A0A093IAE6_STRCA Loading...

Kinase

AlphaFold DB , UniProt , Accession A0A093IAE6, Species STRCA (Struthio camelus australis), Gene n/a, Length 424 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.8	Very low	35.5	Very low	246 Å²	246	142.7 Å²	142.7	100%	1.212	83%	0.827	S	S	*	*				0	97.2	0	-72.5	-175.3	179.2	0	0	106.6
2	S	28.3	Very low	35.9	Very low	119 Å²	119	144.4 Å²	144.4	83%	0.832	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-91.8	135.1	177.5	-54.3	0	0	0	0	108.4
3	P	35.7	Very low	36.7	Very low	118 Å²	118	143.1 Å²	143.1	77%	0.766	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-76.6	136.3	171.1	27.2	-22.1	0	0	0	109.4	F5	P3-F5 PolarHBondContact O-N 3.29Å
4	A	34.5	Very low	37.9	Very low	99 Å²	99	139.9 Å²	139.9	82%	0.818	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-61.7	127.9	179.2	0	0	0	0	0	111.2
5	F	38.4	Very low	40	Very low	214 Å²	214	142.8 Å²	142.8	94%	0.939	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-67.7	129.8	161.5	-87.3	-92.6	0	0	0	108.7	P3	P3-F5 PolarHBondContact O-N 3.29Å
6	G	33.7	Very low	42.7	Very low	70 Å²	70	134.9 Å²	134.9	72%	0.722	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-64	131.6	-167.8	0	0	0	0	0	114.1	M8	G6-M8 PolarHBondContact O-N 2.79Å; G6-M8 VanDerWaalsContact O-N 3.12Å
7	A	35.5	Very low	45.4	Very low	89 Å²	89	129.1 Å²	129.1	74%	0.736	72%	0.719	S	S	*	*	S	Bend	trans	-78.9	35.2	172.2	0	0	0	0	0	113.3
8	M	35.9	Very low	47.8	Very low	179 Å²	179	127.4 Å²	127.4	88%	0.882	71%	0.708	S	S	*	*			trans	-104.3	-0.8	-173.3	-76.8	-170.6	87.8	0	0	116	G6	G6-M8 PolarHBondContact O-N 2.79Å; G6-M8 VanDerWaalsContact O-N 3.12Å
9	E	42.2	Very low	49.9	Very low	164 Å²	164	121.4 Å²	121.4	77%	0.766	67%	0.674	S	S	*	*	S	Bend	trans	-104.8	-10.1	178.1	-77.7	-172.7	158.4	0	0	115	Y13	E9-Y13 WeakPolarHBondContact O-CD2 3.41Å
10	V	40.8	Very low	51.6	Low	112 Å²	112	119.5 Å²	119.5	68%	0.679	66%	0.66	S	S	*	*	S	Bend	trans	-85.6	-30.1	-172.9	-176.2	0	0	0	0	112.9	H12 Y13	V10-H12 PolarHBondContact O-N 3.42Å; V10-Y13 PolarHBondContact O-N 3.08Å
11	E	33.2	Very low	53.1	Low	160 Å²	160	115.9 Å²	115.9	75%	0.748	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-22.6	-172.7	-67.6	-168.8	160	0	0	114.5
12	H	39.5	Very low	55.5	Low	163 Å²	163	105.1 Å²	105.1	76%	0.755	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-23.7	178.9	-96.6	-122	0	0	0	113.4	V10	V10-H12 PolarHBondContact O-N 3.42Å
13	Y	46.5	Very low	57.9	Low	127 Å²	127	101.3 Å²	101.3	50%	0.498	56%	0.56	S	S	.	*	G	3₁₀ helix	trans	-82.2	-13	-177.7	-73.8	-75.6	0	0	0	113.9	E9 V10 K15 P88	E9-Y13 WeakPolarHBondContact O-CD2 3.41Å; V10-Y13 PolarHBondContact O-N 3.08Å; Y13-K15 VanDerWaalsContact C-N 3.28Å; Y13-K15 PolarHBondContact O-N 3.12Å; Y13-P88 HydrophobicContact CD1-CG 4.06Å; Y13-P88 HydrophobicContact CG-CG 4.46Å
14	S	54.2	Low	60	Low	98 Å²	98	98.3 Å²	98.3	69%	0.685	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-75	-17.8	175.4	-34.4	0	0	0	0	113
15	K	68.8	Low	62.1	Low	184 Å²	184	94.4 Å²	94.4	80%	0.8	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-98	-3.6	-172.5	-113	179.2	178.2	-179.6	0	115.2	Y13	Y13-K15 VanDerWaalsContact C-N 3.28Å; Y13-K15 PolarHBondContact O-N 3.12Å
16	G	83.1	Confident	63.9	Low	17 Å²	17	84.5 Å²	84.5	18%	0.175	46%	0.458	C	S	.	.			trans	73.5	156	-174	0	0	0	0	0	113	A86	G16-A86 CarbonylContact C-O 3.46Å; G16-A86 VanDerWaalsContact CA-O 3.29Å; G16-A86 WeakPolarHBondContact CA-O 3.46Å
