C 3.07Å; Q87-Y90 WeakPolarHBondContact O-CB 3.48Å; Q87-Y90 PolarHBondContact O-N 3.41Å; Q87-Y90 VanDerWaalsContact O-N 3.09Å; Q87-E91 WeakPolarHBondContact O-CG 3.46Å; Q87-E91 PolarHBondContact O-N 3.13Å
88	S	90.6	Very high	90.4	Very high	56 Å²	56	54.9 Å²	54.9	39%	0.392	27%	0.268	S	S	.	.	H	α-helix	trans	-61.3	-39.5	178.3	179.4	0	0	0	0	112.3	R84 L85 R92	R84-S88 PolarHBondContact O-N 3.21Å; L85-S88 PolarHBondContact O-N 2.87Å; S88-R92 WeakPolarHBondContact O-CG 3.21Å; S88-R92 PolarHBondContact O-N 3.12Å
89	F	93.5	Very high	89.9	Confident	26 Å²	26	59.1 Å²	59.1	11%	0.114	29%	0.291	C	S	.	.	H	α-helix	trans	-66.6	-41.5	172.8	-75.9	-63.1	0	0	0	111.9	L58 P59 H63 L79 L85 G86 Q87 E91 R92 I93	L58-F89 HydrophobicContact CD1-CB 3.93Å; L58-F89 HydrophobicContact CD1-CD1 3.54Å; L58-F89 HydrophobicContact CD1-CD2 3.76Å; L58-F89 HydrophobicContact CD1-CE1 3.92Å; L58-F89 HydrophobicContact CD1-CE2 4.13Å; L58-F89 HydrophobicContact CD1-CG 3.47Å; L58-F89 VanDerWaalsContact CD1-CG 3.47Å; L58-F89 HydrophobicContact CD1-CZ 4.2Å; P59-F89 HydrophobicContact CG-CZ 4.38Å; H63-F89 AromaticContact CD2-CD2 3.38Å; H63-F89 WeakPolarHBondContact CD2-CD2 3.32Å; H63-F89 AromaticContact CD2-CE2 3.49Å; H63-F89 VanDerWaalsContact CD2-CE2 3.49Å; H63-F89 WeakPolarHBondContact CD2-CE2 3.38Å; H63-F89 AromaticContact CE1-CE2 3.5Å; H63-F89 AromaticContact CG-CD2 3.88Å; H63-F89 AromaticContact CG-CE2 3.78Å; H63-F89 AromaticContact ND1-CE2 3.78Å; H63-F89 AromaticContact NE2-CD2 3.6Å; H63-F89 AromaticContact NE2-CE2 3.29Å; H63-F89 VanDerWaalsContact NE2-CE2 3.29Å; H63-F89 WeakPolarHBondContact NE2-CE2 3.16Å; H63-F89 AromaticContact NE2-CZ 3.96Å; L79-F89 HydrophobicContact CD1-CB 4.04Å; L79-F89 HydrophobicContact CD2-CB 4.14Å; L85-F89 WeakPolarHBondContact O-CD2 3.5Å; L85-F89 PolarHBondContact O-N 2.72Å; G86-F89 PolarHBondContact O-N 3.41Å; Q87-F89 VanDerWaalsContact C-N 3.3Å; Q87-F89 PolarHBondContact O-N 3.14Å; F89-E91 PolarHBondContact O-N 3.22Å; F89-R92 PolarHBondContact O-N 3.4Å; F89-I93 VanDerWaalsContact O-CG1 3.27Å; F89-I93 WeakPolarHBondContact O-CG1 3.35Å; F89-I93 PolarHBondContact O-N 3.4Å
90	Y	91.9	Very high	89.4	Confident	14 Å²	14	62.6 Å²	62.6	6%	0.055	31%	0.31	C	S	.	.	H	α-helix	trans	-60.1	-44.8	176.7	175	-115.9	0	0	0	111.3	T81 G86 Q87 R92 I93 S94 N119 L121 V127 I143	T81-Y90 HydrophobicContact CG2-CG 4.42Å; G86-Y90 WeakPolarHBondContact O-CB 3.42Å; G86-Y90 PolarHBondContact O-N 2.76Å; Q87-Y90 CarbonylContact O-C 3.07Å; Q87-Y90 WeakPolarHBondContact O-CB 3.48Å; Q87-Y90 PolarHBondContact O-N 3.41Å; Q87-Y90 VanDerWaalsContact O-N 3.09Å; Y90-R92 VanDerWaalsContact C-N 3.29Å; Y90-R92 PolarHBondContact O-N 3.31Å; Y90-I93 PolarHBondContact O-N 2.82Å; Y90-S94 WeakPolarHBondContact O-CB 3.49Å; Y90-S94 PolarHBondContact O-N 3.23Å; Y90-N119 HydrophobicContact CD1-CB 4.4Å; Y90-N119 HydrophobicContact CE1-CB 4.01Å; Y90-N119 WeakPolarHBondContact CE1-O 3.32Å; Y90-L121 HydrophobicContact CD1-CB 4.48Å; Y90-L121 HydrophobicContact CE1-CB 3.95Å; Y90-L121 HydrophobicContact CE1-CD1 3.96Å; Y90-L121 HydrophobicContact CE2-CD1 4.07Å; Y90-L121 WeakPolarHBondContact OH-CD1 3.3Å; Y90-V127 HydrophobicContact CD2-CB 4.37Å; Y90-V127 HydrophobicContact CD2-CG1 3.93Å; Y90-V127 HydrophobicContact CD2-CG2 3.71Å; Y90-V127 HydrophobicContact CE2-CG1 4.28Å; Y90-V127 HydrophobicContact CE2-CG2 3.67Å; Y90-V127 HydrophobicContact CG-CG2 4.5Å; Y90-I143 HydrophobicContact CE2-CD1 4.06Å
91	E	89.7	Confident	89.1	Confident	89 Å²	89	63 Å²	63	42%	0.416	31%	0.311	S	S	.	.	H	α-helix	trans	-57.8	-42.3	177.3	-73.7	173.7	172	0	0	112	Q87 F89 T95 N119	Q87-E91 WeakPolarHBondContact O-CG 3.46Å; Q87-E91 PolarHBondContact O-N 3.13Å; F89-E91 PolarHBondContact O-N 3.22Å; E91-T95 WeakPolarHBondContact O-CB 3.3Å; E91-T95 PolarHBondContact O-N 3.09Å; E91-T95 PolarHBondContact O-OG1 3.26Å; E91-N119 HydrophobicContact CG-CB 4.21Å
92	R	91.3	Very high	88.9	Confident	113 Å²	113	63 Å²	63	43%	0.426	32%	0.318	S	S	.	.	H	α-helix	trans	-67.2	-42.4	177.4	-67.8	172.3	66	-167.3	1.4	112	V56 S88 F89 Y90 L96	V56-R92 HydrophobicContact CG1-CB 4.31Å; V56-R92 HydrophobicContact CG2-CB 4.04Å; S88-R92 WeakPolarHBondContact O-CG 3.21Å; S88-R92 PolarHBondContact O-N 3.12Å; F89-R92 PolarHBondContact O-N 3.4Å; Y90-R92 VanDerWaalsContact C-N 3.29Å; Y90-R92 PolarHBondContact O-N 3.31Å; R92-L96 PolarHBondContact O-N 3.22Å
93	I	92.4	Very high	88.5	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-70.5	-40.6	178.1	-64.2	167.9	0	0	0	110.7	V56 L79 F89 Y90 T95 L96 M97 V129 V138 C141	V56-I93 HydrophobicContact CB-CG1 4.41Å; V56-I93 HydrophobicContact CG1-CG1 3.95Å; L79-I93 HydrophobicContact CD2-CD1 4.36Å; F89-I93 VanDerWaalsContact O-CG1 3.27Å; F89-I93 WeakPolarHBondContact O-CG1 3.35Å; F89-I93 PolarHBondContact O-N 3.4Å; Y90-I93 PolarHBondContact O-N 2.82Å; I93-T95 VanDerWaalsContact C-N 3.34Å; I93-T95 PolarHBondContact O-N 3.46Å; I93-L96 CarbonylContact O-C 3.51Å; I93-L96 WeakPolarHBondContact O-CA 3.28Å; I93-L96 WeakPolarHBondContact O-CB 3.11Å; I93-L96 PolarHBondContact O-N 2.64Å; I93-L96 VanDerWaalsContact O-N 3.11Å; I93-M97 HydrophobicContact CG2-CG 4.3Å; I93-M97 HydrophobicContact CG2-SD 4.02Å; I93-M97 WeakPolarHBondContact O-CG 3.48Å; I93-M97 PolarHBondContact O-N 2.66Å; I93-V129 HydrophobicContact CD1-CG1 4.09Å; I93-V129 HydrophobicContact CD1-CG2 3.82Å; I93-V138 HydrophobicContact CD1-CG1 4.28Å; I93-V138 HydrophobicContact CD1-CG2 4.06Å; I93-V138 HydrophobicContact CG1-CG1 4.25Å; I93-V138 HydrophobicContact CG1-CG2 4.33Å; I93-V138 HydrophobicContact CG2-CG1 4.39Å; I93-C141 HydrophobicContact CG2-CB 3.8Å
94	S	90.1	Very high	87.3	Confident	18 Å²	18	62.4 Å²	62.4	13%	0.126	31%	0.306	C	S	.	.	H	α-helix	trans	-60.1	-45.3	175	178.2	0	0	0	0	110.6	Y90 L96 M97 S98	Y90-S94 WeakPolarHBondContact O-CB 3.49Å; Y90-S94 PolarHBondContact O-N 3.23Å; S94-L96 VanDerWaalsContact C-N 3.3Å; S94-L96 PolarHBondContact O-N 3.02Å; S94-M97 PolarHBondContact O-N 3.38Å; S94-S98 WeakPolarHBondContact O-CB 3.32Å; S94-S98 PolarHBondContact O-N 3.27Å; S94-S98 PolarHBondContact O-OG 3.41Å
95	T	88.2	Confident	86.1	Confident	68 Å²	68	56.4 Å²	56.4	42%	0.417	29%	0.294	S	S	.	.	H	α-helix	trans	-58.3	-45.3	173	-55.2	0	0	0	0	110.6	E91 I93 S98 L99	E91-T95 WeakPolarHBondContact O-CB 3.3Å; E91-T95 PolarHBondContact O-N 3.09Å; E91-T95 PolarHBondContact O-OG1 3.26Å; I93-T95 VanDerWaalsContact C-N 3.34Å; I93-T95 PolarHBondContact O-N 3.46Å; T95-S98 WeakPolarHBondContact CA-OG 3.47Å; T95-S98 PolarHBondContact O-N 2.78Å; T95-S98 PolarHBondContact O-OG 2.97Å; T95-L99 WeakPolarHBondContact O-CG 3.45Å; T95-L99 PolarHBondContact O-N 3.18Å
96	L	89	Confident	84.2	Confident	13 Å²	13	55.4 Å²	55.4	7%	0.068	30%	0.295	C	S	.	.	H	α-helix	trans	-61.3	-44.9	176.6	-178.7	61.8	0	0	0	112.7	P54 V56 R92 I93 S94 S98 L99 W209	P54-L96 HydrophobicContact CB-CD1 4.17Å; P54-L96 HydrophobicContact CG-CD1 3.8Å; P54-L96 WeakPolarHBondContact O-CD1 3.48Å; V56-L96 HydrophobicContact CB-CD2 4.4Å; V56-L96 HydrophobicContact CG2-CB 4.39Å; V56-L96 HydrophobicContact CG2-CD2 4.05Å; R92-L96 PolarHBondContact O-N 3.22Å; I93-L96 CarbonylContact O-C 3.51Å; I93-L96 WeakPolarHBondContact O-CA 3.28Å; I93-L96 WeakPolarHBondContact O-CB 3.11Å; I93-L96 PolarHBondContact O-N 2.64Å; I93-L96 VanDerWaalsContact O-N 3.11Å; S94-L96 VanDerWaalsContact C-N 3.3Å; S94-L96 PolarHBondContact O-N 3.02Å; L96-S98 VanDerWaalsContact C-N 3.34Å; L96-S98 PolarHBondContact O-N 3.34Å; L96-L99 PolarHBondContact O-N 2.74Å; L96-W209 HydrophobicContact CD2-CH2 3.55Å; L96-W209 HydrophobicContact CD2-CZ2 4.26Å; L96-W209 HydrophobicContact CD2-CZ3 4.08Å; L96-W209 HydrophobicContact CG-CH2 3.83Å; L96-W209 HydrophobicContact CG-CZ2 4.04Å
97	M	89.5	Confident	82.3	Confident	4 Å²	4	61 Å²	61	2%	0.02	33%	0.334	C	S	.	.	H	α-helix	trans	-64.1	-38.6	177.2	-70.3	172.1	67.4	0	0	111.9	I93 S94 L99 D100 L101 C141 I143 R207 W209	I93-M97 HydrophobicContact CG2-CG 4.3Å; I93-M97 HydrophobicContact CG2-SD 4.02Å; I93-M97 WeakPolarHBondContact O-CG 3.48Å; I93-M97 PolarHBondContact O-N 2.66Å; S94-M97 PolarHBondContact O-N 3.38Å; M97-L99 PolarHBondContact O-N 2.81Å; M97-D100 PolarHBondContact O-N 3.3Å; M97-D100 VanDerWaalsContact O-N 3.12Å; M97-L101 PolarHBondContact O-N 3.41Å; M97-C141 HydrophobicContact CE-CB 4.42Å; M97-C141 HydrophobicContact CG-CB 4.34Å; M97-C141 HydrophobicContact SD-CB 3.61Å; M97-C141 PolarHBondContact SD-SG 3.34Å; M97-I143 HydrophobicContact CE-CD1 4.36Å; M97-I143 HydrophobicContact CE-CG1 4.46Å; M97-R207 HydrophobicContact CE-CB 3.83Å; M97-W209 HydrophobicContact CE-CB 3.94Å; M97-W209 HydrophobicContact CG-CB 3.92Å; M97-W209 HydrophobicContact CG-CD2 3.99Å; M97-W209 HydrophobicContact CG-CE3 4.11Å; M97-W209 HydrophobicContact CG-CG 3.92Å
98	S	86.8	Confident	80.3	Confident	11 Å²	11	63.9 Å²	63.9	8%	0.077	35%	0.347	C	S	.	.	H	α-helix	trans	-65.5	-24.1	-179.1	69.4	0	0	0	0	113.6	S94 T95 L96 D100 G102 Y103	S94-S98 WeakPolarHBondContact O-CB 3.32Å; S94-S98 PolarHBondContact O-N 3.27Å; S94-S98 PolarHBondContact O-OG 3.41Å; T95-S98 WeakPolarHBondContact CA-OG 3.47Å; T95-S98 PolarHBondContact O-N 2.78Å; T95-S98 PolarHBondContact O-OG 2.97Å; L96-S98 VanDerWaalsContact C-N 3.34Å; L96-S98 PolarHBondContact O-N 3.34Å; S98-D100 VanDerWaalsContact C-N 3.31Å; S98-G102 WeakPolarHBondContact CA-O 3.49Å; S98-G102 WeakPolarHBondContact O-CA 3.26Å; S98-G102 PolarHBondContact O-N 2.83Å; S98-Y103 WeakPolarHBondContact OG-CE1 3.29Å
99	L	84.9	Confident	78.1	Confident	112 Å²	112	68.7 Å²	68.7	59%	0.586	36%	0.364	S	S	*	.	H	α-helix	trans	-68.7	-31	174.1	-66.7	170.2	0	0	0	112.5	P54 T95 L96 M97	P54-L99 HydrophobicContact CG-CD1 3.44Å; P54-L99 VanDerWaalsContact CG-CD1 3.44Å; T95-L99 WeakPolarHBondContact O-CG 3.45Å; T95-L99 PolarHBondContact O-N 3.18Å; L96-L99 PolarHBondContact O-N 2.74Å; M97-L99 PolarHBondContact O-N 2.81Å
100	D	85.1	Confident	75.7	Confident	77 Å²	77	73.6 Å²	73.6	41%	0.412	40%	0.401	S	S	.	.	H	α-helix	trans	-97.4	-36.5	-177.9	-84.6	16.3	0	0	0	112.9	M97 S98 W209 R215	M97-D100 PolarHBondContact O-N 3.3Å; M97-D100 VanDerWaalsContact O-N 3.12Å; S98-D100 VanDerWaalsContact C-N 3.31Å; D100-W209 PolarHBondContact OD2-NE1 3.36Å; D100-R215 IonicContact OD2-NH2 2.73Å; D100-R215 PolarHBondContact OD2-NH2 2.58Å
101	L	87	Confident	73.3	Confident	54 Å²	54	78.5 Å²	78.5	28%	0.283	43%	0.428	S	S	.	.	H	α-helix	trans	-111.4	-6.6	-171.5	-60.3	-179.2	0	0	0	113.7	M97 W209	M97-L101 PolarHBondContact O-N 3.41Å; L101-W209 HydrophobicContact CD1-CB 3.87Å; L101-W209 HydrophobicContact CD1-CG 4.35Å
102	G	83.6	Confident	70.8	Confident	33 Å²	33	82.2 Å²	82.2	34%	0.34	45%	0.45	S	S	.	.			trans	72.7	176.1	-167	0	0	0	0	0	112.9	S98 R207	S98-G102 WeakPolarHBondContact CA-O 3.49Å; S98-G102 WeakPolarHBondContact O-CA 3.26Å; S98-G102 PolarHBondContact O-N 2.83Å; G102-R207 PolarHBondContact O-NH1 3.37Å
103	Y	77	Confident	68.3	Low	142 Å²	142	85 Å²	85	56%	0.557	47%	0.468	S	S	*	.			trans	-76.3	153.7	179.8	-66.8	-78.2	0	0	0	112.3	S98 L117 R207	S98-Y103 WeakPolarHBondContact OG-CE1 3.29Å; Y103-L117 HydrophobicContact CD1-CD2 3.78Å; Y103-L117 HydrophobicContact CE1-CD2 3.4Å; Y103-L117 VanDerWaalsContact CE1-CD2 3.4Å; Y103-R207 PolarHBondContact O-NH2 2.7Å
104	D	66.3	Low	65.6	Low	41 Å²	41	95.3 Å²	95.3	22%	0.219	51%	0.508	C	S	.	.	S	Bend	trans	-90.7	-15.1	-174.3	-164.7	42	0	0	0	116.2	R206 R207	D104-R206 IonicContact OD1-CZ 2.72Å; D104-R206 IonicContact OD1-NE 3.87Å; D104-R206 IonicContact OD1-NH2 3.67Å; D104-R206 PolarHBondContact OD1-NH2 3.33Å; D104-R206 IonicContact OD2-CZ 3.35Å; D104-R206 VanDerWaalsContact OD2-CZ 3.28Å; D104-R206 IonicContact OD2-NE 3.14Å; D104-R206 PolarHBondContact OD2-NE 2.93Å; D104-R206 IonicContact OD2-NH2 3.29Å; D104-R206 PolarHBondContact OD2-NH2 3.03Å; D104-R207 IonicContact OD1-CZ 2.98Å; D104-R207 IonicContact OD1-NE 3.88Å; D104-R207 PolarHBondContact OD1-NE 2.89Å; D104-R207 IonicContact OD1-NH2 3.39Å; D104-R207 PolarHBondContact OD1-NH2 3.38Å; D104-R207 IonicContact OD2-NE 3.28Å
105	V	62.7	Low	63	Low	103 Å²	103	99.7 Å²	99.7	62%	0.624	53%	0.534	S	S	*	.	S	Bend	trans	-111	120.9	178.3	-176.3	0	0	0	0	105.1	S107	V105-S107 PolarHBondContact O-N 3.49Å; V105-S107 VanDerWaalsContact O-N 3.08Å
106	P	50.5	Low	60.6	Low	93 Å²	93	104 Å²	104	60%	0.604	55%	0.546	S	S	*	.			trans	-55	121.2	160.2	-8.9	22.4	0	0	0	104.2	E108	P106-E108 HydrophobicContact CB-CG 4.37Å; P106-E108 PolarHBondContact O-N 3.22Å
107	S	49.6	Very low	58.3	Low	117 Å²	117	107.8 Å²	107.8	82%	0.818	57%	0.567	S	S	*	*			trans	-63.8	73.4	171.4	32.5	0	0	0	0	108.5	V105	V105-S107 PolarHBondContact O-N 3.49Å; V105-S107 VanDerWaalsContact O-N 3.08Å
108	E	46.6	Very low	56.1	Low	158 Å²	158	111 Å²	111	74%	0.738	59%	0.589	S	S	*	*			trans	-63.7	129.1	161.9	-63.8	-67.8	141.6	0	0	105.5	P106	P106-E108 HydrophobicContact CB-CG 4.37Å; P106-E108 PolarHBondContact O-N 3.22Å
109	E	44	Very low	54.4	Low	157 Å²	157	112.1 Å²	112.1	73%	0.734	59%	0.594	S	S	*	*			trans	87.9	93.4	179	-52.6	-176.3	-172.8	0	0	116.8	N111	E109-N111 PolarHBondContact O-N 2.7Å
110	S	43	Very low	53.2	Low	128 Å²	128	111.7 Å²	111.7	90%	0.895	60%	0.597	S	S	*	*			trans	-50.1	32.7	159.4	-47.8	0	0	0	0	116.6	L112	S110-L112 PolarHBondContact O-N 2.8Å
111	N	41.7	Very low	52.3	Low	118 Å²	118	109.4 Å²	109.4	63%	0.631	58%	0.584	S	S	*	*			trans	-93.4	90.5	174.8	-71.6	-39.1	0	0	0	110.2	E109 H113	E109-N111 PolarHBondContact O-N 2.7Å; N111-H113 VanDerWaalsContact C-N 3.25Å; N111-H113 PolarHBondContact O-N 2.93Å
112	L	36.6	Very low	51.7	Low	166 Å²	166	110.5 Å²	110.5	87%	0.869	59%	0.588	S	S	*	*			trans	-45.5	75.4	166.2	-172.8	75.6	0	0	0	112.7	S110	S110-L112 PolarHBondContact O-N 2.8Å
113	H	39.7	Very low	51.2	Low	173 Å²	173	114.7 Å²	114.7	80%	0.801	61%	0.609	S	S	*	*	S	Bend	trans	-162.7	94.5	166.7	-104.5	-76	0	0	0	108.8	N111 V115	N111-H113 VanDerWaalsContact C-N 3.25Å; N111-H113 PolarHBondContact O-N 2.93Å; H113-V115 PolarHBondContact O-N 2.98Å
114	Y	34.6	Very low	51.4	Low	216 Å²	216	110.9 Å²	110.9	85%	0.847	60%	0.598	S	S	*	*			trans	22.9	61.6	164.3	-164.7	-97.8	0	0	0	113	K116	Y114-K116 HydrophobicContact CD1-CB 4.39Å; Y114-K116 HydrophobicContact CE1-CB 4.19Å; Y114-K116 PolarHBondContact O-N 2.73Å
115	V	36.5	Very low	52.6	Low	110 Å²	110	110.9 Å²	110.9	67%	0.667	60%	0.595	S	S	*	*			trans	-71.9	91.6	166.5	-178.5	0	0	0	0	101.3	H113 L117	H113-V115 PolarHBondContact O-N 2.98Å; V115-L117 PolarHBondContact O-N 3.39Å
116	K	38.1	Very low	54	Low	157 Å²	157	109.2 Å²	109.2	68%	0.683	58%	0.578	S	S	*	*			trans	-41	98.8	158.3	-177.9	178.8	-171.3	-180	0	102.5	Y114 S118	Y114-K116 HydrophobicContact CD1-CB 4.39Å; Y114-K116 HydrophobicContact CE1-CB 4.19Å; Y114-K116 PolarHBondContact O-N 2.73Å; K116-S118 VanDerWaalsContact O-CA 3.3Å; K116-S118 WeakPolarHBondContact O-CA 3.34Å; K116-S118 WeakPolarHBondContact O-CB 3.48Å; K116-S118 PolarHBondContact O-N 3.32Å
117	L	40.1	Very low	56.2	Low	94 Å²	94	104.8 Å²	104.8	49%	0.492	55%	0.549	S	S	.	.			trans	-51.7	93.9	-174.6	175	74.8	0	0	0	103.1	Y103 V115 N119	Y103-L117 HydrophobicContact CD1-CD2 3.78Å; Y103-L117 HydrophobicContact CE1-CD2 3.4Å; Y103-L117 VanDerWaalsContact CE1-CD2 3.4Å; V115-L117 PolarHBondContact O-N 3.39Å; L117-N119 PolarHBondContact O-N 3.28Å
118	S	43.4	Very low	58.5	Low	71 Å²	71	99.2 Å²	99.2	50%	0.497	51%	0.51	S	S	.	.			trans	-78.6	98	-169.1	61.5	0	0	0	0	98.3	K116 T120	K116-S118 VanDerWaalsContact O-CA 3.3Å; K116-S118 WeakPolarHBondContact O-CA 3.34Å; K116-S118 WeakPolarHBondContact O-CB 3.48Å; K116-S118 PolarHBondContact O-N 3.32Å; S118-T120 WeakPolarHBondContact CB-OG1 3.19Å; S118-T120 PolarHBondContact O-N 3.48Å; S118-T120 PolarHBondContact O-OG1 3.34Å; S118-T120 PolarHBondContact OG-OG1 2.88Å
119	N	51.7	Low	60.9	Low	34 Å²	34	91.7 Å²	91.7	18%	0.182	48%	0.475	C	S	.	.			trans	-64.9	41.6	162.4	-70.3	-28.7	0	0	0	107.6	Y90 E91 L117 L121	Y90-N119 HydrophobicContact CD1-CB 4.4Å; Y90-N119 HydrophobicContact CE1-CB 4.01Å; Y90-N119 WeakPolarHBondContact CE1-O 3.32Å; E91-N119 HydrophobicContact CG-CB 4.21Å; L117-N119 PolarHBondContact O-N 3.28Å; N119-L121 PolarHBondContact O-N 3.4Å
120	T	59	Low	63.5	Low	104 Å²	104	85.1 Å²	85.1	64%	0.638	44%	0.443	S	S	*	.			trans	-67.9	86.3	172.7	37.9	0	0	0	0	104.6	S118 H122	S118-T120 WeakPolarHBondContact CB-OG1 3.19Å; S118-T120 PolarHBondContact O-N 3.48Å; S118-T120 PolarHBondContact O-OG1 3.34Å; S118-T120 PolarHBondContact OG-OG1 2.88Å; T120-H122 PolarHBondContact O-N 3.43Å
121	L	67.1	Low	66.1	Low	28 Å²	28	79 Å²	79	15%	0.147	40%	0.401	C	S	.	.			trans	-50.4	127.9	166.6	-170.5	80.4	0	0	0	107.6	T81 Y90 N119 W125 V127 I143	T81-L121 HydrophobicContact CG2-CD2 3.72Å; T81-L121 WeakPolarHBondContact OG1-CD2 3.32Å; Y90-L121 HydrophobicContact CD1-CB 4.48Å; Y90-L121 HydrophobicContact CE1-CB 3.95Å; Y90-L121 HydrophobicContact CE1-CD1 3.96Å; Y90-L121 HydrophobicContact CE2-CD1 4.07Å; Y90-L121 WeakPolarHBondContact OH-CD1 3.3Å; N119-L121 PolarHBondContact O-N 3.4Å; L121-W125 HydrophobicContact CD1-CB 3.84Å; L121-W125 HydrophobicContact CD1-CE3 3.79Å; L121-W125 HydrophobicContact CD2-CB 4.35Å; L121-W125 WeakPolarHBondContact CD2-O 3.37Å; L121-W125 HydrophobicContact CG-CB 3.86Å; L121-W125 HydrophobicContact CG-CE3 4.32Å; L121-V127 HydrophobicContact CD1-CG2 3.7Å; L121-V127 HydrophobicContact CD2-CG2 3.71Å; L121-V127 HydrophobicContact CG-CG2 4.39Å; L121-I143 HydrophobicContact CD1-CG2 4.21Å
122	H	74.1	Confident	68.6	Low	77 Å²	77	76.5 Å²	76.5	36%	0.356	38%	0.384	S	S	.	.			trans	-55.3	140.4	173.4	-169.5	-89.9	0	0	0	109.1	T120 D124 W125	T120-H122 PolarHBondContact O-N 3.43Å; H122-D124 IonicContact CE1-OD2 2.76Å; H122-D124 PolarHBondContact CE1-OD2 3.33Å; H122-D124 PolarHBondContact ND1-N 3.32Å; H122-D124 IonicContact ND1-OD2 2.64Å; H122-D124 PolarHBondContact O-N 2.85Å; H122-D124 VanDerWaalsContact O-N 3.07Å; H122-W125 HydrophobicContact CB-CB 4.45Å; H122-W125 HydrophobicContact CB-CD2 3.41Å; H122-W125 VanDerWaalsContact CB-CD2 3.41Å; H122-W125 VanDerWaalsContact CB-CE2 3.46Å; H122-W125 HydrophobicContact CB-CE3 3.81Å; H122-W125 HydrophobicContact CB-CG 3.73Å; H122-W125 HydrophobicContact CB-CH2 4.22Å; H122-W125 HydrophobicContact CB-CZ2 3.88Å; H122-W125 HydrophobicContact CB-CZ3 4.21Å; H122-W125 WeakPolarHBondContact O-CB 3.41Å; H122-W125 PolarHBondContact O-N 2.84Å
123	P	73.5	Confident	71.1	Confident	121 Å²	121	70.2 Å²	70.2	79%	0.786	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-25.5	-174.3	21.9	-34.8	0	0	0	114.1
124	D	81.4	Confident	73.4	Confident	62 Å²	62	73.3 Å²	73.3	33%	0.332	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-10.4	176.5	-72.8	-57.4	0	0	0	114.5	H122 K151	H122-D124 IonicContact CE1-OD2 2.76Å; H122-D124 PolarHBondContact CE1-OD2 3.33Å; H122-D124 PolarHBondContact ND1-N 3.32Å; H122-D124 IonicContact ND1-OD2 2.64Å; H122-D124 PolarHBondContact O-N 2.85Å; H122-D124 VanDerWaalsContact O-N 3.07Å; D124-K151 IonicContact OD1-NZ 3.27Å; D124-K151 PolarHBondContact OD1-NZ 3.29Å; D124-K151 IonicContact OD2-NZ 3.04Å
125	W	90	Very high	76.1	Confident	42 Å²	42	66 Å²	66	16%	0.159	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	141.2	-178.7	-62.8	-9.3	0	0	0	110.7	L121 H122 I143 R206	L121-W125 HydrophobicContact CD1-CB 3.84Å; L121-W125 HydrophobicContact CD1-CE3 3.79Å; L121-W125 HydrophobicContact CD2-CB 4.35Å; L121-W125 WeakPolarHBondContact CD2-O 3.37Å; L121-W125 HydrophobicContact CG-CB 3.86Å; L121-W125 HydrophobicContact CG-CE3 4.32Å; H122-W125 HydrophobicContact CB-CB 4.45Å; H122-W125 HydrophobicContact CB-CD2 3.41Å; H122-W125 VanDerWaalsContact CB-CD2 3.41Å; H122-W125 VanDerWaalsContact CB-CE2 3.46Å; H122-W125 HydrophobicContact CB-CE3 3.81Å; H122-W125 HydrophobicContact CB-CG 3.73Å; H122-W125 HydrophobicContact CB-CH2 4.22Å; H122-W125 HydrophobicContact CB-CZ2 3.88Å; H122-W125 HydrophobicContact CB-CZ3 4.21Å; H122-W125 WeakPolarHBondContact O-CB 3.41Å; H122-W125 PolarHBondContact O-N 2.84Å; W125-I143 HydrophobicContact CB-CG2 4.09Å; W125-I143 HydrophobicContact CD2-CG2 4.45Å; W125-I143 HydrophobicContact CE3-CG2 4.33Å; W125-I143 HydrophobicContact CG-CG2 4.38Å; W125-R206 VanDerWaalsContact CZ2-CD 3.45Å
126	R	93.4	Very high	78.8	Confident	68 Å²	68	62.5 Å²	62.5	26%	0.257	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	138.4	-179.7	-64	175.3	68.5	-171.9	-1.9	108.9	E78 F128 I143 V144 L231	E78-R126 IonicContact OE1-CZ 2.8Å; E78-R126 IonicContact OE1-NE 3.78Å; E78-R126 PolarHBondContact OE1-NE 3.05Å; E78-R126 IonicContact OE1-NH2 3.75Å; E78-R126 PolarHBondContact OE1-NH2 3.01Å; E78-R126 IonicContact OE2-CZ 2.68Å; E78-R126 IonicContact OE2-NH2 3.51Å; E78-R126 PolarHBondContact OE2-NH2 3.41Å; R126-F128 HydrophobicContact CB-CD2 4.45Å; R126-F128 HydrophobicContact CB-CE2 3.71Å; R126-F128 HydrophobicContact CB-CZ 4.41Å; R126-I143 WeakPolarHBondContact O-CA 3.49Å; R126-V144 HydrophobicContact CB-CG2 4.24Å; R126-V144 PolarHBondContact N-O 3.37Å; R126-V144 PolarHBondContact O-N 3.31Å; R126-L231 PolarHBondContact NH1-O 3.23Å
127	V	95.4	Very high	81.5	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	123	-174.4	-178	0	0	0	0	108.2	L79 T81 Y90 L121 V129 I143	L79-V127 HydrophobicContact CB-CB 4.23Å; L79-V127 HydrophobicContact CB-CG1 4.29Å; L79-V127 HydrophobicContact CD2-CG1 4.35Å; L79-V127 PolarHBondContact N-O 2.88Å; T81-V127 HydrophobicContact CG2-CB 4.46Å; T81-V127 HydrophobicContact CG2-CG2 4.13Å; Y90-V127 HydrophobicContact CD2-CB 4.37Å; Y90-V127 HydrophobicContact CD2-CG1 3.93Å; Y90-V127 HydrophobicContact CD2-CG2 3.71Å; Y90-V127 HydrophobicContact CE2-CG1 4.28Å; Y90-V127 HydrophobicContact CE2-CG2 3.67Å; Y90-V127 HydrophobicContact CG-CG2 4.5Å; L121-V127 HydrophobicContact CD1-CG2 3.7Å; L121-V127 HydrophobicContact CD2-CG2 3.71Å; L121-V127 HydrophobicContact CG-CG2 4.39Å; V127-V129 HydrophobicContact CG1-CG2 4.17Å; V127-I143 HydrophobicContact CG2-CG1 4.44Å
128	F	97.6	Very high	84.2	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	138.5	175.7	-63.4	-96.8	0	0	0	109.8	I67 T77 E78 R126 C141 C142 V144 L223 V227 L231	I67-F128 HydrophobicContact CD1-CD1 3.65Å; I67-F128 HydrophobicContact CD1-CE1 3.81Å; I67-F128 HydrophobicContact CG2-CE1 4.46Å; T77-F128 CarbonylContact O-C 3.46Å; T77-F128 WeakPolarHBondContact O-CA 3.29Å; E78-F128 HydrophobicContact CB-CD1 3.76Å; E78-F128 HydrophobicContact CB-CE1 3.58Å; E78-F128 HydrophobicContact CB-CZ 4.31Å; E78-F128 HydrophobicContact CG-CD1 4.24Å; E78-F128 HydrophobicContact CG-CE1 3.86Å; E78-F128 HydrophobicContact CG-CZ 4.09Å; R126-F128 HydrophobicContact CB-CD2 4.45Å; R126-F128 HydrophobicContact CB-CE2 3.71Å; R126-F128 HydrophobicContact CB-CZ 4.41Å; F128-C141 CarbonylContact O-C 3.56Å; F128-C141 VanDerWaalsContact O-CA 3.3Å; F128-C141 WeakPolarHBondContact O-CA 3.46Å; F128-C142 PolarHBondContact N-O 2.64Å; F128-C142 PolarHBondContact O-N 3.08Å; F128-V144 HydrophobicContact CD2-CG2 3.63Å; F128-V144 HydrophobicContact CE2-CG2 3.39Å; F128-L223 HydrophobicContact CB-CD1 4.04Å; F128-V227 HydrophobicContact CB-CG2 3.66Å; F128-V227 HydrophobicContact CD1-CG2 3.76Å; F128-V227 HydrophobicContact CD2-CG1 4.26Å; F128-V227 HydrophobicContact CD2-CG2 3.66Å; F128-V227 HydrophobicContact CE1-CG2 4.25Å; F128-V227 HydrophobicContact CE2-CG1 4.12Å; F128-V227 HydrophobicContact CE2-CG2 4.18Å; F128-V227 HydrophobicContact CG-CG2 3.41Å; F128-V227 VanDerWaalsContact CG-CG2 3.41Å; F128-V227 HydrophobicContact CZ-CG1 4.46Å; F128-V227 HydrophobicContact CZ-CG2 4.44Å; F128-L231 HydrophobicContact CE2-CD1 4.42Å
129	V	97.9	Very high	86.7	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	135.2	-171.5	-173.6	0	0	0	0	109	L58 V76 T77 L79 I93 V127 V131 V138 G140	L58-V129 HydrophobicContact CD2-CB 4.26Å; L58-V129 HydrophobicContact CD2-CG1 4.08Å; V76-V129 WeakPolarHBondContact CA-O 3.44Å; T77-V129 HydrophobicContact CG2-CB 4.07Å; T77-V129 PolarHBondContact N-O 2.92Å; T77-V129 PolarHBondContact O-N 3.32Å; L79-V129 HydrophobicContact CB-CG2 4.38Å; I93-V129 HydrophobicContact CD1-CG1 4.09Å; I93-V129 HydrophobicContact CD1-CG2 3.82Å; V127-V129 HydrophobicContact CG1-CG2 4.17Å; V129-V131 HydrophobicContact CG1-CG2 4.19Å; V129-V138 HydrophobicContact CG1-CB 4.12Å; V129-V138 HydrophobicContact CG1-CG1 3.43Å; V129-V138 VanDerWaalsContact CG1-CG1 3.43Å; V129-V138 HydrophobicContact CG1-CG2 3.73Å; V129-G140 WeakPolarHBondContact CG1-O 3.23Å
130	Y	98	Very high	88.8	Confident	18 Å²	18	47.4 Å²	47.4	7%	0.071	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	118.4	169.1	-166.9	-68.1	0	0	0	109	N70 S74 V76 V139 G140 I219 N222 L223	N70-Y130 PolarHBondContact ND2-OH 3.17Å; S74-Y130 PolarHBondContact OG-OH 3.03Å; V76-Y130 HydrophobicContact CG2-CD2 3.78Å; V76-Y130 HydrophobicContact CG2-CE2 4.25Å; Y130-V139 HydrophobicContact CD1-CG2 3.34Å; Y130-V139 HydrophobicContact CE1-CG2 3.92Å; Y130-V139 HydrophobicContact CG-CG2 4.25Å; Y130-V139 PolarHBondContact O-N 3.38Å; Y130-G140 PolarHBondContact N-O 3.07Å; Y130-G140 PolarHBondContact O-N 2.71Å; Y130-I219 HydrophobicContact CD1-CG2 4.08Å; Y130-I219 HydrophobicContact CD2-CG2 3.72Å; Y130-I219 HydrophobicContact CE1-CG2 4.47Å; Y130-I219 HydrophobicContact CE2-CG2 4.1Å; Y130-I219 HydrophobicContact CG-CG2 3.69Å; Y130-N222 HydrophobicContact CE2-CB 4.27Å; Y130-N222 VanDerWaalsContact CE2-OD1 3.29Å; Y130-N222 WeakPolarHBondContact CE2-OD1 3.25Å; Y130-L223 HydrophobicContact CD2-CB 4.43Å
131	V	97.3	Very high	90.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	126.2	178.5	-173.2	0	0	0	0	109.7	L58 S74 R75 T77 V129 Q136 L137	L58-V131 HydrophobicContact CB-CG2 4.02Å; L58-V131 HydrophobicContact CD2-CG2 3.74Å; L58-V131 HydrophobicContact CG-CG2 4.33Å; S74-V131 CarbonylContact C-O 3.48Å; S74-V131 WeakPolarHBondContact CA-O 3.39Å; S74-V131 VanDerWaalsContact CB-O 3.28Å; S74-V131 WeakPolarHBondContact CB-O 3.33Å; R75-V131 HydrophobicContact CG-CB 4.02Å; R75-V131 HydrophobicContact CG-CG2 4.49Å; R75-V131 PolarHBondContact N-O 2.96Å; R75-V131 PolarHBondContact O-N 2.93Å; T77-V131 HydrophobicContact CG2-CG2 4.33Å; V129-V131 HydrophobicContact CG1-CG2 4.19Å; V131-Q136 VanDerWaalsContact CG1-C 3.42Å; V131-Q136 VanDerWaalsContact CG1-CA 3.49Å; V131-Q136 HydrophobicContact CG1-CB 4.31Å; V131-L137 CarbonylContact C-O 3.51Å; V131-L137 WeakPolarHBondContact CA-O 3.17Å
132	K	94.5	Very high	91.9	Very high	65 Å²	65	41.1 Å²	41.1	28%	0.283	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	128.9	-179	-163.4	-168.2	-174.5	-102.2	0	111.3	T135 Q136 L137 V139 H214	K132-T135 PolarHBondContact O-OG1 2.86Å; K132-Q136 PolarHBondContact O-N 2.82Å; K132-L137 PolarHBondContact N-O 3Å; K132-V139 HydrophobicContact CB-CG1 3.78Å; K132-V139 HydrophobicContact CB-CG2 3.99Å; K132-V139 HydrophobicContact CD-CG1 4.14Å; K132-V139 HydrophobicContact CG-CG1 4.43Å; K132-H214 WeakPolarHBondContact CD-NE2 3.42Å; K132-H214 WeakPolarHBondContact CE-NE2 3.3Å