17	V	88.9	Confident	65.8	Low	36 Å²	36	81.4 Å²	81.4	22%	0.218	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	118.8	-178.1	179.5	0	0	0	0	109.2	L19 F35 I85 A86	V17-L19 PolarHBondContact O-N 3.44Å; V17-F35 HydrophobicContact CB-CD2 4.36Å; V17-F35 HydrophobicContact CB-CE2 3.85Å; V17-F35 HydrophobicContact CB-CZ 4.24Å; V17-F35 HydrophobicContact CG1-CD2 4.18Å; V17-F35 HydrophobicContact CG1-CE2 4.09Å; V17-F35 HydrophobicContact CG1-CZ 4.43Å; V17-F35 WeakPolarHBondContact CG1-O 3.34Å; V17-F35 HydrophobicContact CG2-CE2 3.95Å; V17-F35 HydrophobicContact CG2-CZ 3.84Å; V17-I85 CarbonylContact O-C 3.54Å; V17-I85 WeakPolarHBondContact O-CA 3.49Å; V17-A86 HydrophobicContact CB-CB 4.43Å; V17-A86 PolarHBondContact N-O 2.91Å; V17-A86 PolarHBondContact O-N 3.48Å
18	L	87.8	Confident	67.3	Low	99 Å²	99	78 Å²	78	52%	0.518	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	124.1	174	-179.8	65	0	0	0	110	C83	L18-C83 HydrophobicContact CD1-CB 3.64Å
19	L	88	Confident	68.8	Low	12 Å²	12	75.4 Å²	75.4	6%	0.063	39%	0.385	C	S	.	.			trans	-90.2	135.5	179.5	-60.5	-177	0	0	0	111.2	V17 L33 F35 V72 L84 A86	V17-L19 PolarHBondContact O-N 3.44Å; L19-L33 HydrophobicContact CB-CB 4.22Å; L19-L33 HydrophobicContact CB-CD1 4.13Å; L19-L33 HydrophobicContact CB-CD2 4.07Å; L19-L33 HydrophobicContact CB-CG 4.38Å; L19-L33 HydrophobicContact CD1-CB 4.36Å; L19-L33 HydrophobicContact CD1-CD1 3.67Å; L19-F35 HydrophobicContact CD2-CB 4.21Å; L19-F35 HydrophobicContact CD2-CD2 3.82Å; L19-F35 HydrophobicContact CD2-CG 4.47Å; L19-V72 HydrophobicContact CD1-CG1 3.73Å; L19-V72 HydrophobicContact CD1-CG2 3.89Å; L19-L84 HydrophobicContact CB-CB 3.94Å; L19-L84 HydrophobicContact CD1-CB 4.16Å; L19-L84 HydrophobicContact CG-CB 4.37Å; L19-L84 PolarHBondContact N-O 3.5Å; L19-A86 HydrophobicContact CD1-CB 4.13Å; L19-A86 HydrophobicContact CD2-CB 3.82Å; L19-A86 HydrophobicContact CG-CB 4.05Å
20	E	83.8	Confident	70.1	Confident	84 Å²	84	69.8 Å²	69.8	39%	0.393	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	154	178.7	-65.1	177.8	159.2	0	0	111.7	F22 L33 R34	E20-F22 PolarHBondContact O-N 2.78Å; E20-L33 CarbonylContact O-C 3.44Å; E20-L33 VanDerWaalsContact O-CA 3.31Å; E20-L33 WeakPolarHBondContact O-CA 3.42Å; E20-L33 VanDerWaalsContact O-CD2 3.27Å; E20-L33 WeakPolarHBondContact O-CD2 3.38Å; E20-R34 HydrophobicContact CB-CB 4.33Å; E20-R34 PolarHBondContact N-O 2.94Å; E20-R34 PolarHBondContact O-N 3.39Å; E20-R34 IonicContact OE1-NH2 2.64Å; E20-R34 IonicContact OE2-CZ 2.81Å; E20-R34 IonicContact OE2-NE 3.53Å; E20-R34 PolarHBondContact OE2-NE 3.48Å; E20-R34 IonicContact OE2-NH2 2.6Å; E20-R34 PolarHBondContact OE2-NH2 2.83Å
21	P	82.8	Confident	71.7	Confident	44 Å²	44	64.5 Å²	64.5	29%	0.286	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	133.6	173.4	-19.5	29.1	0	0	0	112.2	V23 M180 H183	P21-V23 PolarHBondContact O-N 2.97Å; P21-M180 HydrophobicContact CB-SD 4.2Å; P21-H183 WeakPolarHBondContact CG-NE2 3.31Å
22	F	84.1	Confident	74.3	Confident	20 Å²	20	57.9 Å²	57.9	9%	0.088	30%	0.302	C	S	.	.			trans	-79.8	115.3	173.5	-176.2	-116.4	0	0	0	111.5	E20 H24 Q25 V32 I40 S179 N207 T209	E20-F22 PolarHBondContact O-N 2.78Å; F22-H24 HydrophobicContact CE1-CB 4.02Å; F22-H24 HydrophobicContact CE2-CB 4.37Å; F22-H24 HydrophobicContact CZ-CB 3.78Å; F22-Q25 HydrophobicContact CD1-CB 4Å; F22-V32 HydrophobicContact CB-CB 3.97Å; F22-V32 HydrophobicContact CB-CG1 3.72Å; F22-V32 VanDerWaalsContact CB-O 3.26Å; F22-V32 WeakPolarHBondContact CB-O 3.38Å; F22-V32 HydrophobicContact CD1-CB 4.16Å; F22-V32 HydrophobicContact CD1-CG1 3.75Å; F22-V32 HydrophobicContact CG-CB 4.43Å; F22-V32 HydrophobicContact CG-CG1 3.87Å; F22-V32 PolarHBondContact N-O 2.73Å; F22-V32 VanDerWaalsContact N-O 3.11Å; F22-I40 HydrophobicContact CD2-CG2 3.71Å; F22-I40 HydrophobicContact CE2-CG2 3.86Å; F22-I40 HydrophobicContact CG-CG2 4.15Å; F22-I40 HydrophobicContact CZ-CG2 4.41Å; F22-S179 PolarHBondContact O-OG 2.96Å; F22-N207 WeakPolarHBondContact CE2-OD1 3.31Å; F22-T209 WeakPolarHBondContact CE2-OG1 3.22Å; F22-T209 HydrophobicContact CZ-CG2 3.93Å; F22-T209 WeakPolarHBondContact CZ-OG1 3.27Å