133	D	89.9	Confident	92.9	Very high	35 Å²	35	37.6 Å²	37.6	19%	0.187	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	36.6	-149.1	162.1	66.6	26.7	0	0	0	115.4	T135 Q136	D133-T135 VanDerWaalsContact C-N 3.29Å; D133-T135 WeakPolarHBondContact OD1-CA 3.47Å; D133-T135 WeakPolarHBondContact OD1-CB 3.47Å; D133-T135 WeakPolarHBondContact OD1-CG2 3.37Å; D133-T135 PolarHBondContact OD1-N 2.8Å; D133-T135 PolarHBondContact OD1-OG1 2.9Å; D133-Q136 PolarHBondContact O-NE2 2.93Å
134	R	88.5	Confident	93.9	Very high	238 Å²	238	31.9 Å²	31.9	90%	0.898	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-13.8	176.8	-60.7	-176.2	-177.8	-176.9	0.5	113.3	Q136	R134-Q136 PolarHBondContact O-N 2.88Å
135	T	91.6	Very high	94.4	Very high	62 Å²	62	29.4 Å²	29.4	38%	0.38	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-19.8	176.7	63.3	0	0	0	0	112.3	K132 D133 L137	K132-T135 PolarHBondContact O-OG1 2.86Å; D133-T135 VanDerWaalsContact C-N 3.29Å; D133-T135 WeakPolarHBondContact OD1-CA 3.47Å; D133-T135 WeakPolarHBondContact OD1-CB 3.47Å; D133-T135 WeakPolarHBondContact OD1-CG2 3.37Å; D133-T135 PolarHBondContact OD1-N 2.8Å; D133-T135 PolarHBondContact OD1-OG1 2.9Å; T135-L137 PolarHBondContact O-N 2.82Å
136	Q	92.6	Very high	94.4	Very high	36 Å²	36	30.5 Å²	30.5	17%	0.168	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	27.2	-179.3	-56.9	-65.9	-67.2	0	0	112.4	R57 L58 R75 V131 K132 D133 R134	R57-Q136 CarbonylContact C-O 3.52Å; R57-Q136 VanDerWaalsContact CA-O 3.25Å; R57-Q136 WeakPolarHBondContact CA-O 3.48Å; L58-Q136 PolarHBondContact N-O 2.71Å; L58-Q136 PolarHBondContact O-OE1 3.15Å; R75-Q136 VanDerWaalsContact NH2-OE1 3.15Å; V131-Q136 VanDerWaalsContact CG1-C 3.42Å; V131-Q136 VanDerWaalsContact CG1-CA 3.49Å; V131-Q136 HydrophobicContact CG1-CB 4.31Å; K132-Q136 PolarHBondContact O-N 2.82Å; D133-Q136 PolarHBondContact O-NE2 2.93Å; R134-Q136 PolarHBondContact O-N 2.88Å
137	L	94.7	Very high	94.1	Very high	35 Å²	35	27.4 Å²	27.4	18%	0.183	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	132.5	-179.1	-69.5	171.6	0	0	0	110.6	T55 R57 V131 K132 T135 V139	T55-L137 HydrophobicContact CG2-CD2 4.4Å; R57-L137 HydrophobicContact CG-CD2 3.7Å; V131-L137 CarbonylContact C-O 3.51Å; V131-L137 WeakPolarHBondContact CA-O 3.17Å; K132-L137 PolarHBondContact N-O 3Å; T135-L137 PolarHBondContact O-N 2.82Å; L137-V139 HydrophobicContact CB-CG1 4.4Å; L137-V139 PolarHBondContact O-N 2.78Å
138	V	96.1	Very high	93.6	Very high	4 Å²	4	29.2 Å²	29.2	2%	0.024	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	114.6	170.8	175.5	0	0	0	0	108.5	V56 L58 I93 V129 W209	V56-V138 HydrophobicContact CB-CB 4.34Å; V56-V138 HydrophobicContact CB-CG2 4.32Å; V56-V138 HydrophobicContact CG1-CG2 4.15Å; V56-V138 PolarHBondContact O-N 2.91Å; L58-V138 HydrophobicContact CB-CG2 3.68Å; L58-V138 HydrophobicContact CD2-CG2 4.49Å; I93-V138 HydrophobicContact CD1-CG1 4.28Å; I93-V138 HydrophobicContact CD1-CG2 4.06Å; I93-V138 HydrophobicContact CG1-CG1 4.25Å; I93-V138 HydrophobicContact CG1-CG2 4.33Å; I93-V138 HydrophobicContact CG2-CG1 4.39Å; V129-V138 HydrophobicContact CG1-CB 4.12Å; V129-V138 HydrophobicContact CG1-CG1 3.43Å; V129-V138 VanDerWaalsContact CG1-CG1 3.43Å; V129-V138 HydrophobicContact CG1-CG2 3.73Å; V138-W209 HydrophobicContact CG1-CZ3 4.39Å
139	V	95.6	Very high	92.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	-9.4	-178.5	-63.5	0	0	0	0	112.9	Y130 K132 L137 V210 E211 H214 I219	Y130-V139 HydrophobicContact CD1-CG2 3.34Å; Y130-V139 HydrophobicContact CE1-CG2 3.92Å; Y130-V139 HydrophobicContact CG-CG2 4.25Å; Y130-V139 PolarHBondContact O-N 3.38Å; K132-V139 HydrophobicContact CB-CG1 3.78Å; K132-V139 HydrophobicContact CB-CG2 3.99Å; K132-V139 HydrophobicContact CD-CG1 4.14Å; K132-V139 HydrophobicContact CG-CG1 4.43Å; L137-V139 HydrophobicContact CB-CG1 4.4Å; L137-V139 PolarHBondContact O-N 2.78Å; V139-V210 CarbonylContact O-C 3.58Å; V139-V210 WeakPolarHBondContact O-CA 3.47Å; V139-V210 WeakPolarHBondContact O-CG1 3.41Å; V139-E211 HydrophobicContact CB-CB 4.49Å; V139-E211 PolarHBondContact O-N 2.87Å; V139-H214 HydrophobicContact CB-CB 4.47Å; V139-I219 HydrophobicContact CG2-CD1 3.96Å
140	G	96.7	Very high	91.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	152.3	173	0	0	0	0	0	111.1	V129 Y130 W209	V129-G140 WeakPolarHBondContact CG1-O 3.23Å; Y130-G140 PolarHBondContact N-O 3.07Å; Y130-G140 PolarHBondContact O-N 2.71Å; G140-W209 CarbonylContact C-O 3.56Å; G140-W209 WeakPolarHBondContact CA-O 3.15Å
141	C	96.4	Very high	90.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	139.5	176.9	-175.7	0	0	0	0	108.9	I93 M97 F128 W209	I93-C141 HydrophobicContact CG2-CB 3.8Å; M97-C141 HydrophobicContact CE-CB 4.42Å; M97-C141 HydrophobicContact CG-CB 4.34Å; M97-C141 HydrophobicContact SD-CB 3.61Å; M97-C141 PolarHBondContact SD-SG 3.34Å; F128-C141 CarbonylContact O-C 3.56Å; F128-C141 VanDerWaalsContact O-CA 3.3Å; F128-C141 WeakPolarHBondContact O-CA 3.46Å; C141-W209 HydrophobicContact CB-CE3 4.2Å; C141-W209 PolarHBondContact N-O 2.95Å; C141-W209 PolarHBondContact O-N 2.74Å
142	C	95.6	Very high	89.4	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	142.2	167.2	65	0	0	0	0	111	F128 V144 R207 I208 L223 L224	F128-C142 PolarHBondContact N-O 2.64Å; F128-C142 PolarHBondContact O-N 3.08Å; C142-V144 HydrophobicContact CB-CG1 4.39Å; C142-R207 CarbonylContact C-O 3.51Å; C142-R207 WeakPolarHBondContact CA-O 3.49Å; C142-R207 VanDerWaalsContact CB-O 3.28Å; C142-R207 WeakPolarHBondContact CB-O 3.49Å; C142-I208 HydrophobicContact CB-CB 4.3Å; C142-I208 HydrophobicContact CB-CG1 4.25Å; C142-L223 HydrophobicContact CB-CD2 4Å; C142-L223 HydrophobicContact CB-CG 4.43Å; C142-L224 HydrophobicContact CB-CD2 4.32Å
143	I	94.7	Very high	88.3	Confident	4 Å²	4	44.6 Å²	44.6	2%	0.021	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	123	173	-54.5	176	0	0	0	105.8	Y90 M97 L121 W125 R126 V127 R206 R207	Y90-I143 HydrophobicContact CE2-CD1 4.06Å; M97-I143 HydrophobicContact CE-CD1 4.36Å; M97-I143 HydrophobicContact CE-CG1 4.46Å; L121-I143 HydrophobicContact CD1-CG2 4.21Å; W125-I143 HydrophobicContact CB-CG2 4.09Å; W125-I143 HydrophobicContact CD2-CG2 4.45Å; W125-I143 HydrophobicContact CE3-CG2 4.33Å; W125-I143 HydrophobicContact CG-CG2 4.38Å; R126-I143 WeakPolarHBondContact O-CA 3.49Å; V127-I143 HydrophobicContact CG2-CG1 4.44Å; I143-R206 HydrophobicContact CG2-CB 4.4Å; I143-R206 PolarHBondContact O-N 3.47Å; I143-R207 HydrophobicContact CB-CB 4.26Å; I143-R207 HydrophobicContact CD1-CB 4.32Å; I143-R207 HydrophobicContact CG1-CB 4.32Å; I143-R207 PolarHBondContact N-O 3.22Å; I143-R207 PolarHBondContact O-N 3.48Å; I143-R207 VanDerWaalsContact O-N 3.15Å
144	V	94.9	Very high	87.3	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	157.7	-176.1	-55.5	0	0	0	0	110.9	R126 F128 C142 G204 I205 V227 L231	R126-V144 HydrophobicContact CB-CG2 4.24Å; R126-V144 PolarHBondContact N-O 3.37Å; R126-V144 PolarHBondContact O-N 3.31Å; F128-V144 HydrophobicContact CD2-CG2 3.63Å; F128-V144 HydrophobicContact CE2-CG2 3.39Å; C142-V144 HydrophobicContact CB-CG1 4.39Å; V144-G204 CarbonylContact C-O 3.48Å; V144-G204 WeakPolarHBondContact CA-O 3.48Å; V144-I205 HydrophobicContact CG1-CG1 4.38Å; V144-V227 HydrophobicContact CB-CG1 4.49Å; V144-V227 HydrophobicContact CG1-CG1 4.15Å; V144-V227 HydrophobicContact CG2-CG1 3.93Å; V144-L231 HydrophobicContact CG2-CD1 3.8Å
145	E	91.5	Very high	86.1	Confident	11 Å²	11	39 Å²	39	5%	0.051	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	150.8	172.9	68.9	-168.7	111.4	0	0	110.1	L147 G204 Y267	E145-L147 HydrophobicContact CG-CD2 3.77Å; E145-L147 HydrophobicContact CG-CG 4.12Å; E145-L147 PolarHBondContact O-N 3Å; E145-G204 PolarHBondContact N-O 2.87Å; E145-G204 PolarHBondContact O-N 3.33Å; E145-Y267 HydrophobicContact CG-CE2 4.36Å; E145-Y267 WeakPolarHBondContact OE1-CE2 3.17Å; E145-Y267 PolarHBondContact OE1-OH 2.97Å
146	E	90.4	Very high	84.8	Confident	65 Å²	65	41.4 Å²	41.4	30%	0.304	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	114.8	170.1	-172.4	-163.1	130.2	0	0	109.1	T148 K151 I232	E146-T148 PolarHBondContact OE1-OG1 3.24Å; E146-K151 WeakPolarHBondContact O-CD 3.5Å; E146-I232 HydrophobicContact CG-CD1 3.87Å; E146-I232 HydrophobicContact CG-CG1 4.18Å
147	L	87.4	Confident	83.6	Confident	3 Å²	3	40.9 Å²	40.9	2%	0.016	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	106.7	173.3	-61.7	177.9	0	0	0	108.9	E145 I152 I202 A243 Y267	E145-L147 HydrophobicContact CG-CD2 3.77Å; E145-L147 HydrophobicContact CG-CG 4.12Å; E145-L147 PolarHBondContact O-N 3Å; L147-I152 HydrophobicContact CB-CD1 4.46Å; L147-I152 HydrophobicContact CB-CG1 4.37Å; L147-I202 HydrophobicContact CB-CB 4.15Å; L147-I202 HydrophobicContact CB-CG2 4.46Å; L147-I202 WeakPolarHBondContact CB-O 2.91Å; L147-I202 HydrophobicContact CD1-CG2 4.3Å; L147-I202 PolarHBondContact N-O 3.2Å; L147-I202 PolarHBondContact O-N 3.49Å; L147-A243 HydrophobicContact CD1-CB 4.21Å; L147-Y267 HydrophobicContact CD1-CD1 3.9Å; L147-Y267 HydrophobicContact CD1-CD2 3.8Å; L147-Y267 HydrophobicContact CD1-CE1 4.18Å; L147-Y267 HydrophobicContact CD1-CE2 4.06Å; L147-Y267 HydrophobicContact CD1-CG 3.67Å; L147-Y267 HydrophobicContact CD2-CD2 4.21Å; L147-Y267 HydrophobicContact CD2-CE2 4.13Å
148	T	83.4	Confident	82.8	Confident	38 Å²	38	46.7 Å²	46.7	23%	0.233	26%	0.261	C	S	.	.			trans	-107.7	151	169.6	-73.1	0	0	0	0	108.6	E146 K150 K151 I152	E146-T148 PolarHBondContact OE1-OG1 3.24Å; T148-K150 PolarHBondContact O-N 3.14Å; T148-K151 WeakPolarHBondContact O-CA 3.49Å; T148-K151 WeakPolarHBondContact O-CB 3.46Å; T148-K151 PolarHBondContact O-N 2.96Å; T148-I152 PolarHBondContact O-N 3.4Å
149	T	76.7	Confident	82.1	Confident	54 Å²	54	47.8 Å²	47.8	33%	0.331	27%	0.267	S	S	.	.	H	α-helix	trans	-45.5	-38.3	-180	51.2	0	0	0	0	114.3	S153 N199	T149-S153 PolarHBondContact O-N 3.32Å; T149-S153 VanDerWaalsContact O-N 3.15Å; T149-S153 PolarHBondContact O-OG 3.16Å; T149-N199 HydrophobicContact CG2-CB 4.22Å; T149-N199 WeakPolarHBondContact CG2-O 3.47Å
150	K	75.8	Confident	81.5	Confident	170 Å²	170	51.8 Å²	51.8	74%	0.739	29%	0.288	S	S	*	.	H	α-helix	trans	-64	-43.8	174.2	-62.9	-178.1	-179.2	178	0	113	T148 S153 A154	T148-K150 PolarHBondContact O-N 3.14Å; K150-S153 PolarHBondContact O-N 3.14Å; K150-A154 VanDerWaalsContact O-CB 3.28Å; K150-A154 WeakPolarHBondContact O-CB 3.17Å; K150-A154 PolarHBondContact O-N 3.07Å
151	K	77.3	Confident	80.9	Confident	49 Å²	49	55.8 Å²	55.8	21%	0.213	30%	0.304	C	S	.	.	H	α-helix	trans	-69.1	-39.5	178.8	-78.2	-176.8	164.8	-176.1	0	111.8	D124 E146 T148 S153 A154 N155	D124-K151 IonicContact OD1-NZ 3.27Å; D124-K151 PolarHBondContact OD1-NZ 3.29Å; D124-K151 IonicContact OD2-NZ 3.04Å; E146-K151 WeakPolarHBondContact O-CD 3.5Å; T148-K151 WeakPolarHBondContact O-CA 3.49Å; T148-K151 WeakPolarHBondContact O-CB 3.46Å; T148-K151 PolarHBondContact O-N 2.96Å; K151-S153 VanDerWaalsContact C-N 3.32Å; K151-S153 PolarHBondContact O-N 2.86Å; K151-A154 PolarHBondContact O-N 2.8Å; K151-N155 WeakPolarHBondContact O-CB 3.23Å; K151-N155 PolarHBondContact O-N 2.82Å
152	I	72.8	Confident	80.2	Confident	29 Å²	29	56.4 Å²	56.4	15%	0.149	31%	0.307	C	S	.	.	H	α-helix	trans	-58.9	-47.5	175.4	-61.9	171	0	0	0	109.6	L147 T148 A154 C157 L159	L147-I152 HydrophobicContact CB-CD1 4.46Å; L147-I152 HydrophobicContact CB-CG1 4.37Å; T148-I152 PolarHBondContact O-N 3.4Å; I152-A154 PolarHBondContact O-N 3.19Å; I152-C157 WeakPolarHBondContact CG2-O 3.28Å; I152-C157 PolarHBondContact O-N 2.8Å; I152-C157 VanDerWaalsContact O-O 3.09Å; I152-L159 HydrophobicContact CD1-CB 4.16Å; I152-L159 HydrophobicContact CD1-CD2 3.96Å; I152-L159 HydrophobicContact CG2-CB 4.35Å
153	S	71.7	Confident	79.3	Confident	103 Å²	103	62.3 Å²	62.3	72%	0.72	34%	0.343	S	S	*	.	H	α-helix	trans	-67.8	-33.4	178.5	-53.5	0	0	0	0	113.3	T149 K150 K151	T149-S153 PolarHBondContact O-N 3.32Å; T149-S153 VanDerWaalsContact O-N 3.15Å; T149-S153 PolarHBondContact O-OG 3.16Å; K150-S153 PolarHBondContact O-N 3.14Å; K151-S153 VanDerWaalsContact C-N 3.32Å; K151-S153 PolarHBondContact O-N 2.86Å
154	A	68.8	Low	78.4	Confident	74 Å²	74	66.7 Å²	66.7	61%	0.612	37%	0.373	S	S	*	.	H	α-helix	trans	-80.4	-42.5	-177.2	0	0	0	0	0	113.5	K150 K151 I152 S156	K150-A154 VanDerWaalsContact O-CB 3.28Å; K150-A154 WeakPolarHBondContact O-CB 3.17Å; K150-A154 PolarHBondContact O-N 3.07Å; K151-A154 PolarHBondContact O-N 2.8Å; I152-A154 PolarHBondContact O-N 3.19Å; A154-S156 PolarHBondContact O-N 2.97Å
155	N	64.4	Low	77.7	Confident	82 Å²	82	67.1 Å²	67.1	44%	0.439	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	9.1	-172.2	-68.2	-4.6	0	0	0	113.2	K151 C157	K151-N155 WeakPolarHBondContact O-CB 3.23Å; K151-N155 PolarHBondContact O-N 2.82Å; N155-C157 HydrophobicContact CB-CB 4.45Å; N155-C157 PolarHBondContact O-N 3.48Å
156	S	64.3	Low	77.1	Confident	113 Å²	113	69.3 Å²	69.3	79%	0.79	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	20.1	-171.5	-59.7	0	0	0	0	113.9	A154	A154-S156 PolarHBondContact O-N 2.97Å
157	C	67.1	Low	76.4	Confident	24 Å²	24	72.1 Å²	72.1	16%	0.162	40%	0.397	C	S	.	.			trans	-80.1	131.5	176.1	165.5	0	0	0	0	108.6	I152 N155 Y267	I152-C157 WeakPolarHBondContact CG2-O 3.28Å; I152-C157 PolarHBondContact O-N 2.8Å; I152-C157 VanDerWaalsContact O-O 3.09Å; N155-C157 HydrophobicContact CB-CB 4.45Å; N155-C157 PolarHBondContact O-N 3.48Å; C157-Y267 WeakPolarHBondContact SG-CD2 3.49Å; C157-Y267 PolarHBondContact SG-OXT 3.4Å
158	K	76.6	Confident	76	Confident	157 Å²	157	74.6 Å²	74.6	68%	0.683	41%	0.414	S	S	*	.			trans	-107.3	103.1	178.1	-67.1	-178.6	-178.1	176.2	0	109	N160	K158-N160 PolarHBondContact O-N 3.05Å; K158-N160 PolarHBondContact O-ND2 2.9Å
159	L	82.3	Confident	75.7	Confident	28 Å²	28	73.9 Å²	73.9	15%	0.147	41%	0.409	C	S	.	.			trans	-69.3	115.8	170.5	-177.7	69.6	0	0	0	109.4	I152 I198 I202 A243 L265	I152-L159 HydrophobicContact CD1-CB 4.16Å; I152-L159 HydrophobicContact CD1-CD2 3.96Å; I152-L159 HydrophobicContact CG2-CB 4.35Å; L159-I198 HydrophobicContact CD2-CG2 3.81Å; L159-I202 HydrophobicContact CD2-CD1 3.33Å; L159-A243 HydrophobicContact CD1-CB 3.57Å; L159-L265 HydrophobicContact CD1-CB 4.07Å; L159-L265 HydrophobicContact CD1-CD1 4.41Å
160	N	82.9	Confident	75.8	Confident	84 Å²	84	77.8 Å²	77.8	45%	0.449	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	146.9	-178.2	-65.6	-60.7	0	0	0	111.2	K158 L265 I266	K158-N160 PolarHBondContact O-N 3.05Å; K158-N160 PolarHBondContact O-ND2 2.9Å; N160-L265 WeakPolarHBondContact O-CA 3.44Å; N160-I266 HydrophobicContact CB-CG1 4.16Å; N160-I266 PolarHBondContact N-O 2.83Å; N160-I266 WeakPolarHBondContact O-CG1 3.41Å; N160-I266 PolarHBondContact O-N 2.86Å
161	R	83.6	Confident	75.8	Confident	84 Å²	84	71.4 Å²	71.4	32%	0.317	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	131.1	168.7	-167.9	175.4	-178.7	139.3	9	108.6	V163 L193 D263 L265	R161-V163 VanDerWaalsContact C-N 3.26Å; R161-V163 WeakPolarHBondContact O-CG2 3.2Å; R161-V163 PolarHBondContact O-N 2.76Å; R161-L193 VanDerWaalsContact NH2-CD1 3.3Å; R161-D263 HydrophobicContact CG-CB 4.16Å; R161-D263 WeakPolarHBondContact CG-O 3.24Å; R161-D263 IonicContact CZ-OD1 3.73Å; R161-D263 IonicContact CZ-OD2 3.13Å; R161-D263 IonicContact NE-OD1 3.62Å; R161-D263 IonicContact NE-OD2 3.78Å; R161-D263 PolarHBondContact NE-OD2 3.25Å; R161-D263 VanDerWaalsContact NH2-CG 3.28Å; R161-D263 IonicContact NH2-OD1 2.89Å; R161-D263 PolarHBondContact NH2-OD1 3.2Å; R161-D263 IonicContact NH2-OD2 2.78Å; R161-D263 PolarHBondContact NH2-OD2 3.26Å; R161-L265 HydrophobicContact CB-CD2 4.29Å
162	L	82.6	Confident	75.8	Confident	13 Å²	13	70.7 Å²	70.7	7%	0.068	40%	0.4	C	S	.	.			trans	-77.3	74.2	179.5	-170.7	64.6	0	0	0	111.3	S164 G165 S168 L169 D263 F264 I266	L162-S164 PolarHBondContact O-N 2.88Å; L162-S164 VanDerWaalsContact O-N 3.1Å; L162-G165 WeakPolarHBondContact CD2-O 3.1Å; L162-G165 PolarHBondContact O-N 2.83Å; L162-S168 WeakPolarHBondContact CD1-OG 3.12Å; L162-L169 HydrophobicContact CD1-CD2 3.92Å; L162-L169 HydrophobicContact CD1-CG 4.37Å; L162-L169 HydrophobicContact CD2-CD1 3.92Å; L162-L169 HydrophobicContact CD2-CD2 4.11Å; L162-L169 HydrophobicContact CD2-CG 3.87Å; L162-D263 WeakPolarHBondContact O-CA 3.32Å; L162-D263 VanDerWaalsContact O-CB 3.23Å; L162-D263 WeakPolarHBondContact O-CB 3.4Å; L162-F264 WeakPolarHBondContact CB-O 3.18Å; L162-F264 HydrophobicContact CD2-CD1 4.47Å; L162-F264 HydrophobicContact CD2-CE1 3.77Å; L162-F264 HydrophobicContact CD2-CE2 4.32Å; L162-F264 HydrophobicContact CD2-CZ 3.68Å; L162-F264 PolarHBondContact N-O 3.37Å; L162-F264 VanDerWaalsContact N-O 3.08Å; L162-I266 HydrophobicContact CD1-CD1 4.11Å
163	V	75.3	Confident	75.7	Confident	124 Å²	124	72.9 Å²	72.9	75%	0.752	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-33.7	-169.8	-174.5	0	0	0	0	113.4	R161 G165	R161-V163 VanDerWaalsContact C-N 3.26Å; R161-V163 WeakPolarHBondContact O-CG2 3.2Å; R161-V163 PolarHBondContact O-N 2.76Å; V163-G165 VanDerWaalsContact C-N 3.32Å; V163-G165 PolarHBondContact O-N 3.44Å
164	S	77.1	Confident	75.8	Confident	95 Å²	95	74.1 Å²	74.1	66%	0.664	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	7.6	-177.7	-57.7	0	0	0	0	114.4	L162 S168	L162-S164 PolarHBondContact O-N 2.88Å; L162-S164 VanDerWaalsContact O-N 3.1Å; S164-S168 VanDerWaalsContact CB-CB 3.48Å
165	G	78.8	Confident	76.1	Confident	9 Å²	9	75.8 Å²	75.8	9%	0.093	40%	0.404	C	S	.	.			trans	71.7	177.8	-179.1	0	0	0	0	0	114	L162 V163 K167 S168 E262	L162-G165 WeakPolarHBondContact CD2-O 3.1Å; L162-G165 PolarHBondContact O-N 2.83Å; V163-G165 VanDerWaalsContact C-N 3.32Å; V163-G165 PolarHBondContact O-N 3.44Å; G165-K167 PolarHBondContact O-N 2.84Å; G165-K167 VanDerWaalsContact O-N 3.11Å; G165-S168 PolarHBondContact O-N 2.82Å; G165-S168 VanDerWaalsContact O-N 3.11Å; G165-S168 PolarHBondContact O-OG 2.97Å; G165-E262 WeakPolarHBondContact CA-O 3.4Å
166	R	79.6	Confident	76.1	Confident	58 Å²	58	72.5 Å²	72.5	22%	0.219	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-60.9	-26.7	-174.4	73.7	-167.6	-157	-177.1	0.6	114.1	S168 L169 W172 A252 D253 V256 E262 F264	R166-S168 PolarHBondContact O-N 2.89Å; R166-L169 WeakPolarHBondContact O-CB 3.27Å; R166-L169 PolarHBondContact O-N 3.12Å; R166-L169 VanDerWaalsContact O-N 3.09Å; R166-W172 HydrophobicContact CG-CD2 4.39Å; R166-W172 HydrophobicContact CG-CG 4.49Å; R166-W172 VanDerWaalsContact O-CB 3.32Å; R166-W172 WeakPolarHBondContact O-CB 3.44Å; R166-A252 HydrophobicContact CB-CB 4.15Å; R166-D253 IonicContact CZ-OD1 2.67Å; R166-D253 IonicContact NE-OD1 3.41Å; R166-D253 PolarHBondContact NE-OD1 3.3Å; R166-D253 IonicContact NH1-OD1 3.42Å; R166-D253 PolarHBondContact NH1-OD1 2.96Å; R166-D253 IonicContact NH2-OD1 2.76Å; R166-D253 PolarHBondContact NH2-OD1 3.32Å; R166-V256 HydrophobicContact CB-CG2 4.25Å; R166-E262 WeakPolarHBondContact CG-OE2 3.33Å; R166-E262 PolarHBondContact N-OE2 3.47Å; R166-E262 VanDerWaalsContact N-OE2 3.15Å; R166-F264 HydrophobicContact CB-CE1 4.26Å
167	K	76.5	Confident	75.8	Confident	123 Å²	123	72.2 Å²	72.2	54%	0.535	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-65.5	-17.3	179.3	-55.9	-168.1	178.6	179.7	0	113.2	G165 L169 W172 N173	G165-K167 PolarHBondContact O-N 2.84Å; G165-K167 VanDerWaalsContact O-N 3.11Å; K167-L169 VanDerWaalsContact C-N 3.3Å; K167-W172 HydrophobicContact CB-CE3 4.11Å; K167-W172 HydrophobicContact CB-CZ3 3.97Å; K167-W172 HydrophobicContact CD-CH2 4.23Å; K167-W172 HydrophobicContact CD-CZ3 4.18Å; K167-W172 HydrophobicContact CG-CE3 4.07Å; K167-W172 HydrophobicContact CG-CH2 3.8Å; K167-W172 HydrophobicContact CG-CZ2 4.44Å; K167-W172 HydrophobicContact CG-CZ3 3.58Å; K167-N173 VanDerWaalsContact O-CG 3.32Å; K167-N173 PolarHBondContact O-ND2 3.09Å; K167-N173 PolarHBondContact O-OD1 2.58Å
168	S	78.9	Confident	75.2	Confident	55 Å²	55	78.8 Å²	78.8	39%	0.385	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-81.2	-10.8	174.8	70.7	0	0	0	0	113.5	L162 S164 G165 R166	L162-S168 WeakPolarHBondContact CD1-OG 3.12Å; S164-S168 VanDerWaalsContact CB-CB 3.48Å; G165-S168 PolarHBondContact O-N 2.82Å; G165-S168 VanDerWaalsContact O-N 3.11Å; G165-S168 PolarHBondContact O-OG 2.97Å; R166-S168 PolarHBondContact O-N 2.89Å
169	L	77.1	Confident	74.1	Confident	24 Å²	24	77.7 Å²	77.7	13%	0.126	41%	0.406	C	S	.	.			trans	-75.5	128	178.1	-63.2	172.1	0	0	0	110.1	L162 R166 K167 S171 W172 N173 P247 A252 F264	L162-L169 HydrophobicContact CD1-CD2 3.92Å; L162-L169 HydrophobicContact CD1-CG 4.37Å; L162-L169 HydrophobicContact CD2-CD1 3.92Å; L162-L169 HydrophobicContact CD2-CD2 4.11Å; L162-L169 HydrophobicContact CD2-CG 3.87Å; R166-L169 WeakPolarHBondContact O-CB 3.27Å; R166-L169 PolarHBondContact O-N 3.12Å; R166-L169 VanDerWaalsContact O-N 3.09Å; K167-L169 VanDerWaalsContact C-N 3.3Å; L169-S171 VanDerWaalsContact C-N 3.26Å; L169-S171 PolarHBondContact O-N 2.82Å; L169-W172 HydrophobicContact CB-CB 3.93Å; L169-W172 WeakPolarHBondContact O-CB 3.42Å; L169-W172 PolarHBondContact O-N 2.71Å; L169-W172 VanDerWaalsContact O-N 3.08Å; L169-N173 PolarHBondContact O-N 3.02Å; L169-P247 HydrophobicContact CD1-CG 3.84Å; L169-A252 HydrophobicContact CD1-CB 3.85Å; L169-F264 HydrophobicContact CD1-CZ 4.1Å
170	L	79.3	Confident	72.4	Confident	136 Å²	136	84 Å²	84	71%	0.712	44%	0.44	S	S	*	.	H	α-helix	trans	-57.6	-41.7	174.2	-67.7	173.5	0	0	0	111.5	W172 N173 I174	L170-W172 VanDerWaalsContact C-N 3.27Å; L170-W172 PolarHBondContact O-N 2.77Å; L170-N173 PolarHBondContact O-N 3.17Å; L170-I174 VanDerWaalsContact O-CG1 3.29Å; L170-I174 WeakPolarHBondContact O-CG1 3.46Å; L170-I174 PolarHBondContact O-N 2.81Å
171	S	75.8	Confident	70.9	Confident	36 Å²	36	85.4 Å²	85.4	25%	0.252	45%	0.447	S	S	.	.	H	α-helix	trans	-57.8	-40.9	175.9	57.7	0	0	0	0	111.8	L169 Q175 P247	L169-S171 VanDerWaalsContact C-N 3.26Å; L169-S171 PolarHBondContact O-N 2.82Å; S171-Q175 VanDerWaalsContact O-CB 3.29Å; S171-Q175 WeakPolarHBondContact O-CB 3.3Å; S171-Q175 WeakPolarHBondContact O-CG 3.27Å; S171-Q175 PolarHBondContact O-N 2.95Å; S171-Q175 VanDerWaalsContact O-N 3.13Å; S171-P247 WeakPolarHBondContact CB-O 3.48Å; S171-P247 PolarHBondContact OG-O 3.02Å
172	W	76.6	Confident	69.1	Low	34 Å²	34	88.6 Å²	88.6	13%	0.129	47%	0.471	C	S	.	.	H	α-helix	trans	-66.1	-54.1	177.3	-164	87.6	0	0	0	110.2	R166 K167 L169 L170 I174 Q175 S176 A249 D253	R166-W172 HydrophobicContact CG-CD2 4.39Å; R166-W172 HydrophobicContact CG-CG 4.49Å; R166-W172 VanDerWaalsContact O-CB 3.32Å; R166-W172 WeakPolarHBondContact O-CB 3.44Å; K167-W172 HydrophobicContact CB-CE3 4.11Å; K167-W172 HydrophobicContact CB-CZ3 3.97Å; K167-W172 HydrophobicContact CD-CH2 4.23Å; K167-W172 HydrophobicContact CD-CZ3 4.18Å; K167-W172 HydrophobicContact CG-CE3 4.07Å; K167-W172 HydrophobicContact CG-CH2 3.8Å; K167-W172 HydrophobicContact CG-CZ2 4.44Å; K167-W172 HydrophobicContact CG-CZ3 3.58Å; L169-W172 HydrophobicContact CB-CB 3.93Å; L169-W172 WeakPolarHBondContact O-CB 3.42Å; L169-W172 PolarHBondContact O-N 2.71Å; L169-W172 VanDerWaalsContact O-N 3.08Å; L170-W172 VanDerWaalsContact C-N 3.27Å; L170-W172 PolarHBondContact O-N 2.77Å; W172-I174 PolarHBondContact O-N 2.89Å; W172-I174 VanDerWaalsContact O-N 3.15Å; W172-Q175 PolarHBondContact O-N 3.29Å; W172-Q175 VanDerWaalsContact O-N 3.14Å; W172-S176 WeakPolarHBondContact CZ3-OG 3.44Å; W172-S176 WeakPolarHBondContact O-CB 3.41Å; W172-S176 PolarHBondContact O-N 2.76Å; W172-S176 PolarHBondContact O-OG 2.89Å; W172-A249 HydrophobicContact CG-CB 4.46Å; W172-D253 PolarHBondContact NE1-OD1 2.88Å
173	N	70.2	Confident	67.3	Low	74 Å²	74	96.6 Å²	96.6	40%	0.396	50%	0.5	S	S	.	.	H	α-helix	trans	-57.4	-33.4	-178.4	-71.5	-27.1	0	0	0	114.1	K167 L169 L170 V177	K167-N173 VanDerWaalsContact O-CG 3.32Å; K167-N173 PolarHBondContact O-ND2 3.09Å; K167-N173 PolarHBondContact O-OD1 2.58Å; L169-N173 PolarHBondContact O-N 3.02Å; L170-N173 PolarHBondContact O-N 3.17Å; N173-V177 WeakPolarHBondContact O-CG2 3.47Å
174	I	74.6	Confident	65.9	Low	130 Å²	130	95.4 Å²	95.4	67%	0.667	50%	0.496	S	S	*	.	H	α-helix	trans	-80.4	-38.7	179.4	-65.1	165.6	0	0	0	111.6	L170 W172	L170-I174 VanDerWaalsContact O-CG1 3.29Å; L170-I174 WeakPolarHBondContact O-CG1 3.46Å; L170-I174 PolarHBondContact O-N 2.81Å; W172-I174 PolarHBondContact O-N 2.89Å; W172-I174 VanDerWaalsContact O-N 3.15Å
175	Q	74.3	Confident	64.3	Low	109 Å²	109	97 Å²	97	51%	0.509	50%	0.497	S	S	.	.	H	α-helix	trans	-95.3	-11.9	-172.3	-63.5	174.7	-12.1	0	0	113.6	S171 W172 A249	S171-Q175 VanDerWaalsContact O-CB 3.29Å; S171-Q175 WeakPolarHBondContact O-CB 3.3Å; S171-Q175 WeakPolarHBondContact O-CG 3.27Å; S171-Q175 PolarHBondContact O-N 2.95Å; S171-Q175 VanDerWaalsContact O-N 3.13Å; W172-Q175 PolarHBondContact O-N 3.29Å; W172-Q175 VanDerWaalsContact O-N 3.14Å; Q175-A249 HydrophobicContact CB-CB 3.57Å
176	S	64.6	Low	62.6	Low	13 Å²	13	104.6 Å²	104.6	9%	0.091	54%	0.535	C	S	.	.	S	Bend	trans	-95.5	-2.9	-179.6	73.8	0	0	0	0	114.1	W172 D178 R179	W172-S176 WeakPolarHBondContact CZ3-OG 3.44Å; W172-S176 WeakPolarHBondContact O-CB 3.41Å; W172-S176 PolarHBondContact O-N 2.76Å; W172-S176 PolarHBondContact O-OG 2.89Å; S176-D178 PolarHBondContact O-N 2.81Å; S176-R179 WeakPolarHBondContact O-CB 3.35Å; S176-R179 PolarHBondContact O-N 2.94Å
177	V	58.2	Low	60.9	Low	107 Å²	107	106.3 Å²	106.3	65%	0.648	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-28.7	-169.8	-177.3	0	0	0	0	113.3	N173 R179	N173-V177 WeakPolarHBondContact O-CG2 3.47Å; V177-R179 VanDerWaalsContact C-N 3.29Å; V177-R179 PolarHBondContact O-N 2.92Å
178	D	54	Low	59.5	Low	162 Å²	162	104 Å²	104	87%	0.866	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	3.5	179.2	-68.2	-29	0	0	0	114.7	S176 N180	S176-D178 PolarHBondContact O-N 2.81Å; D178-N180 PolarHBondContact O-N 2.86Å
179	R	55	Low	57.7	Low	134 Å²	134	106.6 Å²	106.6	51%	0.506	57%	0.565	S	S	.	*			trans	-101	76	179.5	-60.8	-169.8	-175.9	177.9	10.8	110.6	S176 V177 D181 N250 D253	S176-R179 WeakPolarHBondContact O-CB 3.35Å; S176-R179 PolarHBondContact O-N 2.94Å; V177-R179 VanDerWaalsContact C-N 3.29Å; V177-R179 PolarHBondContact O-N 2.92Å; R179-D181 PolarHBondContact O-N 2.87Å; R179-N250 PolarHBondContact NH2-OD1 2.92Å; R179-D253 IonicContact CZ-OD2 3.26Å; R179-D253 IonicContact NH1-OD2 2.91Å; R179-D253 PolarHBondContact NH1-OD2 2.79Å; R179-D253 IonicContact NH2-OD2 3.18Å