23	V	78.6	Confident	76.7	Confident	39 Å²	39	50.1 Å²	50.1	24%	0.236	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-19.3	-165.5	-61.3	0	0	0	0	114.9	P21 H175	P21-V23 PolarHBondContact O-N 2.97Å; V23-H175 VanDerWaalsContact CB-CD2 3.43Å; V23-H175 WeakPolarHBondContact CB-CD2 3.3Å; V23-H175 WeakPolarHBondContact CG1-CD2 3.25Å; V23-H175 WeakPolarHBondContact CG1-NE2 3.39Å
24	H	78.9	Confident	78.8	Confident	54 Å²	54	47.6 Å²	47.6	25%	0.25	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	14.1	-179.7	-55.3	124.4	0	0	0	113.3	F22 V26 T209	F22-H24 HydrophobicContact CE1-CB 4.02Å; F22-H24 HydrophobicContact CE2-CB 4.37Å; F22-H24 HydrophobicContact CZ-CB 3.78Å; H24-V26 PolarHBondContact O-N 3.23Å; H24-T209 HydrophobicContact CB-CG2 3.84Å; H24-T209 PolarHBondContact ND1-OG1 2.79Å
25	Q	79.6	Confident	80.6	Confident	18 Å²	18	44.2 Å²	44.2	8%	0.084	23%	0.229	C	C	.	.			trans	-70.3	114.1	173.2	-173.9	170.5	-2.9	0	0	110.1	F22 G27 S30 N176	F22-Q25 HydrophobicContact CD1-CB 4Å; Q25-G27 WeakPolarHBondContact CG-O 3.31Å; Q25-G27 PolarHBondContact NE2-O 3.5Å; Q25-S30 PolarHBondContact NE2-O 3.15Å; Q25-N176 PolarHBondContact O-ND2 3.45Å
26	V	76.3	Confident	81.7	Confident	6 Å²	6	38.4 Å²	38.4	4%	0.036	21%	0.206	C	C	.	.			trans	-98.6	-19	179.6	-61.5	0	0	0	0	113.5	H24 V217 D219 G257 Q259	H24-V26 PolarHBondContact O-N 3.23Å; V26-V217 HydrophobicContact CG1-CB 3.91Å; V26-V217 HydrophobicContact CG1-CG1 4.14Å; V26-V217 HydrophobicContact CG2-CB 4.27Å; V26-V217 HydrophobicContact CG2-CG1 3.66Å; V26-D219 HydrophobicContact CG2-CB 3.72Å; V26-G257 VanDerWaalsContact O-CA 3.29Å; V26-G257 WeakPolarHBondContact O-CA 3.28Å; V26-Q259 HydrophobicContact CG1-CB 3.47Å; V26-Q259 VanDerWaalsContact CG1-CB 3.47Å
27	G	73	Confident	81.9	Confident	5 Å²	5	43 Å²	43	5%	0.052	23%	0.227	C	C	.	.	S	Bend	trans	-148.3	-171.8	-175.6	0	0	0	0	0	112.9	Q25 D219	Q25-G27 WeakPolarHBondContact CG-O 3.31Å; Q25-G27 PolarHBondContact NE2-O 3.5Å; G27-D219 WeakPolarHBondContact CA-OD2 2.98Å
28	G	68.6	Low	82.2	Confident	17 Å²	17	48.7 Å²	48.7	18%	0.175	25%	0.249	C	C	.	.			trans	82.7	158.7	178.4	0	0	0	0	0	115.3	W178	G28-W178 WeakPolarHBondContact O-CH2 3.26Å
29	H	66.2	Low	82.5	Confident	125 Å²	125	44.6 Å²	44.6	58%	0.579	23%	0.228	S	C	*	.	S	Bend	trans	-104.4	-13.8	179	-74.3	-127.4	0	0	0	112.7	Q186 K273	H29-Q186 PolarHBondContact O-OE1 3.41Å; H29-Q186 VanDerWaalsContact O-OE1 3.05Å; H29-K273 PolarHBondContact CD2-NZ 3.11Å; H29-K273 PolarHBondContact CE1-NZ 3.34Å; H29-K273 PolarHBondContact NE2-NZ 3.12Å
30	S	69.6	Low	82.8	Confident	45 Å²	45	45.2 Å²	45.2	32%	0.315	23%	0.231	S	C	.	.	S	Bend	trans	-85.8	138.7	-178.7	-57.7	0	0	0	0	110.4	Q25 V32	Q25-S30 PolarHBondContact NE2-O 3.15Å; S30-V32 PolarHBondContact O-N 2.71Å
31	C	75.1	Confident	83.3	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.014	21%	0.213	C	C	.	.			trans	-66.8	115.7	173.6	172.2	0	0	0	0	108.3	P43 H183 Q186	C31-P43 WeakPolarHBondContact O-CD 3.48Å; C31-H183 PolarHBondContact SG-CE1 2.89Å; C31-H183 PolarHBondContact SG-ND1 2.65Å; C31-Q186 HydrophobicContact CB-CB 4.07Å; C31-Q186 HydrophobicContact CB-CG 3.77Å; C31-Q186 VanDerWaalsContact CB-OE1 3.22Å; C31-Q186 VanDerWaalsContact N-CD 3.3Å