180	N	46.1	Very low	56.1	Low	160 Å²	160	111.1 Å²	111.1	86%	0.856	59%	0.589	S	S	*	*			trans	-73	45	176.8	-159.5	26	0	0	0	113.3	D178	D178-N180 PolarHBondContact O-N 2.86Å
181	D	50.3	Low	54.5	Low	113 Å²	113	109.5 Å²	109.5	60%	0.604	59%	0.589	S	S	*	*			trans	-112.8	97.6	177	-163.8	26.7	0	0	0	109.6	R179 R183	R179-D181 PolarHBondContact O-N 2.87Å; D181-R183 PolarHBondContact O-N 3.26Å; D181-R183 IonicContact OD1-NE 3.05Å; D181-R183 VanDerWaalsContact OD2-CD 3.31Å; D181-R183 WeakPolarHBondContact OD2-CD 3.19Å; D181-R183 IonicContact OD2-NE 2.67Å
182	D	46.1	Very low	53	Low	152 Å²	152	114 Å²	114	81%	0.813	61%	0.61	S	S	*	*			trans	-66.8	34.1	174.3	-103.4	-20.9	0	0	0	113.2	C184	D182-C184 VanDerWaalsContact C-N 3.32Å; D182-C184 PolarHBondContact O-N 3.08Å
183	R	45.5	Very low	51.5	Low	181 Å²	181	117.9 Å²	117.9	68%	0.683	63%	0.633	S	S	*	*			trans	-77.5	89.3	170.5	-73.6	-175.7	-175.4	-131.4	-1.8	109.3	D181 D185	D181-R183 PolarHBondContact O-N 3.26Å; D181-R183 IonicContact OD1-NE 3.05Å; D181-R183 VanDerWaalsContact OD2-CD 3.31Å; D181-R183 WeakPolarHBondContact OD2-CD 3.19Å; D181-R183 IonicContact OD2-NE 2.67Å; R183-D185 PolarHBondContact O-N 3.36Å
184	C	46.3	Very low	50.6	Low	98 Å²	98	119.8 Å²	119.8	66%	0.662	65%	0.652	S	S	*	*			trans	-61	78.9	151.9	-68.5	0	0	0	0	108.2	D182 L186	D182-C184 VanDerWaalsContact C-N 3.32Å; D182-C184 PolarHBondContact O-N 3.08Å; C184-L186 VanDerWaalsContact C-N 3.33Å; C184-L186 PolarHBondContact O-N 2.83Å
185	D	43.3	Very low	49.4	Very low	128 Å²	128	118.6 Å²	118.6	68%	0.684	65%	0.654	S	S	*	*			trans	-71.7	102.9	164.7	-77.4	-18.4	0	0	0	106.4	R183 I187	R183-D185 PolarHBondContact O-N 3.36Å; D185-I187 PolarHBondContact O-N 3.32Å
186	L	42	Very low	48.7	Very low	169 Å²	169	114.7 Å²	114.7	89%	0.885	64%	0.637	S	S	*	*			trans	-52.7	78.1	167.3	-65	160.1	0	0	0	109	C184 S188	C184-L186 VanDerWaalsContact C-N 3.33Å; C184-L186 PolarHBondContact O-N 2.83Å; L186-S188 PolarHBondContact O-N 2.98Å
187	I	45.2	Very low	48.6	Very low	95 Å²	95	118.5 Å²	118.5	49%	0.487	66%	0.657	S	S	.	*			trans	-74	95.6	155.5	-58.7	-178.4	0	0	0	103.9	D185 S189 V256	D185-I187 PolarHBondContact O-N 3.32Å; I187-S189 PolarHBondContact O-N 2.68Å; I187-V256 HydrophobicContact CD1-CG1 4.27Å
188	S	45.4	Very low	49	Very low	74 Å²	74	118 Å²	118	52%	0.517	65%	0.649	S	S	.	*			trans	-23.3	125.3	164.5	-168.3	0	0	0	0	109.2	L186 N190	L186-S188 PolarHBondContact O-N 2.98Å; S188-N190 PolarHBondContact O-N 2.81Å; S188-N190 PolarHBondContact OG-OD1 3.2Å; S188-N190 VanDerWaalsContact OG-OD1 3.09Å
189	S	43	Very low	49.8	Very low	109 Å²	109	116 Å²	116	76%	0.762	64%	0.639	S	S	*	*			trans	-58.4	75.3	161	52.3	0	0	0	0	107.4	I187 S191	I187-S189 PolarHBondContact O-N 2.68Å; S189-S191 PolarHBondContact O-N 3Å
190	N	42.4	Very low	51.1	Low	120 Å²	120	110.2 Å²	110.2	64%	0.642	62%	0.621	S	S	*	*			trans	-69.8	89.2	165.6	-78.9	-1.5	0	0	0	103.4	S188 D192	S188-N190 PolarHBondContact O-N 2.81Å; S188-N190 PolarHBondContact OG-OD1 3.2Å; S188-N190 VanDerWaalsContact OG-OD1 3.09Å; N190-D192 PolarHBondContact O-N 3.18Å
191	S	46.2	Very low	53.1	Low	101 Å²	101	104.1 Å²	104.1	71%	0.706	59%	0.59	S	S	*	*			trans	-66.8	28	169.6	57.1	0	0	0	0	111.8	S189 L193	S189-S191 PolarHBondContact O-N 3Å; S191-L193 PolarHBondContact O-N 3.23Å
192	D	42.8	Very low	55.1	Low	132 Å²	132	98.7 Å²	98.7	71%	0.706	56%	0.561	S	S	*	*			trans	-73.4	61.1	158.7	-76.4	-17	0	0	0	107.8	N190 S194	N190-D192 PolarHBondContact O-N 3.18Å; D192-S194 PolarHBondContact O-N 2.79Å
193	L	45.9	Very low	57.4	Low	115 Å²	115	91.5 Å²	91.5	60%	0.602	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-0.5	-176.7	-157.1	76	0	0	0	111.7	R161 S191	R161-L193 VanDerWaalsContact NH2-CD1 3.3Å; S191-L193 PolarHBondContact O-N 3.23Å
194	S	50.6	Low	59.7	Low	113 Å²	113	82.9 Å²	82.9	79%	0.79	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-5.3	-164.9	58.5	0	0	0	0	116	D192	D192-S194 PolarHBondContact O-N 2.79Å
195	C	51	Low	62	Low	105 Å²	105	78.3 Å²	78.3	71%	0.709	46%	0.459	S	S	*	.			trans	-91.2	-8.8	-169.2	-164.7	0	0	0	0	115.8	D197	C195-D197 PolarHBondContact O-N 3.39Å
196	V	58.1	Low	64.2	Low	27 Å²	27	74.8 Å²	74.8	16%	0.164	44%	0.436	C	S	.	.			trans	-96.6	100.6	178.4	-168.9	0	0	0	0	109.4	I198 L265	V196-I198 VanDerWaalsContact C-N 3.32Å; V196-I198 HydrophobicContact CG1-CG1 4.49Å; V196-I198 PolarHBondContact O-N 3.49Å; V196-L265 HydrophobicContact CG1-CD1 4.28Å
197	D	63.9	Low	66.6	Low	94 Å²	94	68.9 Å²	68.9	50%	0.503	40%	0.402	S	S	.	.			trans	-68	96.2	163.7	-176.2	14.4	0	0	0	108.4	C195 N199 G200	C195-D197 PolarHBondContact O-N 3.39Å; D197-N199 PolarHBondContact O-N 3.04Å; D197-N199 VanDerWaalsContact O-N 3.12Å; D197-N199 WeakPolarHBondContact OD1-CB 3.43Å; D197-N199 PolarHBondContact OD1-N 3.11Å; D197-N199 PolarHBondContact OD1-ND2 2.71Å; D197-G200 PolarHBondContact O-N 3.4Å
198	I	66.9	Low	68.9	Low	95 Å²	95	65.9 Å²	65.9	49%	0.487	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-18.2	176.3	-58.4	172.3	0	0	0	110.6	L159 V196	L159-I198 HydrophobicContact CD2-CG2 3.81Å; V196-I198 VanDerWaalsContact C-N 3.32Å; V196-I198 HydrophobicContact CG1-CG1 4.49Å; V196-I198 PolarHBondContact O-N 3.49Å
199	N	70.6	Confident	71.3	Confident	121 Å²	121	62.7 Å²	62.7	65%	0.647	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-13.9	176.1	-48.2	-65.8	0	0	0	113.1	T149 D197	T149-N199 HydrophobicContact CG2-CB 4.22Å; T149-N199 WeakPolarHBondContact CG2-O 3.47Å; D197-N199 PolarHBondContact O-N 3.04Å; D197-N199 VanDerWaalsContact O-N 3.12Å; D197-N199 WeakPolarHBondContact OD1-CB 3.43Å; D197-N199 PolarHBondContact OD1-N 3.11Å; D197-N199 PolarHBondContact OD1-ND2 2.71Å
200	G	82.4	Confident	73.8	Confident	13 Å²	13	58.1 Å²	58.1	13%	0.134	33%	0.331	C	S	.	.	S	Bend	trans	-75.9	172	174.8	0	0	0	0	0	112.6	D197	D197-G200 PolarHBondContact O-N 3.4Å
201	P	88.1	Confident	76.2	Confident	31 Å²	31	53.8 Å²	53.8	20%	0.201	31%	0.306	C	S	.	.			trans	-67.1	139.2	174	24.8	-29	0	0	0	111.2	I232 L235 L237 Q241	P201-I232 HydrophobicContact CB-CD1 3.33Å; P201-I232 HydrophobicContact CG-CD1 3.88Å; P201-L235 HydrophobicContact CG-CD2 3.49Å; P201-L235 VanDerWaalsContact CG-CD2 3.49Å; P201-L237 HydrophobicContact CB-CD2 4.38Å; P201-L237 HydrophobicContact CG-CD2 4.07Å; P201-Q241 PolarHBondContact O-NE2 2.88Å; P201-Q241 VanDerWaalsContact O-NE2 3.08Å
202	I	91.3	Very high	78.2	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	142	180	-68.2	169.6	0	0	0	108.7	L147 L159 G204 A243 L265	L147-I202 HydrophobicContact CB-CB 4.15Å; L147-I202 HydrophobicContact CB-CG2 4.46Å; L147-I202 WeakPolarHBondContact CB-O 2.91Å; L147-I202 HydrophobicContact CD1-CG2 4.3Å; L147-I202 PolarHBondContact N-O 3.2Å; L147-I202 PolarHBondContact O-N 3.49Å; L159-I202 HydrophobicContact CD2-CD1 3.33Å; I202-G204 PolarHBondContact O-N 3.09Å; I202-A243 HydrophobicContact CG2-CB 3.89Å; I202-L265 HydrophobicContact CD1-CD1 4.15Å
203	C	94	Very high	80.4	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	108.7	169.7	178.9	0	0	0	0	109.4	I205 L228 L231 L237 Q241 T242 A243	C203-I205 PolarHBondContact O-N 2.93Å; C203-L228 HydrophobicContact CB-CD2 3.41Å; C203-L228 VanDerWaalsContact CB-CD2 3.41Å; C203-L231 HydrophobicContact CB-CD2 3.68Å; C203-L237 HydrophobicContact CB-CD1 3.91Å; C203-Q241 PolarHBondContact N-O 3.38Å; C203-T242 HydrophobicContact CB-CG2 4.38Å; C203-T242 WeakPolarHBondContact O-CA 3.35Å; C203-A243 PolarHBondContact O-N 2.83Å
204	G	93.3	Very high	82.6	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	109	169.6	0	0	0	0	0	110.1	V144 E145 I202 R206 Y267	V144-G204 CarbonylContact C-O 3.48Å; V144-G204 WeakPolarHBondContact CA-O 3.48Å; E145-G204 PolarHBondContact N-O 2.87Å; E145-G204 PolarHBondContact O-N 3.33Å; I202-G204 PolarHBondContact O-N 3.09Å; G204-R206 PolarHBondContact O-N 3.47Å; G204-Y267 VanDerWaalsContact C-OH 3.23Å; G204-Y267 PolarHBondContact O-OH 3.24Å
205	I	94.7	Very high	84.6	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	98	174.7	-57.4	162.6	0	0	0	107.5	V144 C203 I208 L224 T242 A243 F244 S245	V144-I205 HydrophobicContact CG1-CG1 4.38Å; C203-I205 PolarHBondContact O-N 2.93Å; I205-I208 HydrophobicContact CG2-CB 4.16Å; I205-I208 HydrophobicContact CG2-CG2 4.42Å; I205-L224 HydrophobicContact CD1-CD1 3.56Å; I205-L224 HydrophobicContact CD1-CD2 3.86Å; I205-L224 HydrophobicContact CD1-CG 4.36Å; I205-L224 HydrophobicContact CG1-CD2 4.05Å; I205-L224 HydrophobicContact CG2-CD2 4.43Å; I205-T242 HydrophobicContact CD1-CG2 4.18Å; I205-A243 PolarHBondContact N-O 3.29Å; I205-F244 HydrophobicContact CB-CD1 4.04Å; I205-F244 HydrophobicContact CB-CE1 4.32Å; I205-F244 HydrophobicContact CD1-CD1 3.96Å; I205-F244 HydrophobicContact CD1-CE1 3.44Å; I205-F244 VanDerWaalsContact CD1-CE1 3.44Å; I205-F244 HydrophobicContact CD1-CE2 4.23Å; I205-F244 HydrophobicContact CD1-CZ 3.59Å; I205-F244 HydrophobicContact CG1-CE1 4.5Å; I205-F244 HydrophobicContact CG2-CD1 4.1Å; I205-F244 HydrophobicContact CG2-CE1 4.27Å; I205-S245 PolarHBondContact O-N 2.97Å
206	R	90.7	Very high	86.6	Confident	55 Å²	55	55 Å²	55	21%	0.208	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	-44.8	179.5	-172.4	168.6	175.7	77.5	8.6	111.5	D104 W125 I143 G204 Y267	D104-R206 IonicContact OD1-CZ 2.72Å; D104-R206 IonicContact OD1-NE 3.87Å; D104-R206 IonicContact OD1-NH2 3.67Å; D104-R206 PolarHBondContact OD1-NH2 3.33Å; D104-R206 IonicContact OD2-CZ 3.35Å; D104-R206 VanDerWaalsContact OD2-CZ 3.28Å; D104-R206 IonicContact OD2-NE 3.14Å; D104-R206 PolarHBondContact OD2-NE 2.93Å; D104-R206 IonicContact OD2-NH2 3.29Å; D104-R206 PolarHBondContact OD2-NH2 3.03Å; W125-R206 VanDerWaalsContact CZ2-CD 3.45Å; I143-R206 HydrophobicContact CG2-CB 4.4Å; I143-R206 PolarHBondContact O-N 3.47Å; G204-R206 PolarHBondContact O-N 3.47Å; R206-Y267 WeakPolarHBondContact CA-OH 3.48Å; R206-Y267 WeakPolarHBondContact CB-OH 3.5Å; R206-Y267 PolarHBondContact N-OH 2.98Å
207	R	91.7	Very high	88.3	Confident	45 Å²	45	60.6 Å²	60.6	17%	0.17	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	143.8	175.2	-69.1	-165.4	169.3	-120.7	-19.7	111.2	M97 G102 Y103 D104 C142 I143	M97-R207 HydrophobicContact CE-CB 3.83Å; G102-R207 PolarHBondContact O-NH1 3.37Å; Y103-R207 PolarHBondContact O-NH2 2.7Å; D104-R207 IonicContact OD1-CZ 2.98Å; D104-R207 IonicContact OD1-NE 3.88Å; D104-R207 PolarHBondContact OD1-NE 2.89Å; D104-R207 IonicContact OD1-NH2 3.39Å; D104-R207 PolarHBondContact OD1-NH2 3.38Å; D104-R207 IonicContact OD2-NE 3.28Å; C142-R207 CarbonylContact C-O 3.51Å; C142-R207 WeakPolarHBondContact CA-O 3.49Å; C142-R207 VanDerWaalsContact CB-O 3.28Å; C142-R207 WeakPolarHBondContact CB-O 3.49Å; I143-R207 HydrophobicContact CB-CB 4.26Å; I143-R207 HydrophobicContact CD1-CB 4.32Å; I143-R207 HydrophobicContact CG1-CB 4.32Å; I143-R207 PolarHBondContact N-O 3.22Å; I143-R207 PolarHBondContact O-N 3.48Å; I143-R207 VanDerWaalsContact O-N 3.15Å
208	I	94.9	Very high	89.7	Confident	31 Å²	31	58 Å²	58	16%	0.159	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	132.2	167	-173.5	166	0	0	0	109.5	C142 I205 A220 L224 F254	C142-I208 HydrophobicContact CB-CB 4.3Å; C142-I208 HydrophobicContact CB-CG1 4.25Å; I205-I208 HydrophobicContact CG2-CB 4.16Å; I205-I208 HydrophobicContact CG2-CG2 4.42Å; I208-A220 HydrophobicContact CD1-CB 3.83Å; I208-L224 HydrophobicContact CD1-CD1 3.71Å; I208-L224 HydrophobicContact CD1-CD2 4.07Å; I208-L224 HydrophobicContact CD1-CG 3.68Å; I208-F254 HydrophobicContact CD1-CD1 4.41Å; I208-F254 HydrophobicContact CD1-CE1 3.68Å; I208-F254 HydrophobicContact CD1-CZ 4.05Å
209	W	95.5	Very high	91.1	Very high	8 Å²	8	54.2 Å²	54.2	3%	0.03	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	141.1	-178.2	176.7	79.5	0	0	0	110.2	L96 M97 D100 L101 V138 G140 C141 E211	L96-W209 HydrophobicContact CD2-CH2 3.55Å; L96-W209 HydrophobicContact CD2-CZ2 4.26Å; L96-W209 HydrophobicContact CD2-CZ3 4.08Å; L96-W209 HydrophobicContact CG-CH2 3.83Å; L96-W209 HydrophobicContact CG-CZ2 4.04Å; M97-W209 HydrophobicContact CE-CB 3.94Å; M97-W209 HydrophobicContact CG-CB 3.92Å; M97-W209 HydrophobicContact CG-CD2 3.99Å; M97-W209 HydrophobicContact CG-CE3 4.11Å; M97-W209 HydrophobicContact CG-CG 3.92Å; D100-W209 PolarHBondContact OD2-NE1 3.36Å; L101-W209 HydrophobicContact CD1-CB 3.87Å; L101-W209 HydrophobicContact CD1-CG 4.35Å; V138-W209 HydrophobicContact CG1-CZ3 4.39Å; G140-W209 CarbonylContact C-O 3.56Å; G140-W209 WeakPolarHBondContact CA-O 3.15Å; C141-W209 HydrophobicContact CB-CE3 4.2Å; C141-W209 PolarHBondContact N-O 2.95Å; C141-W209 PolarHBondContact O-N 2.74Å; W209-E211 HydrophobicContact CH2-CB 3.83Å; W209-E211 HydrophobicContact CH2-CG 4.46Å; W209-E211 HydrophobicContact CZ2-CB 4.02Å; W209-E211 HydrophobicContact CZ2-CG 4.5Å
210	V	95.8	Very high	92.4	Very high	13 Å²	13	49.2 Å²	49.2	8%	0.079	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	133.8	169.7	176.4	0	0	0	0	107.6	V139 H212 H214 R215 I219 A220	V139-V210 CarbonylContact O-C 3.58Å; V139-V210 WeakPolarHBondContact O-CA 3.47Å; V139-V210 WeakPolarHBondContact O-CG1 3.41Å; V210-H212 PolarHBondContact O-N 2.84Å; V210-H214 HydrophobicContact CG1-CB 4.35Å; V210-R215 HydrophobicContact CB-CG 4.13Å; V210-R215 HydrophobicContact CG1-CG 4.02Å; V210-R215 PolarHBondContact O-NE 3.27Å; V210-R215 PolarHBondContact O-NH2 3.24Å; V210-I219 HydrophobicContact CG1-CB 4.17Å; V210-I219 HydrophobicContact CG1-CD1 4.41Å; V210-I219 HydrophobicContact CG1-CG2 4.11Å; V210-I219 HydrophobicContact CG2-CB 4.37Å; V210-I219 HydrophobicContact CG2-CG2 3.99Å; V210-A220 HydrophobicContact CG2-CB 3.83Å
211	E	92.8	Very high	93.1	Very high	28 Å²	28	50.6 Å²	50.6	13%	0.131	24%	0.235	C	C	.	.			trans	-51.5	133.1	176.2	-171.8	-169.3	169.2	0	0	109.5	V139 W209 K213 H214 R215	V139-E211 HydrophobicContact CB-CB 4.49Å; V139-E211 PolarHBondContact O-N 2.87Å; W209-E211 HydrophobicContact CH2-CB 3.83Å; W209-E211 HydrophobicContact CH2-CG 4.46Å; W209-E211 HydrophobicContact CZ2-CB 4.02Å; W209-E211 HydrophobicContact CZ2-CG 4.5Å; E211-K213 PolarHBondContact O-N 2.75Å; E211-K213 VanDerWaalsContact O-N 3.07Å; E211-H214 CarbonylContact O-C 3.52Å; E211-H214 PolarHBondContact O-N 2.58Å; E211-H214 IonicContact OE2-CE1 3.82Å; E211-H214 PolarHBondContact OE2-CE1 2.76Å; E211-H214 IonicContact OE2-ND1 3.32Å; E211-H214 PolarHBondContact OE2-ND1 2.75Å; E211-R215 PolarHBondContact O-N 3.33Å
212	H	87.9	Confident	93.4	Very high	136 Å²	136	51 Å²	51	63%	0.63	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-48.3	-42.7	-175.3	-177.3	80.5	0	0	0	113.5	V210 H214 R215	V210-H212 PolarHBondContact O-N 2.84Å; H212-H214 PolarHBondContact O-N 2.7Å; H212-H214 VanDerWaalsContact O-N 3.14Å; H212-R215 PolarHBondContact O-N 2.68Å
213	K	88.4	Confident	93.8	Very high	103 Å²	103	51 Å²	51	45%	0.448	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-67.6	-11.3	-179.1	-64.6	174.8	-174.5	164.8	0	114.1	F53 E211 K217	F53-K213 VanDerWaalsContact CD1-NZ 3.34Å; F53-K213 VanDerWaalsContact CG-NZ 3.33Å; E211-K213 PolarHBondContact O-N 2.75Å; E211-K213 VanDerWaalsContact O-N 3.07Å; K213-K217 PolarHBondContact O-NZ 3.05Å
214	H	91.4	Very high	93.9	Very high	26 Å²	26	51 Å²	51	12%	0.12	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-124.9	6.1	-175.6	-53.5	65.6	0	0	0	113.5	K132 V139 V210 E211 H212 I219	K132-H214 WeakPolarHBondContact CD-NE2 3.42Å; K132-H214 WeakPolarHBondContact CE-NE2 3.3Å; V139-H214 HydrophobicContact CB-CB 4.47Å; V210-H214 HydrophobicContact CG1-CB 4.35Å; E211-H214 CarbonylContact O-C 3.52Å; E211-H214 PolarHBondContact O-N 2.58Å; E211-H214 IonicContact OE2-CE1 3.82Å; E211-H214 PolarHBondContact OE2-CE1 2.76Å; E211-H214 IonicContact OE2-ND1 3.32Å; E211-H214 PolarHBondContact OE2-ND1 2.75Å; H212-H214 PolarHBondContact O-N 2.7Å; H212-H214 VanDerWaalsContact O-N 3.14Å; H214-I219 HydrophobicContact CB-CD1 3.5Å; H214-I219 VanDerWaalsContact CB-CD1 3.5Å
215	R	93.1	Very high	94.1	Very high	86 Å²	86	53.1 Å²	53.1	33%	0.325	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	156.7	170.7	-66.1	-179.4	-171.8	168.9	6.6	110.8	D100 V210 E211 H212 K217	D100-R215 IonicContact OD2-NH2 2.73Å; D100-R215 PolarHBondContact OD2-NH2 2.58Å; V210-R215 HydrophobicContact CB-CG 4.13Å; V210-R215 HydrophobicContact CG1-CG 4.02Å; V210-R215 PolarHBondContact O-NE 3.27Å; V210-R215 PolarHBondContact O-NH2 3.24Å; E211-R215 PolarHBondContact O-N 3.33Å; H212-R215 PolarHBondContact O-N 2.68Å; R215-K217 PolarHBondContact O-N 2.76Å; R215-K217 VanDerWaalsContact O-N 3.16Å
216	R	92.9	Very high	94.2	Very high	242 Å²	242	53 Å²	53	91%	0.913	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.7	18.6	178.3	-49	-53	-58.8	-89.7	0.5	115.4
217	K	93.5	Very high	94.5	Very high	143 Å²	143	50.4 Å²	50.4	62%	0.622	24%	0.236	S	C	*	.	S	Bend	trans	-106.2	20	173.8	-62.7	175.7	-178	165.3	0	113.2	K213 R215 I219	K213-K217 PolarHBondContact O-NZ 3.05Å; R215-K217 PolarHBondContact O-N 2.76Å; R215-K217 VanDerWaalsContact O-N 3.16Å; K217-I219 VanDerWaalsContact C-N 3.27Å; K217-I219 HydrophobicContact CB-CG1 4.5Å; K217-I219 PolarHBondContact O-N 2.89Å
218	G	94.2	Very high	94.8	Very high	41 Å²	41	48.3 Å²	48.3	42%	0.423	23%	0.229	S	C	.	.	S	Bend	trans	75.9	2.6	-178.4	0	0	0	0	0	115.9	A220 T221 N222	G218-A220 PolarHBondContact O-N 3.33Å; G218-T221 WeakPolarHBondContact O-CB 3.49Å; G218-T221 PolarHBondContact O-N 2.91Å; G218-N222 WeakPolarHBondContact O-CB 3.21Å; G218-N222 PolarHBondContact O-N 3.17Å
219	I	96.5	Very high	94.8	Very high	14 Å²	14	51.9 Å²	51.9	7%	0.072	25%	0.245	C	C	.	.	H	α-helix	trans	-59.8	-49.3	-177.2	-65.3	-176.3	0	0	0	112.6	Y130 V139 V210 H214 K217 T221 N222 L223	Y130-I219 HydrophobicContact CD1-CG2 4.08Å; Y130-I219 HydrophobicContact CD2-CG2 3.72Å; Y130-I219 HydrophobicContact CE1-CG2 4.47Å; Y130-I219 HydrophobicContact CE2-CG2 4.1Å; Y130-I219 HydrophobicContact CG-CG2 3.69Å; V139-I219 HydrophobicContact CG2-CD1 3.96Å; V210-I219 HydrophobicContact CG1-CB 4.17Å; V210-I219 HydrophobicContact CG1-CD1 4.41Å; V210-I219 HydrophobicContact CG1-CG2 4.11Å; V210-I219 HydrophobicContact CG2-CB 4.37Å; V210-I219 HydrophobicContact CG2-CG2 3.99Å; H214-I219 HydrophobicContact CB-CD1 3.5Å; H214-I219 VanDerWaalsContact CB-CD1 3.5Å; K217-I219 VanDerWaalsContact C-N 3.27Å; K217-I219 HydrophobicContact CB-CG1 4.5Å; K217-I219 PolarHBondContact O-N 2.89Å; I219-T221 VanDerWaalsContact C-N 3.29Å; I219-T221 PolarHBondContact O-N 2.87Å; I219-N222 PolarHBondContact O-N 2.91Å; I219-L223 WeakPolarHBondContact O-CB 3.18Å; I219-L223 PolarHBondContact O-N 3.44Å
220	A	96.8	Very high	94.8	Very high	17 Å²	17	54.8 Å²	54.8	14%	0.14	26%	0.261	C	S	.	.	H	α-helix	trans	-60.3	-41.2	179.2	0	0	0	0	0	111.8	I208 V210 G218 L224 F254	I208-A220 HydrophobicContact CD1-CB 3.83Å; V210-A220 HydrophobicContact CG2-CB 3.83Å; G218-A220 PolarHBondContact O-N 3.33Å; A220-L224 PolarHBondContact O-N 3.17Å; A220-F254 HydrophobicContact CB-CD2 4.12Å; A220-F254 HydrophobicContact CB-CE1 4.36Å; A220-F254 HydrophobicContact CB-CE2 3.51Å; A220-F254 HydrophobicContact CB-CZ 3.65Å
221	T	96.9	Very high	94.7	Very high	41 Å²	41	54.3 Å²	54.3	25%	0.252	26%	0.258	S	S	.	.	H	α-helix	trans	-63.7	-50.3	176.2	-53.7	0	0	0	0	111.2	G218 I219 L223 L224 D225 Y258	G218-T221 WeakPolarHBondContact O-CB 3.49Å; G218-T221 PolarHBondContact O-N 2.91Å; I219-T221 VanDerWaalsContact C-N 3.29Å; I219-T221 PolarHBondContact O-N 2.87Å; T221-L223 VanDerWaalsContact C-N 3.33Å; T221-L223 PolarHBondContact O-N 3.34Å; T221-L224 PolarHBondContact O-N 3.24Å; T221-D225 WeakPolarHBondContact O-CB 3.09Å; T221-D225 VanDerWaalsContact O-CG 3.24Å; T221-D225 PolarHBondContact O-N 2.83Å; T221-Y258 HydrophobicContact CG2-CD2 4.01Å; T221-Y258 HydrophobicContact CG2-CE2 3.96Å
222	N	96.2	Very high	94.6	Very high	40 Å²	40	54.4 Å²	54.4	21%	0.214	26%	0.259	C	S	.	.	H	α-helix	trans	-63	-39.9	179.4	-176.5	-106.5	0	0	0	112	M68 N70 Y130 G218 I219 A226	M68-N222 PolarHBondContact SD-ND2 2.82Å; M68-N222 VanDerWaalsContact SD-ND2 3.37Å; N70-N222 PolarHBondContact ND2-OD1 2.68Å; Y130-N222 HydrophobicContact CE2-CB 4.27Å; Y130-N222 VanDerWaalsContact CE2-OD1 3.29Å; Y130-N222 WeakPolarHBondContact CE2-OD1 3.25Å; G218-N222 WeakPolarHBondContact O-CB 3.21Å; G218-N222 PolarHBondContact O-N 3.17Å; I219-N222 PolarHBondContact O-N 2.91Å; N222-A226 WeakPolarHBondContact O-CB 3.29Å; N222-A226 PolarHBondContact O-N 3.41Å
223	L	97.7	Very high	94.6	Very high	0 Å²	0	59 Å²	59	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-58.9	-53.6	174.5	175.6	58.4	0	0	0	111.1	V76 F128 Y130 C142 I219 T221 A226 V227	V76-L223 HydrophobicContact CG1-CD1 3.44Å; V76-L223 VanDerWaalsContact CG1-CD1 3.44Å; V76-L223 HydrophobicContact CG2-CD1 4.44Å; F128-L223 HydrophobicContact CB-CD1 4.04Å; Y130-L223 HydrophobicContact CD2-CB 4.43Å; C142-L223 HydrophobicContact CB-CD2 4Å; C142-L223 HydrophobicContact CB-CG 4.43Å; I219-L223 WeakPolarHBondContact O-CB 3.18Å; I219-L223 PolarHBondContact O-N 3.44Å; T221-L223 VanDerWaalsContact C-N 3.33Å; T221-L223 PolarHBondContact O-N 3.34Å; L223-A226 PolarHBondContact O-N 3.28Å; L223-V227 VanDerWaalsContact O-CG2 3.3Å; L223-V227 WeakPolarHBondContact O-CG2 3.49Å; L223-V227 PolarHBondContact O-N 3.37Å
224	L	97.7	Very high	94.7	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-69	-38.6	-179.5	-70.7	-174.8	0	0	0	112.8	C142 I205 I208 A220 T221 A226 V227 L228 F244 F254 Y258	C142-L224 HydrophobicContact CB-CD2 4.32Å; I205-L224 HydrophobicContact CD1-CD1 3.56Å; I205-L224 HydrophobicContact CD1-CD2 3.86Å; I205-L224 HydrophobicContact CD1-CG 4.36Å; I205-L224 HydrophobicContact CG1-CD2 4.05Å; I205-L224 HydrophobicContact CG2-CD2 4.43Å; I208-L224 HydrophobicContact CD1-CD1 3.71Å; I208-L224 HydrophobicContact CD1-CD2 4.07Å; I208-L224 HydrophobicContact CD1-CG 3.68Å; A220-L224 PolarHBondContact O-N 3.17Å; T221-L224 PolarHBondContact O-N 3.24Å; L224-A226 VanDerWaalsContact C-N 3.29Å; L224-A226 PolarHBondContact O-N 3.25Å; L224-V227 CarbonylContact O-C 3.59Å; L224-V227 WeakPolarHBondContact O-CB 3.21Å; L224-V227 PolarHBondContact O-N 3.26Å; L224-V227 VanDerWaalsContact O-N 3.12Å; L224-L228 VanDerWaalsContact O-CG 3.31Å; L224-L228 WeakPolarHBondContact O-CG 3.48Å; L224-L228 PolarHBondContact O-N 3.25Å; L224-F244 HydrophobicContact CD1-CE1 4.45Å; L224-F254 HydrophobicContact CD1-CE1 3.57Å; L224-F254 HydrophobicContact CD1-CZ 3.77Å; L224-Y258 HydrophobicContact CB-CE1 4.17Å; L224-Y258 HydrophobicContact CB-CE2 3.95Å; L224-Y258 WeakPolarHBondContact CB-OH 3.33Å; L224-Y258 HydrophobicContact CD1-CD1 4.12Å; L224-Y258 HydrophobicContact CD1-CE1 3.81Å; L224-Y258 HydrophobicContact CD1-CE2 4.36Å
225	D	97.3	Very high	94.6	Very high	43 Å²	43	60 Å²	60	23%	0.23	30%	0.3	C	S	.	.	H	α-helix	trans	-58.2	-45.8	175.5	-75.6	-26.5	0	0	0	110.3	T221 V227 L228 Q229 R239 Y258	T221-D225 WeakPolarHBondContact O-CB 3.09Å; T221-D225 VanDerWaalsContact O-CG 3.24Å; T221-D225 PolarHBondContact O-N 2.83Å; D225-V227 VanDerWaalsContact C-N 3.31Å; D225-V227 PolarHBondContact O-N 3.43Å; D225-L228 PolarHBondContact O-N 3.38Å; D225-Q229 VanDerWaalsContact O-CG 3.28Å; D225-Q229 WeakPolarHBondContact O-CG 3.34Å; D225-Q229 PolarHBondContact O-N 2.95Å; D225-Q229 VanDerWaalsContact O-N 3.13Å; D225-R239 VanDerWaalsContact CG-NH2 3.34Å; D225-R239 IonicContact OD1-CZ 3.2Å; D225-R239 IonicContact OD1-NE 3.62Å; D225-R239 PolarHBondContact OD1-NE 3.44Å; D225-R239 IonicContact OD1-NH2 3.82Å; D225-R239 PolarHBondContact OD1-NH2 3.39Å; D225-R239 VanDerWaalsContact OD1-NH2 3.14Å; D225-R239 IonicContact OD2-CZ 3.88Å; D225-R239 IonicContact OD2-NE 3.08Å; D225-R239 IonicContact OD2-NH2 3.7Å; D225-R239 PolarHBondContact OD2-NH2 3.46Å; D225-Y258 PolarHBondContact N-OH 3.13Å; D225-Y258 PolarHBondContact OD1-OH 2.7Å
226	A	97	Very high	94.6	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-59.6	-42.6	175.5	0	0	0	0	0	112	I67 M68 V76 N222 L223 L224 Q229 N230	I67-A226 HydrophobicContact CD1-CB 3.74Å; I67-A226 HydrophobicContact CG1-CB 4.28Å; M68-A226 HydrophobicContact CB-CB 4.07Å; M68-A226 HydrophobicContact CE-CB 3.54Å; M68-A226 HydrophobicContact SD-CB 4.04Å; V76-A226 HydrophobicContact CB-CB 3.91Å; V76-A226 HydrophobicContact CG1-CB 3.92Å; V76-A226 HydrophobicContact CG2-CB 4Å; N222-A226 WeakPolarHBondContact O-CB 3.29Å; N222-A226 PolarHBondContact O-N 3.41Å; L223-A226 PolarHBondContact O-N 3.28Å; L224-A226 VanDerWaalsContact C-N 3.29Å; L224-A226 PolarHBondContact O-N 3.25Å; A226-Q229 PolarHBondContact O-N 3.04Å; A226-N230 PolarHBondContact O-N 3.05Å; A226-N230 PolarHBondContact O-ND2 3.17Å
227	V	97.3	Very high	94.6	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.7	-49.7	176.2	170.9	0	0	0	0	111.1	F128 V144 L223 L224 D225 Q229 N230 L231	F128-V227 HydrophobicContact CB-CG2 3.66Å; F128-V227 HydrophobicContact CD1-CG2 3.76Å; F128-V227 HydrophobicContact CD2-CG1 4.26Å; F128-V227 HydrophobicContact CD2-CG2 3.66Å; F128-V227 HydrophobicContact CE1-CG2 4.25Å; F128-V227 HydrophobicContact CE2-CG1 4.12Å; F128-V227 HydrophobicContact CE2-CG2 4.18Å; F128-V227 HydrophobicContact CG-CG2 3.41Å; F128-V227 VanDerWaalsContact CG-CG2 3.41Å; F128-V227 HydrophobicContact CZ-CG1 4.46Å; F128-V227 HydrophobicContact CZ-CG2 4.44Å; V144-V227 HydrophobicContact CB-CG1 4.49Å; V144-V227 HydrophobicContact CG1-CG1 4.15Å; V144-V227 HydrophobicContact CG2-CG1 3.93Å; L223-V227 VanDerWaalsContact O-CG2 3.3Å; L223-V227 WeakPolarHBondContact O-CG2 3.49Å; L223-V227 PolarHBondContact O-N 3.37Å; L224-V227 CarbonylContact O-C 3.59Å; L224-V227 WeakPolarHBondContact O-CB 3.21Å; L224-V227 PolarHBondContact O-N 3.26Å; L224-V227 VanDerWaalsContact O-N 3.12Å; D225-V227 VanDerWaalsContact C-N 3.31Å; D225-V227 PolarHBondContact O-N 3.43Å; V227-Q229 PolarHBondContact O-N 3.28Å; V227-N230 CarbonylContact O-C 3.6Å; V227-N230 PolarHBondContact O-N 2.92Å; V227-L231 HydrophobicContact CG1-CB 4.4Å; V227-L231 HydrophobicContact CG1-CD1 4.46Å; V227-L231 WeakPolarHBondContact O-CA 3.38Å; V227-L231 VanDerWaalsContact O-CB 3.32Å; V227-L231 WeakPolarHBondContact O-CB 3.11Å; V227-L231 PolarHBondContact O-N 3.21Å