32	V	87.4	Confident	83.7	Confident	20 Å²	20	39.8 Å²	39.8	12%	0.121	20%	0.202	C	C	.	.			trans	-99.9	130.1	169.1	-174.9	0	0	0	0	107.9	F22 S30 I40	F22-V32 HydrophobicContact CB-CB 3.97Å; F22-V32 HydrophobicContact CB-CG1 3.72Å; F22-V32 VanDerWaalsContact CB-O 3.26Å; F22-V32 WeakPolarHBondContact CB-O 3.38Å; F22-V32 HydrophobicContact CD1-CB 4.16Å; F22-V32 HydrophobicContact CD1-CG1 3.75Å; F22-V32 HydrophobicContact CG-CB 4.43Å; F22-V32 HydrophobicContact CG-CG1 3.87Å; F22-V32 PolarHBondContact N-O 2.73Å; F22-V32 VanDerWaalsContact N-O 3.11Å; S30-V32 PolarHBondContact O-N 2.71Å; V32-I40 HydrophobicContact CG1-CB 3.84Å; V32-I40 HydrophobicContact CG1-CD1 3.64Å; V32-I40 HydrophobicContact CG1-CG1 4.27Å; V32-I40 HydrophobicContact CG1-CG2 4.16Å
33	L	89.2	Confident	84	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	146.5	-179.6	-77.1	163.8	0	0	0	109	L19 E20 I40 C41 L84 H183 F202	L19-L33 HydrophobicContact CB-CB 4.22Å; L19-L33 HydrophobicContact CB-CD1 4.13Å; L19-L33 HydrophobicContact CB-CD2 4.07Å; L19-L33 HydrophobicContact CB-CG 4.38Å; L19-L33 HydrophobicContact CD1-CB 4.36Å; L19-L33 HydrophobicContact CD1-CD1 3.67Å; E20-L33 CarbonylContact O-C 3.44Å; E20-L33 VanDerWaalsContact O-CA 3.31Å; E20-L33 WeakPolarHBondContact O-CA 3.42Å; E20-L33 VanDerWaalsContact O-CD2 3.27Å; E20-L33 WeakPolarHBondContact O-CD2 3.38Å; L33-I40 CarbonylContact O-C 3.54Å; L33-I40 VanDerWaalsContact O-CA 3.25Å; L33-I40 WeakPolarHBondContact O-CA 3.45Å; L33-I40 WeakPolarHBondContact O-CB 3.46Å; L33-C41 WeakPolarHBondContact CB-SG 3.31Å; L33-C41 PolarHBondContact N-O 3.48Å; L33-C41 PolarHBondContact O-N 2.87Å; L33-L84 HydrophobicContact CD1-CD1 3.54Å; L33-L84 HydrophobicContact CD2-CD1 4Å; L33-L84 HydrophobicContact CG-CD1 4.41Å; L33-H183 WeakPolarHBondContact CD2-CE1 2.98Å; L33-F202 HydrophobicContact CD1-CE1 3.78Å; L33-F202 HydrophobicContact CD1-CZ 4.41Å
34	R	91.1	Very high	84.6	Confident	74 Å²	74	38.1 Å²	38.1	28%	0.279	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	120.4	172.9	-167	172.5	85.7	106.5	-3.5	108.2	E20 N36 D37	E20-R34 HydrophobicContact CB-CB 4.33Å; E20-R34 PolarHBondContact N-O 2.94Å; E20-R34 PolarHBondContact O-N 3.39Å; E20-R34 IonicContact OE1-NH2 2.64Å; E20-R34 IonicContact OE2-CZ 2.81Å; E20-R34 IonicContact OE2-NE 3.53Å; E20-R34 PolarHBondContact OE2-NE 3.48Å; E20-R34 IonicContact OE2-NH2 2.6Å; E20-R34 PolarHBondContact OE2-NH2 2.83Å; R34-N36 VanDerWaalsContact CG-O 3.25Å; R34-N36 WeakPolarHBondContact CG-O 3.36Å; R34-D37 IonicContact CZ-OD1 3.35Å; R34-D37 IonicContact NH1-OD1 3.25Å; R34-D37 PolarHBondContact NH1-OD1 3.33Å
35	F	91.6	Very high	85.2	Confident	27 Å²	27	37.8 Å²	37.8	12%	0.118	19%	0.192	C	C	.	.	S	Bend	trans	-89.2	-43.3	174.4	179.4	-95.2	0	0	0	110.3	V17 L19 T39 V70 A86 L204	V17-F35 HydrophobicContact CB-CD2 4.36Å; V17-F35 HydrophobicContact CB-CE2 3.85Å; V17-F35 HydrophobicContact CB-CZ 4.24Å; V17-F35 HydrophobicContact CG1-CD2 4.18Å; V17-F35 HydrophobicContact CG1-CE2 4.09Å; V17-F35 HydrophobicContact CG1-CZ 4.43Å; V17-F35 WeakPolarHBondContact CG1-O 3.34Å; V17-F35 HydrophobicContact CG2-CE2 3.95Å; V17-F35 HydrophobicContact CG2-CZ 3.84Å; L19-F35 HydrophobicContact CD2-CB 4.21Å; L19-F35 HydrophobicContact CD2-CD2 3.82Å; L19-F35 HydrophobicContact CD2-CG 4.47Å; F35-T39 HydrophobicContact CB-CG2 4.33Å; F35-T39 HydrophobicContact CD1-CG2 4.29Å; F35-T39 PolarHBondContact N-O 3.45Å; F35-V70 HydrophobicContact CE2-CG1 4.29Å; F35-A86 HydrophobicContact CD2-CB 3.89Å; F35-A86 HydrophobicContact CE2-CB 3.68Å; F35-L204 HydrophobicContact CB-CD2 4.03Å; F35-L204 HydrophobicContact CD1-CD2 4.17Å; F35-L204 HydrophobicContact CD2-CD2 3.85Å; F35-L204 HydrophobicContact CE2-CD2 4.37Å; F35-L204 HydrophobicContact CG-CD2 3.75Å
36	N	91.1	Very high	85.8	Confident	61 Å²	61	41.2 Å²	41.2	33%	0.326	21%	0.208	S	C	.	.	S	Bend	trans	-153.5	-170.4	168.5	64	44.6	0	0	0	109.2	R34 K38 T39	R34-N36 VanDerWaalsContact CG-O 3.25Å; R34-N36 WeakPolarHBondContact CG-O 3.36Å; N36-K38 VanDerWaalsContact C-N 3.27Å; N36-K38 PolarHBondContact O-N 3.19Å; N36-K38 WeakPolarHBondContact OD1-CA 3.22Å; N36-K38 PolarHBondContact OD1-N 3.03Å; N36-T39 PolarHBondContact N-O 3.28Å; N36-T39 VanDerWaalsContact N-O 3.1Å; N36-T39 PolarHBondContact ND2-OG1 3.06Å; N36-T39 VanDerWaalsContact O-O 3.08Å; N36-T39 WeakPolarHBondContact OD1-CB 3.42Å; N36-T39 PolarHBondContact OD1-N 2.92Å; N36-T39 PolarHBondContact OD1-OG1 3.02Å
37	D	89.3	Confident	86.5	Confident	113 Å²	113	42.2 Å²	42.2	60%	0.604	21%	0.211	S	C	*	.	S	Bend	trans	-60	-35.6	-179.9	-67.5	-19.9	0	0	0	113.2	R34 N207 S210	R34-D37 IonicContact CZ-OD1 3.35Å; R34-D37 IonicContact NH1-OD1 3.25Å; R34-D37 PolarHBondContact NH1-OD1 3.33Å; D37-N207 PolarHBondContact O-ND2 2.81Å; D37-S210 WeakPolarHBondContact O-CB 3.49Å
38	K	93.4	Very high	87.5	Confident	156 Å²	156	42.1 Å²	42.1	68%	0.678	21%	0.21	S	C	*	.	S	Bend	trans	-100.9	-9.6	-174.2	-63.9	-176.4	-179.2	177.9	0	114.2	N36 N207	N36-K38 VanDerWaalsContact C-N 3.27Å; N36-K38 PolarHBondContact O-N 3.19Å; N36-K38 WeakPolarHBondContact OD1-CA 3.22Å; N36-K38 PolarHBondContact OD1-N 3.03Å; K38-N207 VanDerWaalsContact C-CB 3.45Å; K38-N207 WeakPolarHBondContact O-CB 3.03Å; K38-N207 PolarHBondContact O-N 3.42Å
39	T	94.7	Very high	88.8	Confident	14 Å²	14	42.2 Å²	42.2	9%	0.086	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	131.2	-171.6	-50.4	0	0	0	0	111	F35 N36 E67 L204 L205	F35-T39 HydrophobicContact CB-CG2 4.33Å; F35-T39 HydrophobicContact CD1-CG2 4.29Å; F35-T39 PolarHBondContact N-O 3.45Å; N36-T39 PolarHBondContact N-O 3.28Å; N36-T39 VanDerWaalsContact N-O 3.1Å; N36-T39 PolarHBondContact ND2-OG1 3.06Å; N36-T39 VanDerWaalsContact O-O 3.08Å; N36-T39 WeakPolarHBondContact OD1-CB 3.42Å; N36-T39 PolarHBondContact OD1-N 2.92Å; N36-T39 PolarHBondContact OD1-OG1 3.02Å; T39-E67 HydrophobicContact CG2-CB 4.43Å; T39-E67 HydrophobicContact CG2-CG 4.36Å; T39-L204 HydrophobicContact CG2-CB 3.85Å; T39-L204 HydrophobicContact CG2-CD2 3.91Å; T39-L204 HydrophobicContact CG2-CG 4.37Å; T39-L205 CarbonylContact C-O 3.49Å; T39-L205 WeakPolarHBondContact CA-O 3.4Å; T39-L205 WeakPolarHBondContact CG2-O 3.36Å
40	I	95	Very high	90.1	Very high	24 Å²	24	38.1 Å²	38.1	12%	0.123	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	160.8	167.5	58.3	167.1	0	0	0	109.8	F22 V32 L33 L204 L205 N207	F22-I40 HydrophobicContact CD2-CG2 3.71Å; F22-I40 HydrophobicContact CE2-CG2 3.86Å; F22-I40 HydrophobicContact CG-CG2 4.15Å; F22-I40 HydrophobicContact CZ-CG2 4.41Å; V32-I40 HydrophobicContact CG1-CB 3.84Å; V32-I40 HydrophobicContact CG1-CD1 3.64Å; V32-I40 HydrophobicContact CG1-CG1 4.27Å; V32-I40 HydrophobicContact CG1-CG2 4.16Å; L33-I40 CarbonylContact O-C 3.54Å; L33-I40 VanDerWaalsContact O-CA 3.25Å; L33-I40 WeakPolarHBondContact O-CA 3.45Å; L33-I40 WeakPolarHBondContact O-CB 3.46Å; I40-L204 WeakPolarHBondContact O-CA 3.37Å; I40-L205 HydrophobicContact CD1-CB 4.47Å; I40-L205 HydrophobicContact CG1-CB 4.04Å; I40-L205 WeakPolarHBondContact CG1-O 3.23Å; I40-L205 PolarHBondContact N-O 3.45Å; I40-L205 PolarHBondContact O-N 2.86Å; I40-N207 HydrophobicContact CG2-CB 3.98Å
41	C	92.9	Very high	91.3	Very high	1 Å²	1	36 Å²	36	1%	0.007	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	152.2	171.8	71.3	0	0	0	0	111.2	L33 F202 I203 L204	L33-C41 WeakPolarHBondContact CB-SG 3.31Å; L33-C41 PolarHBondContact N-O 3.48Å; L33-C41 PolarHBondContact O-N 2.87Å; C41-F202 HydrophobicContact CB-CB 4.26Å; C41-F202 HydrophobicContact CB-CD1 4.22Å; C41-I203 WeakPolarHBondContact CA-O 3.17Å; C41-L204 HydrophobicContact CB-CD2 3.75Å