228	L	96.5	Very high	94.6	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.01	25%	0.25	C	S	.	.	H	α-helix	trans	-61.9	-31.5	-177.6	-66.2	-178.5	0	0	0	112.9	C203 L224 D225 N230 L237 R239 T242 Y258	C203-L228 HydrophobicContact CB-CD2 3.41Å; C203-L228 VanDerWaalsContact CB-CD2 3.41Å; L224-L228 VanDerWaalsContact O-CG 3.31Å; L224-L228 WeakPolarHBondContact O-CG 3.48Å; L224-L228 PolarHBondContact O-N 3.25Å; D225-L228 PolarHBondContact O-N 3.38Å; L228-N230 VanDerWaalsContact C-N 3.32Å; L228-L237 HydrophobicContact CB-CB 4.15Å; L228-L237 HydrophobicContact CD2-CB 3.98Å; L228-L237 HydrophobicContact CD2-CD1 4.33Å; L228-L237 PolarHBondContact O-N 2.97Å; L228-R239 HydrophobicContact CD1-CG 4.2Å; L228-T242 HydrophobicContact CD1-CG2 3.66Å; L228-T242 HydrophobicContact CD2-CG2 3.56Å; L228-T242 HydrophobicContact CG-CG2 4.17Å; L228-Y258 HydrophobicContact CD1-CE1 4.34Å; L228-Y258 WeakPolarHBondContact CD1-OH 3.45Å
229	Q	95.9	Very high	94.6	Very high	106 Å²	106	46.3 Å²	46.3	50%	0.495	25%	0.248	S	C	.	.	H	α-helix	trans	-73.6	-21.7	175.1	-64.4	-60.9	-49.3	0	0	113.4	D225 A226 V227	D225-Q229 VanDerWaalsContact O-CG 3.28Å; D225-Q229 WeakPolarHBondContact O-CG 3.34Å; D225-Q229 PolarHBondContact O-N 2.95Å; D225-Q229 VanDerWaalsContact O-N 3.13Å; A226-Q229 PolarHBondContact O-N 3.04Å; V227-Q229 PolarHBondContact O-N 3.28Å
230	N	94.9	Very high	94.2	Very high	68 Å²	68	47.7 Å²	47.7	36%	0.364	26%	0.258	S	S	.	.	H	α-helix	trans	-125.6	0.6	-170.2	-66.8	-81.7	0	0	0	114.6	I67 A226 V227 L228	I67-N230 HydrophobicContact CB-CB 4.3Å; I67-N230 HydrophobicContact CD1-CB 4.37Å; I67-N230 HydrophobicContact CG2-CB 4.18Å; A226-N230 PolarHBondContact O-N 3.05Å; A226-N230 PolarHBondContact O-ND2 3.17Å; V227-N230 CarbonylContact O-C 3.6Å; V227-N230 PolarHBondContact O-N 2.92Å; L228-N230 VanDerWaalsContact C-N 3.32Å
231	L	92.9	Very high	93.9	Very high	4 Å²	4	48.8 Å²	48.8	2%	0.021	26%	0.26	C	S	.	.	S	Bend	trans	-67	-49.7	-177.8	-175.4	67.2	0	0	0	110.5	R126 F128 V144 C203 V227 L237	R126-L231 PolarHBondContact NH1-O 3.23Å; F128-L231 HydrophobicContact CE2-CD1 4.42Å; V144-L231 HydrophobicContact CG2-CD1 3.8Å; C203-L231 HydrophobicContact CB-CD2 3.68Å; V227-L231 HydrophobicContact CG1-CB 4.4Å; V227-L231 HydrophobicContact CG1-CD1 4.46Å; V227-L231 WeakPolarHBondContact O-CA 3.38Å; V227-L231 VanDerWaalsContact O-CB 3.32Å; V227-L231 WeakPolarHBondContact O-CB 3.11Å; V227-L231 PolarHBondContact O-N 3.21Å; L231-L237 HydrophobicContact CD2-CD1 3.93Å
232	I	91.3	Very high	93.8	Very high	29 Å²	29	46.9 Å²	46.9	15%	0.149	25%	0.248	C	C	.	.	S	Bend	trans	-113.1	124.1	179.3	-55	178.2	0	0	0	108.2	E146 P201 G234 L235 L237	E146-I232 HydrophobicContact CG-CD1 3.87Å; E146-I232 HydrophobicContact CG-CG1 4.18Å; P201-I232 HydrophobicContact CB-CD1 3.33Å; P201-I232 HydrophobicContact CG-CD1 3.88Å; I232-G234 PolarHBondContact O-N 3.36Å; I232-L235 HydrophobicContact CB-CB 4.21Å; I232-L235 HydrophobicContact CG2-CB 3.94Å; I232-L235 HydrophobicContact CG2-CD2 4.43Å; I232-L235 PolarHBondContact O-N 3.47Å; I232-L235 VanDerWaalsContact O-N 3.09Å; I232-L237 HydrophobicContact CD1-CD1 4.35Å; I232-L237 HydrophobicContact CD1-CD2 4.33Å
233	Y	88.8	Confident	93.6	Very high	232 Å²	232	45 Å²	45	91%	0.91	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	125	-178.1	179.6	-96.8	0	0	0	111	L235	Y233-L235 PolarHBondContact O-N 3.01Å
234	G	89	Confident	93.4	Very high	71 Å²	71	45.3 Å²	45.3	73%	0.732	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	72	5	179	0	0	0	0	0	115.1	I232	I232-G234 PolarHBondContact O-N 3.36Å
235	L	91.1	Very high	93	Very high	80 Å²	80	46.4 Å²	46.4	42%	0.419	25%	0.247	S	C	.	.			trans	-133.4	84.5	178.4	-174.5	63.4	0	0	0	111.2	P201 I232 Y233 L237	P201-L235 HydrophobicContact CG-CD2 3.49Å; P201-L235 VanDerWaalsContact CG-CD2 3.49Å; I232-L235 HydrophobicContact CB-CB 4.21Å; I232-L235 HydrophobicContact CG2-CB 3.94Å; I232-L235 HydrophobicContact CG2-CD2 4.43Å; I232-L235 PolarHBondContact O-N 3.47Å; I232-L235 VanDerWaalsContact O-N 3.09Å; Y233-L235 PolarHBondContact O-N 3.01Å; L235-L237 PolarHBondContact O-N 3.42Å
236	P	92.8	Very high	92.3	Very high	72 Å²	72	52.8 Å²	52.8	47%	0.468	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-60.9	131	172	-23.3	35.1	0	0	0	111.6
237	L	93.4	Very high	91.8	Very high	5 Å²	5	53.3 Å²	53.3	3%	0.026	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-91.5	148.5	178.3	-59.7	179.6	0	0	0	111.4	P201 C203 L228 L231 I232 L235 Q241	P201-L237 HydrophobicContact CB-CD2 4.38Å; P201-L237 HydrophobicContact CG-CD2 4.07Å; C203-L237 HydrophobicContact CB-CD1 3.91Å; L228-L237 HydrophobicContact CB-CB 4.15Å; L228-L237 HydrophobicContact CD2-CB 3.98Å; L228-L237 HydrophobicContact CD2-CD1 4.33Å; L228-L237 PolarHBondContact O-N 2.97Å; L231-L237 HydrophobicContact CD2-CD1 3.93Å; I232-L237 HydrophobicContact CD1-CD1 4.35Å; I232-L237 HydrophobicContact CD1-CD2 4.33Å; L235-L237 PolarHBondContact O-N 3.42Å; L237-Q241 HydrophobicContact CB-CB 4.47Å
238	S	92.2	Very high	91.4	Very high	47 Å²	47	55.6 Å²	55.6	33%	0.329	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-83.7	157.6	171.6	63.4	0	0	0	0	111.6	T240 Q241	S238-T240 PolarHBondContact O-N 3.43Å; S238-T240 VanDerWaalsContact O-N 3.14Å; S238-T240 PolarHBondContact OG-OG1 3.25Å; S238-Q241 WeakPolarHBondContact O-CB 3.17Å; S238-Q241 PolarHBondContact O-N 3.32Å; S238-Q241 WeakPolarHBondContact OG-CG 3.36Å; S238-Q241 PolarHBondContact OG-OE1 3.07Å
239	R	93.8	Very high	90.9	Very high	100 Å²	100	55.6 Å²	55.6	38%	0.377	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-60.8	-21.8	174.7	-61.5	-167.9	-176.8	164	-0.7	113.4	D225 L228 Q241 T242 Y258	D225-R239 VanDerWaalsContact CG-NH2 3.34Å; D225-R239 IonicContact OD1-CZ 3.2Å; D225-R239 IonicContact OD1-NE 3.62Å; D225-R239 PolarHBondContact OD1-NE 3.44Å; D225-R239 IonicContact OD1-NH2 3.82Å; D225-R239 PolarHBondContact OD1-NH2 3.39Å; D225-R239 VanDerWaalsContact OD1-NH2 3.14Å; D225-R239 IonicContact OD2-CZ 3.88Å; D225-R239 IonicContact OD2-NE 3.08Å; D225-R239 IonicContact OD2-NH2 3.7Å; D225-R239 PolarHBondContact OD2-NH2 3.46Å; L228-R239 HydrophobicContact CD1-CG 4.2Å; R239-Q241 VanDerWaalsContact C-N 3.27Å; R239-T242 PolarHBondContact O-OG1 3.47Å; R239-Y258 HydrophobicContact CB-CE1 4.07Å; R239-Y258 WeakPolarHBondContact CD-O 3.45Å; R239-Y258 HydrophobicContact CG-CE1 3.95Å; R239-Y258 HydrophobicContact CG-CE2 4.22Å
240	T	89	Confident	90.5	Very high	44 Å²	44	54.5 Å²	54.5	27%	0.27	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-75.8	-16.4	174.5	47.4	0	0	0	0	113.2	S238 T242	S238-T240 PolarHBondContact O-N 3.43Å; S238-T240 VanDerWaalsContact O-N 3.14Å; S238-T240 PolarHBondContact OG-OG1 3.25Å; T240-T242 VanDerWaalsContact C-N 3.28Å; T240-T242 PolarHBondContact O-N 3.03Å
241	Q	90.9	Very high	90.4	Very high	40 Å²	40	51.9 Å²	51.9	19%	0.187	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-94.5	36.7	174.8	-66.2	168.1	-81.9	0	0	111.6	P201 C203 L237 S238 R239	P201-Q241 PolarHBondContact O-NE2 2.88Å; P201-Q241 VanDerWaalsContact O-NE2 3.08Å; C203-Q241 PolarHBondContact N-O 3.38Å; L237-Q241 HydrophobicContact CB-CB 4.47Å; S238-Q241 WeakPolarHBondContact O-CB 3.17Å; S238-Q241 PolarHBondContact O-N 3.32Å; S238-Q241 WeakPolarHBondContact OG-CG 3.36Å; S238-Q241 PolarHBondContact OG-OE1 3.07Å; R239-Q241 VanDerWaalsContact C-N 3.27Å
242	T	93.5	Very high	90.2	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.006	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	132.8	173.1	64.4	0	0	0	0	110.7	C203 I205 L228 R239 T240 Y258	C203-T242 HydrophobicContact CB-CG2 4.38Å; C203-T242 WeakPolarHBondContact O-CA 3.35Å; I205-T242 HydrophobicContact CD1-CG2 4.18Å; L228-T242 HydrophobicContact CD1-CG2 3.66Å; L228-T242 HydrophobicContact CD2-CG2 3.56Å; L228-T242 HydrophobicContact CG-CG2 4.17Å; R239-T242 PolarHBondContact O-OG1 3.47Å; T240-T242 VanDerWaalsContact C-N 3.28Å; T240-T242 PolarHBondContact O-N 3.03Å; T242-Y258 HydrophobicContact CG2-CE1 4.1Å
243	A	92.8	Very high	90.3	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	143.1	171.4	0	0	0	0	0	109.9	L147 L159 I202 C203 I205 L265 Y267	L147-A243 HydrophobicContact CD1-CB 4.21Å; L159-A243 HydrophobicContact CD1-CB 3.57Å; I202-A243 HydrophobicContact CG2-CB 3.89Å; C203-A243 PolarHBondContact O-N 2.83Å; I205-A243 PolarHBondContact N-O 3.29Å; A243-L265 CarbonylContact C-O 3.52Å; A243-L265 VanDerWaalsContact CA-O 3.27Å; A243-L265 WeakPolarHBondContact CA-O 3.42Å; A243-L265 HydrophobicContact CB-CB 3.73Å; A243-Y267 HydrophobicContact CB-CD1 3.58Å; A243-Y267 HydrophobicContact CB-CE1 4.36Å; A243-Y267 HydrophobicContact CB-CG 4.28Å; A243-Y267 WeakPolarHBondContact O-CE1 3.43Å
244	F	93.7	Very high	90.5	Very high	6 Å²	6	42.1 Å²	42.1	3%	0.026	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	130.8	-177.7	-65.4	-94.8	0	0	0	110.7	I205 L224 F254 A255 Y258 T259 F264 L265 I266 Y267	I205-F244 HydrophobicContact CB-CD1 4.04Å; I205-F244 HydrophobicContact CB-CE1 4.32Å; I205-F244 HydrophobicContact CD1-CD1 3.96Å; I205-F244 HydrophobicContact CD1-CE1 3.44Å; I205-F244 VanDerWaalsContact CD1-CE1 3.44Å; I205-F244 HydrophobicContact CD1-CE2 4.23Å; I205-F244 HydrophobicContact CD1-CZ 3.59Å; I205-F244 HydrophobicContact CG1-CE1 4.5Å; I205-F244 HydrophobicContact CG2-CD1 4.1Å; I205-F244 HydrophobicContact CG2-CE1 4.27Å; L224-F244 HydrophobicContact CD1-CE1 4.45Å; F244-F254 HydrophobicContact CE1-CD1 4.3Å; F244-F254 HydrophobicContact CE1-CE1 4.2Å; F244-F254 HydrophobicContact CZ-CE1 4.45Å; F244-A255 HydrophobicContact CD1-CB 4.31Å; F244-A255 HydrophobicContact CD2-CB 3.77Å; F244-A255 HydrophobicContact CE1-CB 4.14Å; F244-A255 HydrophobicContact CE2-CB 3.59Å; F244-A255 HydrophobicContact CG-CB 4.13Å; F244-A255 HydrophobicContact CZ-CB 3.78Å; F244-Y258 HydrophobicContact CZ-CD1 4.26Å; F244-T259 HydrophobicContact CE2-CG2 3.95Å; F244-F264 HydrophobicContact CB-CE2 4.43Å; F244-F264 AromaticContact CD2-CD2 3.87Å; F244-F264 HydrophobicContact CD2-CD2 3.87Å; F244-F264 HydrophobicContact CD2-CE2 4.38Å; F244-L265 PolarHBondContact N-O 2.82Å; F244-I266 VanDerWaalsContact O-CA 3.27Å; F244-I266 WeakPolarHBondContact O-CA 3.43Å; F244-Y267 PolarHBondContact O-N 2.76Å
245	S	89.3	Confident	90.8	Very high	24 Å²	24	38.7 Å²	38.7	17%	0.168	21%	0.207	C	C	.	.	S	Bend	trans	-84.1	122.7	172	-162	0	0	0	0	109.6	I205 Y267	I205-S245 PolarHBondContact O-N 2.97Å; S245-Y267 PolarHBondContact OG-O 2.83Å
246	E	82.7	Confident	90.8	Very high	178 Å²	178	35.2 Å²	35.2	83%	0.832	19%	0.189	S	C	*	.	S	Bend	trans	37.2	63.9	171.7	-59.8	-171.4	161.8	0	0	115.7	T248	E246-T248 PolarHBondContact O-N 2.9Å
247	P	86.3	Confident	90.8	Very high	11 Å²	11	36.3 Å²	36.3	7%	0.071	20%	0.198	C	C	.	.			trans	-67.4	138.7	-174.6	27.3	-34.4	0	0	0	112.6	L169 S171 A252 F264	L169-P247 HydrophobicContact CD1-CG 3.84Å; S171-P247 WeakPolarHBondContact CB-O 3.48Å; S171-P247 PolarHBondContact OG-O 3.02Å; P247-A252 HydrophobicContact CB-CB 4.26Å; P247-A252 HydrophobicContact CG-CB 4.36Å; P247-F264 HydrophobicContact CG-CE2 4.05Å; P247-F264 HydrophobicContact CG-CZ 4.16Å
248	T	88	Confident	90.9	Very high	47 Å²	47	36.3 Å²	36.3	29%	0.288	20%	0.198	S	C	.	.			trans	-64.9	168.9	163.4	60.9	0	0	0	0	110.7	E246 N250 G251 A252	E246-T248 PolarHBondContact O-N 2.9Å; T248-N250 VanDerWaalsContact C-N 3.31Å; T248-N250 PolarHBondContact O-N 3.49Å; T248-G251 CarbonylContact O-C 3.52Å; T248-G251 WeakPolarHBondContact O-CA 3.27Å; T248-G251 PolarHBondContact O-N 2.94Å; T248-G251 PolarHBondContact OG1-N 3.38Å; T248-A252 PolarHBondContact O-N 3.33Å
249	A	86.1	Confident	90.8	Very high	2 Å²	2	34.9 Å²	34.9	2%	0.017	19%	0.187	C	C	.	.	H	α-helix	trans	-54.5	-47.1	176.6	0	0	0	0	0	112.5	W172 Q175 G251 A252 D253	W172-A249 HydrophobicContact CG-CB 4.46Å; Q175-A249 HydrophobicContact CB-CB 3.57Å; A249-G251 VanDerWaalsContact C-N 3.29Å; A249-G251 PolarHBondContact O-N 2.82Å; A249-A252 PolarHBondContact O-N 2.94Å; A249-D253 PolarHBondContact O-N 3.4Å
250	N	88.8	Confident	90.7	Very high	84 Å²	84	32.6 Å²	32.6	45%	0.449	19%	0.194	S	C	.	.	H	α-helix	trans	-63.3	-36.5	175.6	-70.8	-40.8	0	0	0	112.2	R179 T248 F254	R179-N250 PolarHBondContact NH2-OD1 2.92Å; T248-N250 VanDerWaalsContact C-N 3.31Å; T248-N250 PolarHBondContact O-N 3.49Å; N250-F254 WeakPolarHBondContact O-CB 3.44Å; N250-F254 PolarHBondContact O-N 3.32Å
251	G	91.3	Very high	90.5	Very high	13 Å²	13	32 Å²	32	13%	0.134	19%	0.187	C	C	.	.	H	α-helix	trans	-65.8	-41.5	175.7	0	0	0	0	0	112.3	T248 A249 F254 A255	T248-G251 CarbonylContact O-C 3.52Å; T248-G251 WeakPolarHBondContact O-CA 3.27Å; T248-G251 PolarHBondContact O-N 2.94Å; T248-G251 PolarHBondContact OG1-N 3.38Å; A249-G251 VanDerWaalsContact C-N 3.29Å; A249-G251 PolarHBondContact O-N 2.82Å; G251-F254 WeakPolarHBondContact O-CB 3.43Å; G251-F254 PolarHBondContact O-N 3.42Å; G251-A255 WeakPolarHBondContact O-CB 3.46Å; G251-A255 PolarHBondContact O-N 2.96Å
252	A	90.5	Very high	90.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-69	-42.1	177.6	0	0	0	0	0	111.2	R166 L169 P247 T248 A249 F254 A255 V256 F264	R166-A252 HydrophobicContact CB-CB 4.15Å; L169-A252 HydrophobicContact CD1-CB 3.85Å; P247-A252 HydrophobicContact CB-CB 4.26Å; P247-A252 HydrophobicContact CG-CB 4.36Å; T248-A252 PolarHBondContact O-N 3.33Å; A249-A252 PolarHBondContact O-N 2.94Å; A252-F254 VanDerWaalsContact C-N 3.27Å; A252-F254 PolarHBondContact O-N 3.16Å; A252-A255 PolarHBondContact O-N 3.08Å; A252-V256 WeakPolarHBondContact O-CG2 3.27Å; A252-V256 PolarHBondContact O-N 2.91Å; A252-F264 HydrophobicContact CB-CZ 4.2Å