42	K	91.2	Very high	92.3	Very high	13 Å²	13	36.4 Å²	36.4	6%	0.057	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	154.5	173.9	63.5	179.5	-178.6	178.4	0	110.7	L44 E48 F202 I203 L205	K42-L44 PolarHBondContact O-N 3.41Å; K42-E48 WeakPolarHBondContact CE-OE1 3.46Å; K42-E48 WeakPolarHBondContact CE-OE2 3.39Å; K42-E48 IonicContact NZ-OE1 2.62Å; K42-E48 PolarHBondContact NZ-OE1 3.4Å; K42-E48 IonicContact NZ-OE2 2.71Å; K42-E48 PolarHBondContact NZ-OE2 3.42Å; K42-F202 CarbonylContact O-C 3.53Å; K42-F202 WeakPolarHBondContact O-CA 3.32Å; K42-F202 WeakPolarHBondContact O-CB 3.39Å; K42-F202 WeakPolarHBondContact O-CD1 3.39Å; K42-I203 HydrophobicContact CD-CD1 4.28Å; K42-I203 HydrophobicContact CD-CG1 4.44Å; K42-I203 HydrophobicContact CG-CD1 3.96Å; K42-I203 HydrophobicContact CG-CG1 3.59Å; K42-I203 PolarHBondContact N-O 3.39Å; K42-I203 VanDerWaalsContact N-O 3.1Å; K42-I203 PolarHBondContact O-N 3.33Å; K42-L205 HydrophobicContact CD-CD1 4.3Å
43	P	90.8	Very high	92.6	Very high	10 Å²	10	41.1 Å²	41.1	7%	0.065	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.1	133.1	178.5	-25.7	33.4	0	0	0	111	C31 I45 M190 F202	C31-P43 WeakPolarHBondContact O-CD 3.48Å; P43-I45 PolarHBondContact O-N 3.29Å; P43-M190 HydrophobicContact CB-CE 4.28Å; P43-M190 HydrophobicContact CG-CE 3.45Å; P43-M190 VanDerWaalsContact CG-CE 3.45Å; P43-F202 HydrophobicContact CB-CE1 4.46Å; P43-F202 HydrophobicContact CB-CE2 4.46Å; P43-F202 HydrophobicContact CB-CZ 4.29Å; P43-F202 HydrophobicContact CG-CD1 4.41Å; P43-F202 HydrophobicContact CG-CE1 3.73Å; P43-F202 HydrophobicContact CG-CE2 4.33Å; P43-F202 HydrophobicContact CG-CZ 3.69Å
44	L	92.3	Very high	92.7	Very high	14 Å²	14	44.2 Å²	44.2	7%	0.073	21%	0.213	C	C	.	.			trans	-69.1	120.9	-179.1	-174	154.2	0	0	0	109.4	K42 H49 V69 N101 K201 I203	K42-L44 PolarHBondContact O-N 3.41Å; L44-H49 HydrophobicContact CD1-CB 4.21Å; L44-H49 HydrophobicContact CD2-CB 4.18Å; L44-H49 HydrophobicContact CG-CB 4.01Å; L44-V69 HydrophobicContact CD1-CG1 3.73Å; L44-V69 HydrophobicContact CD1-CG2 3.91Å; L44-N101 WeakPolarHBondContact O-CB 3.3Å; L44-N101 PolarHBondContact O-ND2 2.99Å; L44-K201 HydrophobicContact CB-CB 3.95Å; L44-K201 VanDerWaalsContact CB-O 3.23Å; L44-K201 WeakPolarHBondContact CB-O 3.29Å; L44-K201 HydrophobicContact CD1-CB 4.07Å; L44-K201 PolarHBondContact N-O 2.87Å; L44-I203 HydrophobicContact CB-CG2 4.03Å; L44-I203 HydrophobicContact CD1-CG2 3.73Å; L44-I203 HydrophobicContact CG-CG2 3.72Å
45	I	91.6	Very high	92.8	Very high	47 Å²	47	41.6 Å²	41.6	24%	0.241	20%	0.204	C	C	.	.			trans	-104.8	125	164.3	-63.2	172.3	0	0	0	106.6	P43 R47 E48 H49 A383	P43-I45 PolarHBondContact O-N 3.29Å; I45-R47 VanDerWaalsContact C-N 3.27Å; I45-R47 HydrophobicContact CG2-CB 4.43Å; I45-R47 PolarHBondContact O-N 3.39Å; I45-E48 HydrophobicContact CB-CB 4.21Å; I45-E48 PolarHBondContact O-N 3.11Å; I45-H49 PolarHBondContact O-N 3.38Å; I45-A383 HydrophobicContact CD1-CB 3.72Å; I45-A383 HydrophobicContact CG2-CB 4.04Å
46	Q	91.4	Very high	92.8	Very high	90 Å²	90	41.1 Å²	41.1	42%	0.421	20%	0.204	S	C	.	.	H	α-helix	trans	-54.2	-44.3	-171.5	-173.6	61.9	18.8	0	0	112.5	E48 H49 Q50	Q46-E48 PolarHBondContact O-N 3.08Å; Q46-H49 WeakPolarHBondContact O-CB 3.21Å; Q46-H49 PolarHBondContact O-N 2.86Å; Q46-Q50 WeakPolarHBondContact O-CB 3.33Å; Q46-Q50 PolarHBondContact O-N 3.03Å
47	R	91.2	Very high	92.9	Very high	27 Å²	27	42.7 Å²	42.7	10%	0.102	22%	0.216	C	C	.	.	H	α-helix	trans	-63.2	-39.1	178.8	-172.2	157.8	-69	-139.2	-8.1	113.5	I45 F51 A383 T385 D393	I45-R47 VanDerWaalsContact C-N 3.27Å; I45-R47 HydrophobicContact CG2-CB 4.43Å; I45-R47 PolarHBondContact O-N 3.39Å; R47-F51 PolarHBondContact O-N 3.44Å; R47-F51 VanDerWaalsContact O-N 3.09Å; R47-A383 VanDerWaalsContact CD-O 3.3Å; R47-A383 WeakPolarHBondContact CD-O 3.35Å; R47-A383 WeakPolarHBondContact CG-O 3.41Å; R47-T385 WeakPolarHBondContact CD-O 3.29Å; R47-D393 IonicContact CZ-OD1 3.25Å; R47-D393 IonicContact NH1-OD1 3.93Å; R47-D393 PolarHBondContact NH1-OD1 3.37Å; R47-D393 IonicContact NH2-OD1 3.81Å; R47-D393 PolarHBondContact NH2-OD1 2.81Å
48	E	94.8	Very high	93.1	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.019	21%	0.211	C	C	.	.	H	α-helix	trans	-72.7	-39.2	176.7	178.2	154.7	-135.7	0	0	111.8	K42 I45 Q46 F51 Y52 I203 F382 A383	K42-E48 WeakPolarHBondContact CE-OE1 3.46Å; K42-E48 WeakPolarHBondContact CE-OE2 3.39Å; K42-E48 IonicContact NZ-OE1 2.62Å; K42-E48 PolarHBondContact NZ-OE1 3.4Å; K42-E48 IonicContact NZ-OE2 2.71Å; K42-E48 PolarHBondContact NZ-OE2 3.42Å; I45-E48 HydrophobicContact CB-CB 4.21Å; I45-E48 PolarHBondContact O-N 3.11Å; Q46-E48 PolarHBondContact O-N 3.08Å; E48-F51 WeakPolarHBondContact O-CB 3.45Å; E48-F51 PolarHBondContact O-N 3.18Å; E48-Y52 HydrophobicContact CG-CD2 4.02Å; E48-Y52 HydrophobicContact CG-CE2 3.82Å; E48-Y52 VanDerWaalsContact O-CD2 3.27Å; E48-Y52 WeakPolarHBondContact O-CD2 3.14Å; E48-Y52 PolarHBondContact O-N 2.75Å; E48-Y52 VanDerWaalsContact O-N 3.14Å; E48-I203 HydrophobicContact CG-CD1 3.96Å; E48-F382 HydrophobicContact CG-CB 4.13Å; E48-F382 PolarHBondContact OE1-N 3.37Å; E48-A383 HydrophobicContact CB-CB 4.47Å
49	H	94.5	Very high	93.2	Very high	19 Å²	19	35 Å²	35	9%	0.088	18%	0.179	C	C	.	.	H	α-helix	trans	-59.3	-50.1	173.7	178.2	-109	0	0	0	111.1	L44 I45 Q46 F51 Y52 E53 Y66 V69 I203	L44-H49 HydrophobicContact CD1-CB 4.21Å; L44-H49 HydrophobicContact CD2-CB 4.18Å; L44-H49 HydrophobicContact CG-CB 4.01Å; I45-H49 PolarHBondContact O-N 3.38Å; Q46-H49 WeakPolarHBondContact O-CB 3.21Å; Q46-H49 PolarHBondContact O-N 2.86Å; H49-F51 VanDerWaalsContact C-N 3.25Å; H49-F51 PolarHBondContact O-N 2.77Å; H49-Y52 PolarHBondContact O-N 3.06Å; H49-E53 IonicContact CE1-OE1 2.94Å; H49-E53 PolarHBondContact CE1-OE1 3.19Å; H49-E53 IonicContact CE1-OE2 2.86Å; H49-E53 PolarHBondContact CE1-OE2 2.62Å; H49-E53 VanDerWaalsContact CE1-OE2 3.25Å; H49-E53 IonicContact ND1-OE1 3.76Å; H49-E53 IonicContact ND1-OE2 3.47Å; H49-E53 PolarHBondContact ND1-OE2 2.81Å; H49-E53 IonicContact NE2-OE1 3.49Å; H49-E53 WeakPolarHBondContact O-CG 3.39Å; H49-E53 PolarHBondContact O-N 2.95Å; H49-Y66 AromaticContact CD2-CZ 3.87Å; H49-Y66 PolarHBondContact CD2-OH 2.6Å; H49-Y66 AromaticContact NE2-CZ 3.92Å; H49-Y66 PolarHBondContact NE2-OH 3.43Å; H49-V69 WeakPolarHBondContact NE2-CG2 3.49Å; H49-I203 HydrophobicContact CB-CG2 4.24Å
50	Q	94.1	Very high	93.2	Very high	39 Å²	39	41.3 Å²	41.3	18%	0.182	20%	0.201	C	C	.	.	H	α-helix	trans	-56	-40.8	175.6	-175.1	177.9	21.4	0	0	111.7	Q46 Y52 E53 T54 Y390	Q46-Q50 WeakPolarHBondContact O-CB 3.33Å; Q46-Q50 PolarHBondContact O-N 3.03Å; Q50-Y52 PolarHBondContact O-N 3.2Å; Q50-E53 PolarHBondContact O-N 3.47Å; Q50-T54 HydrophobicContact CG-CG2 4.39Å; Q50-T54 WeakPolarHBondContact O-CG2 3.41Å; Q50-T54 PolarHBondContact O-N 2.9Å; Q50-T54 PolarHBondContact O-OG1 3.23Å; Q50-T54 VanDerWaalsContact O-OG1 3.06Å; Q50-Y390 HydrophobicContact CG-CD1 4.16Å; Q50-Y390 HydrophobicContact CG-CE1 3.94Å