253	D	91.6	Very high	90	Very high	23 Å²	23	34.8 Å²	34.8	12%	0.123	20%	0.202	C	C	.	.	H	α-helix	trans	-59.2	-41.8	173	-63.7	-23.3	0	0	0	111.6	R166 W172 R179 A249 S257	R166-D253 IonicContact CZ-OD1 2.67Å; R166-D253 IonicContact NE-OD1 3.41Å; R166-D253 PolarHBondContact NE-OD1 3.3Å; R166-D253 IonicContact NH1-OD1 3.42Å; R166-D253 PolarHBondContact NH1-OD1 2.96Å; R166-D253 IonicContact NH2-OD1 2.76Å; R166-D253 PolarHBondContact NH2-OD1 3.32Å; W172-D253 PolarHBondContact NE1-OD1 2.88Å; R179-D253 IonicContact CZ-OD2 3.26Å; R179-D253 IonicContact NH1-OD2 2.91Å; R179-D253 PolarHBondContact NH1-OD2 2.79Å; R179-D253 IonicContact NH2-OD2 3.18Å; A249-D253 PolarHBondContact O-N 3.4Å; D253-S257 WeakPolarHBondContact O-CB 3.08Å; D253-S257 PolarHBondContact O-N 3.27Å; D253-S257 VanDerWaalsContact O-N 3.1Å
254	F	94.7	Very high	89.9	Confident	36 Å²	36	34.9 Å²	34.9	16%	0.158	20%	0.202	C	C	.	.	H	α-helix	trans	-64.7	-45.5	173.9	170.3	-102.1	0	0	0	111.7	I208 A220 L224 F244 N250 G251 A252 V256 S257 Y258	I208-F254 HydrophobicContact CD1-CD1 4.41Å; I208-F254 HydrophobicContact CD1-CE1 3.68Å; I208-F254 HydrophobicContact CD1-CZ 4.05Å; A220-F254 HydrophobicContact CB-CD2 4.12Å; A220-F254 HydrophobicContact CB-CE1 4.36Å; A220-F254 HydrophobicContact CB-CE2 3.51Å; A220-F254 HydrophobicContact CB-CZ 3.65Å; L224-F254 HydrophobicContact CD1-CE1 3.57Å; L224-F254 HydrophobicContact CD1-CZ 3.77Å; F244-F254 HydrophobicContact CE1-CD1 4.3Å; F244-F254 HydrophobicContact CE1-CE1 4.2Å; F244-F254 HydrophobicContact CZ-CE1 4.45Å; N250-F254 WeakPolarHBondContact O-CB 3.44Å; N250-F254 PolarHBondContact O-N 3.32Å; G251-F254 WeakPolarHBondContact O-CB 3.43Å; G251-F254 PolarHBondContact O-N 3.42Å; A252-F254 VanDerWaalsContact C-N 3.27Å; A252-F254 PolarHBondContact O-N 3.16Å; F254-V256 VanDerWaalsContact C-N 3.32Å; F254-V256 PolarHBondContact O-N 2.84Å; F254-S257 CarbonylContact O-C 3.58Å; F254-S257 PolarHBondContact O-N 3.34Å; F254-Y258 HydrophobicContact CE1-CG 4.24Å; F254-Y258 HydrophobicContact CE2-CD2 4.24Å; F254-Y258 HydrophobicContact CE2-CG 4.4Å; F254-Y258 AromaticContact CZ-CD2 3.82Å; F254-Y258 HydrophobicContact CZ-CD2 3.82Å; F254-Y258 AromaticContact CZ-CG 3.85Å; F254-Y258 HydrophobicContact CZ-CG 3.85Å; F254-Y258 WeakPolarHBondContact O-CB 3.47Å; F254-Y258 PolarHBondContact O-N 3.39Å
255	A	93.8	Very high	89.7	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-57.7	-44.9	179.6	0	0	0	0	0	111.4	F244 G251 A252 Y258 T259 F264	F244-A255 HydrophobicContact CD1-CB 4.31Å; F244-A255 HydrophobicContact CD2-CB 3.77Å; F244-A255 HydrophobicContact CE1-CB 4.14Å; F244-A255 HydrophobicContact CE2-CB 3.59Å; F244-A255 HydrophobicContact CG-CB 4.13Å; F244-A255 HydrophobicContact CZ-CB 3.78Å; G251-A255 WeakPolarHBondContact O-CB 3.46Å; G251-A255 PolarHBondContact O-N 2.96Å; A252-A255 PolarHBondContact O-N 3.08Å; A255-Y258 PolarHBondContact O-N 2.9Å; A255-T259 WeakPolarHBondContact O-CB 3.29Å; A255-T259 WeakPolarHBondContact O-CG2 3.5Å; A255-T259 PolarHBondContact O-N 2.69Å; A255-T259 PolarHBondContact O-OG1 2.78Å; A255-F264 HydrophobicContact CB-CD1 4.06Å; A255-F264 HydrophobicContact CB-CD2 3.91Å; A255-F264 HydrophobicContact CB-CE1 4.09Å; A255-F264 HydrophobicContact CB-CE2 3.94Å; A255-F264 HydrophobicContact CB-CG 3.97Å; A255-F264 HydrophobicContact CB-CZ 4.02Å
256	V	91.8	Very high	89.8	Confident	7 Å²	7	35.7 Å²	35.7	4%	0.042	20%	0.204	C	C	.	.	H	α-helix	trans	-62.2	-49.1	175.2	174.6	0	0	0	0	111.2	R166 I187 A252 F254 Y258 G260 R261 E262 F264	R166-V256 HydrophobicContact CB-CG2 4.25Å; I187-V256 HydrophobicContact CD1-CG1 4.27Å; A252-V256 WeakPolarHBondContact O-CG2 3.27Å; A252-V256 PolarHBondContact O-N 2.91Å; F254-V256 VanDerWaalsContact C-N 3.32Å; F254-V256 PolarHBondContact O-N 2.84Å; V256-Y258 VanDerWaalsContact C-N 3.27Å; V256-Y258 PolarHBondContact O-N 3.2Å; V256-G260 VanDerWaalsContact O-CA 3.29Å; V256-G260 WeakPolarHBondContact O-CA 3.43Å; V256-G260 PolarHBondContact O-N 3.43Å; V256-R261 PolarHBondContact O-N 3.28Å; V256-E262 HydrophobicContact CG1-CG 4.38Å; V256-F264 HydrophobicContact CG2-CD1 3.87Å; V256-F264 HydrophobicContact CG2-CE1 3.87Å
257	S	93.4	Very high	89.9	Confident	94 Å²	94	29.3 Å²	29.3	66%	0.657	17%	0.173	S	C	*	.	H	α-helix	trans	-63.9	-31.9	178.7	180	0	0	0	0	113.2	D253 F254	D253-S257 WeakPolarHBondContact O-CB 3.08Å; D253-S257 PolarHBondContact O-N 3.27Å; D253-S257 VanDerWaalsContact O-N 3.1Å; F254-S257 CarbonylContact O-C 3.58Å; F254-S257 PolarHBondContact O-N 3.34Å
258	Y	94.5	Very high	90.1	Very high	6 Å²	6	30.2 Å²	30.2	2%	0.024	18%	0.178	C	C	.	.	H	α-helix	trans	-81.4	-45	-176	-178.9	-105.9	0	0	0	111.9	T221 L224 D225 L228 R239 T242 F244 F254 A255 V256	T221-Y258 HydrophobicContact CG2-CD2 4.01Å; T221-Y258 HydrophobicContact CG2-CE2 3.96Å; L224-Y258 HydrophobicContact CB-CE1 4.17Å; L224-Y258 HydrophobicContact CB-CE2 3.95Å; L224-Y258 WeakPolarHBondContact CB-OH 3.33Å; L224-Y258 HydrophobicContact CD1-CD1 4.12Å; L224-Y258 HydrophobicContact CD1-CE1 3.81Å; L224-Y258 HydrophobicContact CD1-CE2 4.36Å; D225-Y258 PolarHBondContact N-OH 3.13Å; D225-Y258 PolarHBondContact OD1-OH 2.7Å; L228-Y258 HydrophobicContact CD1-CE1 4.34Å; L228-Y258 WeakPolarHBondContact CD1-OH 3.45Å; R239-Y258 HydrophobicContact CB-CE1 4.07Å; R239-Y258 WeakPolarHBondContact CD-O 3.45Å; R239-Y258 HydrophobicContact CG-CE1 3.95Å; R239-Y258 HydrophobicContact CG-CE2 4.22Å; T242-Y258 HydrophobicContact CG2-CE1 4.1Å; F244-Y258 HydrophobicContact CZ-CD1 4.26Å; F254-Y258 HydrophobicContact CE1-CG 4.24Å; F254-Y258 HydrophobicContact CE2-CD2 4.24Å; F254-Y258 HydrophobicContact CE2-CG 4.4Å; F254-Y258 AromaticContact CZ-CD2 3.82Å; F254-Y258 HydrophobicContact CZ-CD2 3.82Å; F254-Y258 AromaticContact CZ-CG 3.85Å; F254-Y258 HydrophobicContact CZ-CG 3.85Å; F254-Y258 WeakPolarHBondContact O-CB 3.47Å; F254-Y258 PolarHBondContact O-N 3.39Å; A255-Y258 PolarHBondContact O-N 2.9Å; V256-Y258 VanDerWaalsContact C-N 3.27Å; V256-Y258 PolarHBondContact O-N 3.2Å
259	T	91.6	Very high	90.2	Very high	17 Å²	17	29.3 Å²	29.3	10%	0.104	17%	0.172	C	C	.	.	H	α-helix	trans	-84.8	-19.3	-179.3	63	0	0	0	0	113	F244 A255 R261 F264	F244-T259 HydrophobicContact CE2-CG2 3.95Å; A255-T259 WeakPolarHBondContact O-CB 3.29Å; A255-T259 WeakPolarHBondContact O-CG2 3.5Å; A255-T259 PolarHBondContact O-N 2.69Å; A255-T259 PolarHBondContact O-OG1 2.78Å; T259-R261 VanDerWaalsContact C-N 3.31Å; T259-R261 VanDerWaalsContact OG1-CG 3.31Å; T259-R261 WeakPolarHBondContact OG1-CG 3.32Å; T259-R261 PolarHBondContact OG1-O 3.44Å; T259-F264 HydrophobicContact CG2-CB 4.3Å
260	G	90.1	Very high	90.4	Very high	51 Å²	51	30.8 Å²	30.8	53%	0.526	18%	0.181	S	C	.	.	S	Bend	trans	75.6	15.2	-176.9	0	0	0	0	0	114.2	V256	V256-G260 VanDerWaalsContact O-CA 3.29Å; V256-G260 WeakPolarHBondContact O-CA 3.43Å; V256-G260 PolarHBondContact O-N 3.43Å
261	R	86	Confident	90.5	Very high	31 Å²	31	27.7 Å²	27.7	12%	0.117	17%	0.165	C	C	.	.			trans	-141.7	141	-175.6	57.6	-172.2	-77.7	-165	-15.4	112.2	V256 T259 D263 F264	V256-R261 PolarHBondContact O-N 3.28Å; T259-R261 VanDerWaalsContact C-N 3.31Å; T259-R261 VanDerWaalsContact OG1-CG 3.31Å; T259-R261 WeakPolarHBondContact OG1-CG 3.32Å; T259-R261 PolarHBondContact OG1-O 3.44Å; R261-D263 VanDerWaalsContact C-N 3.31Å; R261-D263 IonicContact CZ-OD1 3.84Å; R261-D263 PolarHBondContact NE-O 2.85Å; R261-D263 IonicContact NE-OD1 2.71Å; R261-D263 PolarHBondContact NE-OD1 3.49Å; R261-D263 PolarHBondContact NH2-O 3.44Å; R261-D263 IonicContact NH2-OD1 3.05Å; R261-D263 PolarHBondContact NH2-OD1 3.46Å; R261-F264 HydrophobicContact CG-CB 4.38Å
262	E	86.7	Confident	90.5	Very high	65 Å²	65	28.6 Å²	28.6	30%	0.304	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-30.8	175	-81.8	-68.3	162.1	0	0	112.3	G165 R166 V256 F264	G165-E262 WeakPolarHBondContact CA-O 3.4Å; R166-E262 WeakPolarHBondContact CG-OE2 3.33Å; R166-E262 PolarHBondContact N-OE2 3.47Å; R166-E262 VanDerWaalsContact N-OE2 3.15Å; V256-E262 HydrophobicContact CG1-CG 4.38Å; E262-F264 VanDerWaalsContact C-N 3.32Å; E262-F264 WeakPolarHBondContact O-CD1 3.42Å; E262-F264 PolarHBondContact O-N 3.29Å
263	D	87.2	Confident	90.5	Very high	36 Å²	36	30.5 Å²	30.5	19%	0.193	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	42.9	-175.2	66	-1.1	0	0	0	112.9	R161 L162 R261	R161-D263 HydrophobicContact CG-CB 4.16Å; R161-D263 WeakPolarHBondContact CG-O 3.24Å; R161-D263 IonicContact CZ-OD1 3.73Å; R161-D263 IonicContact CZ-OD2 3.13Å; R161-D263 IonicContact NE-OD1 3.62Å; R161-D263 IonicContact NE-OD2 3.78Å; R161-D263 PolarHBondContact NE-OD2 3.25Å; R161-D263 VanDerWaalsContact NH2-CG 3.28Å; R161-D263 IonicContact NH2-OD1 2.89Å; R161-D263 PolarHBondContact NH2-OD1 3.2Å; R161-D263 IonicContact NH2-OD2 2.78Å; R161-D263 PolarHBondContact NH2-OD2 3.26Å; L162-D263 WeakPolarHBondContact O-CA 3.32Å; L162-D263 VanDerWaalsContact O-CB 3.23Å; L162-D263 WeakPolarHBondContact O-CB 3.4Å; R261-D263 VanDerWaalsContact C-N 3.31Å; R261-D263 IonicContact CZ-OD1 3.84Å; R261-D263 PolarHBondContact NE-O 2.85Å; R261-D263 IonicContact NE-OD1 2.71Å; R261-D263 PolarHBondContact NE-OD1 3.49Å; R261-D263 PolarHBondContact NH2-O 3.44Å; R261-D263 IonicContact NH2-OD1 3.05Å; R261-D263 PolarHBondContact NH2-OD1 3.46Å
264	F	89.8	Confident	90.4	Very high	1 Å²	1	31.1 Å²	31.1	0%	0.004	18%	0.182	C	C	.	.			trans	-57.8	162.4	178.8	62.5	-90.3	0	0	0	112.3	L162 R166 L169 F244 P247 A252 A255 V256 T259 R261 E262 I266	L162-F264 WeakPolarHBondContact CB-O 3.18Å; L162-F264 HydrophobicContact CD2-CD1 4.47Å; L162-F264 HydrophobicContact CD2-CE1 3.77Å; L162-F264 HydrophobicContact CD2-CE2 4.32Å; L162-F264 HydrophobicContact CD2-CZ 3.68Å; L162-F264 PolarHBondContact N-O 3.37Å; L162-F264 VanDerWaalsContact N-O 3.08Å; R166-F264 HydrophobicContact CB-CE1 4.26Å; L169-F264 HydrophobicContact CD1-CZ 4.1Å; F244-F264 HydrophobicContact CB-CE2 4.43Å; F244-F264 AromaticContact CD2-CD2 3.87Å; F244-F264 HydrophobicContact CD2-CD2 3.87Å; F244-F264 HydrophobicContact CD2-CE2 4.38Å; P247-F264 HydrophobicContact CG-CE2 4.05Å; P247-F264 HydrophobicContact CG-CZ 4.16Å; A252-F264 HydrophobicContact CB-CZ 4.2Å; A255-F264 HydrophobicContact CB-CD1 4.06Å; A255-F264 HydrophobicContact CB-CD2 3.91Å; A255-F264 HydrophobicContact CB-CE1 4.09Å; A255-F264 HydrophobicContact CB-CE2 3.94Å; A255-F264 HydrophobicContact CB-CG 3.97Å; A255-F264 HydrophobicContact CB-CZ 4.02Å; V256-F264 HydrophobicContact CG2-CD1 3.87Å; V256-F264 HydrophobicContact CG2-CE1 3.87Å; T259-F264 HydrophobicContact CG2-CB 4.3Å; R261-F264 HydrophobicContact CG-CB 4.38Å; E262-F264 VanDerWaalsContact C-N 3.32Å; E262-F264 WeakPolarHBondContact O-CD1 3.42Å; E262-F264 PolarHBondContact O-N 3.29Å; F264-I266 HydrophobicContact CD2-CG2 3.96Å; F264-I266 HydrophobicContact CE2-CG2 3.53Å; F264-I266 HydrophobicContact CZ-CG2 4.46Å
265	L	90.4	Very high	90.1	Very high	7 Å²	7	30.7 Å²	30.7	4%	0.037	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	136.9	-178.2	-60.4	176.6	0	0	0	110.6	L159 N160 R161 V196 I202 A243 F244	L159-L265 HydrophobicContact CD1-CB 4.07Å; L159-L265 HydrophobicContact CD1-CD1 4.41Å; N160-L265 WeakPolarHBondContact O-CA 3.44Å; R161-L265 HydrophobicContact CB-CD2 4.29Å; V196-L265 HydrophobicContact CG1-CD1 4.28Å; I202-L265 HydrophobicContact CD1-CD1 4.15Å; A243-L265 CarbonylContact C-O 3.52Å; A243-L265 VanDerWaalsContact CA-O 3.27Å; A243-L265 WeakPolarHBondContact CA-O 3.42Å; A243-L265 HydrophobicContact CB-CB 3.73Å; F244-L265 PolarHBondContact N-O 2.82Å
266	I	89.8	Confident	89.8	Confident	40 Å²	40	33.3 Å²	33.3	21%	0.205	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	150.5	173	56.7	164.7	0	0	0	109.6	N160 L162 F244 F264	N160-I266 HydrophobicContact CB-CG1 4.16Å; N160-I266 PolarHBondContact N-O 2.83Å; N160-I266 WeakPolarHBondContact O-CG1 3.41Å; N160-I266 PolarHBondContact O-N 2.86Å; L162-I266 HydrophobicContact CD1-CD1 4.11Å; F244-I266 VanDerWaalsContact O-CA 3.27Å; F244-I266 WeakPolarHBondContact O-CA 3.43Å; F264-I266 HydrophobicContact CD2-CG2 3.96Å; F264-I266 HydrophobicContact CE2-CG2 3.53Å; F264-I266 HydrophobicContact CZ-CG2 4.46Å
267	Y	86.3	Confident	89.6	Confident	44 Å²	44	35.6 Å²	35.6	17%	0.173	21%	0.213	C	C	.	.			trans	-148.6	0	-176.6	83.6	-85.7	0	0	0	113	E145 L147 C157 G204 R206 A243 F244 S245	E145-Y267 HydrophobicContact CG-CE2 4.36Å; E145-Y267 WeakPolarHBondContact OE1-CE2 3.17Å; E145-Y267 PolarHBondContact OE1-OH 2.97Å; L147-Y267 HydrophobicContact CD1-CD1 3.9Å; L147-Y267 HydrophobicContact CD1-CD2 3.8Å; L147-Y267 HydrophobicContact CD1-CE1 4.18Å; L147-Y267 HydrophobicContact CD1-CE2 4.06Å; L147-Y267 HydrophobicContact CD1-CG 3.67Å; L147-Y267 HydrophobicContact CD2-CD2 4.21Å; L147-Y267 HydrophobicContact CD2-CE2 4.13Å; C157-Y267 WeakPolarHBondContact SG-CD2 3.49Å; C157-Y267 PolarHBondContact SG-OXT 3.4Å; G204-Y267 VanDerWaalsContact C-OH 3.23Å; G204-Y267 PolarHBondContact O-OH 3.24Å; R206-Y267 WeakPolarHBondContact CA-OH 3.48Å; R206-Y267 WeakPolarHBondContact CB-OH 3.5Å; R206-Y267 PolarHBondContact N-OH 2.98Å; A243-Y267 HydrophobicContact CB-CD1 3.58Å; A243-Y267 HydrophobicContact CB-CE1 4.36Å; A243-Y267 HydrophobicContact CB-CG 4.28Å; A243-Y267 WeakPolarHBondContact O-CE1 3.43Å; F244-Y267 PolarHBondContact O-N 2.76Å; S245-Y267 PolarHBondContact OG-O 2.83Å

Retrieved 267 of 267 residues in 192.9 ms (Link to these results)

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