51	F	94.8	Very high	93.2	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-59.3	-44.3	175.6	175.9	-94.8	0	0	0	113.1	R47 E48 H49 T54 L55 M59 T63 Y323 F325 F382 T385 Y390	R47-F51 PolarHBondContact O-N 3.44Å; R47-F51 VanDerWaalsContact O-N 3.09Å; E48-F51 WeakPolarHBondContact O-CB 3.45Å; E48-F51 PolarHBondContact O-N 3.18Å; H49-F51 VanDerWaalsContact C-N 3.25Å; H49-F51 PolarHBondContact O-N 2.77Å; F51-T54 CarbonylContact O-C 3.49Å; F51-L55 HydrophobicContact CD1-CD1 4.49Å; F51-L55 HydrophobicContact CE1-CD1 3.62Å; F51-L55 HydrophobicContact CE2-CD1 4.37Å; F51-L55 HydrophobicContact CZ-CD1 3.56Å; F51-L55 VanDerWaalsContact O-CA 3.32Å; F51-L55 WeakPolarHBondContact O-CA 3.26Å; F51-L55 WeakPolarHBondContact O-CB 3.43Å; F51-L55 PolarHBondContact O-N 2.96Å; F51-M59 HydrophobicContact CZ-CE 3.98Å; F51-T63 HydrophobicContact CE1-CG2 4.34Å; F51-Y323 HydrophobicContact CD2-CE1 4.28Å; F51-Y323 HydrophobicContact CE2-CD1 4.38Å; F51-Y323 HydrophobicContact CE2-CE1 4.1Å; F51-F325 AromaticContact CE2-CE1 3.68Å; F51-F325 HydrophobicContact CE2-CE1 3.68Å; F51-F325 HydrophobicContact CE2-CZ 4.48Å; F51-F325 AromaticContact CZ-CE1 3.98Å; F51-F325 HydrophobicContact CZ-CE1 3.98Å; F51-F382 HydrophobicContact CB-CB 3.95Å; F51-F382 HydrophobicContact CD1-CB 3.47Å; F51-F382 VanDerWaalsContact CD1-CB 3.47Å; F51-F382 AromaticContact CD1-CD1 3.76Å; F51-F382 HydrophobicContact CD1-CD1 3.76Å; F51-F382 AromaticContact CD1-CD2 3.31Å; F51-F382 HydrophobicContact CD1-CD2 3.31Å; F51-F382 HydrophobicContact CD1-CE1 4.33Å; F51-F382 AromaticContact CD1-CE2 3.93Å; F51-F382 HydrophobicContact CD1-CE2 3.93Å; F51-F382 AromaticContact CD1-CG 3.2Å; F51-F382 HydrophobicContact CD1-CG 3.2Å; F51-F382 HydrophobicContact CD1-CZ 4.4Å; F51-F382 HydrophobicContact CD2-CB 4.46Å; F51-F382 HydrophobicContact CE1-CB 4.09Å; F51-F382 AromaticContact CE1-CD1 3.43Å; F51-F382 HydrophobicContact CE1-CD1 3.43Å; F51-F382 VanDerWaalsContact CE1-CD1 3.43Å; F51-F382 AromaticContact CE1-CD2 3.34Å; F51-F382 HydrophobicContact CE1-CD2 3.34Å; F51-F382 AromaticContact CE1-CE1 3.56Å; F51-F382 HydrophobicContact CE1-CE1 3.56Å; F51-F382 AromaticContact CE1-CE2 3.47Å; F51-F382 HydrophobicContact CE1-CE2 3.47Å; F51-F382 VanDerWaalsContact CE1-CE2 3.47Å; F51-F382 AromaticContact CE1-CG 3.31Å; F51-F382 HydrophobicContact CE1-CG 3.31Å; F51-F382 AromaticContact CE1-CZ 3.58Å; F51-F382 HydrophobicContact CE1-CZ 3.58Å; F51-F382 HydrophobicContact CE2-CD1 4.3Å; F51-F382 HydrophobicContact CG-CB 3.68Å; F51-F382 HydrophobicContact CG-CD1 4.3Å; F51-F382 HydrophobicContact CG-CD2 4.36Å; F51-F382 AromaticContact CG-CG 3.87Å; F51-F382 HydrophobicContact CG-CG 3.87Å; F51-F382 AromaticContact CZ-CD1 3.72Å; F51-F382 HydrophobicContact CZ-CD1 3.72Å; F51-F382 HydrophobicContact CZ-CD2 4.41Å; F51-F382 AromaticContact CZ-CE1 3.76Å; F51-F382 HydrophobicContact CZ-CE1 3.76Å; F51-F382 HydrophobicContact CZ-CE2 4.43Å; F51-F382 HydrophobicContact CZ-CG 4.06Å; F51-F382 HydrophobicContact CZ-CZ 4.13Å; F51-T385 HydrophobicContact CD2-CG2 3.78Å; F51-T385 HydrophobicContact CE2-CG2 4.1Å; F51-Y390 WeakPolarHBondContact CA-OH 3.38Å
52	Y	95.7	Very high	93.4	Very high	10 Å²	10	45.6 Å²	45.6	4%	0.039	22%	0.219	C	C	.	.	H	α-helix	trans	-68.8	-36.5	176.9	-79.6	-70.9	0	0	0	112.7	E48 H49 Q50 L55 P64 Y66 I203 L205 F382	E48-Y52 HydrophobicContact CG-CD2 4.02Å; E48-Y52 HydrophobicContact CG-CE2 3.82Å; E48-Y52 VanDerWaalsContact O-CD2 3.27Å; E48-Y52 WeakPolarHBondContact O-CD2 3.14Å; E48-Y52 PolarHBondContact O-N 2.75Å; E48-Y52 VanDerWaalsContact O-N 3.14Å; H49-Y52 PolarHBondContact O-N 3.06Å; Q50-Y52 PolarHBondContact O-N 3.2Å; Y52-L55 WeakPolarHBondContact O-CB 3.46Å; Y52-P64 WeakPolarHBondContact CE1-O 3.46Å; Y52-Y66 HydrophobicContact CG-CD2 4.26Å; Y52-Y66 HydrophobicContact CG-CG 4.3Å; Y52-I203 HydrophobicContact CD2-CD1 4.22Å; Y52-I203 HydrophobicContact CE2-CD1 4.16Å; Y52-L205 HydrophobicContact CD1-CD2 4.12Å; Y52-L205 HydrophobicContact CD2-CD2 4.08Å; Y52-L205 HydrophobicContact CE1-CD2 3.69Å; Y52-L205 HydrophobicContact CE2-CD1 4.07Å; Y52-L205 HydrophobicContact CE2-CD2 3.65Å; Y52-L205 HydrophobicContact CG-CD2 4.3Å; Y52-L205 VanDerWaalsContact CZ-CD2 3.42Å; Y52-F382 HydrophobicContact CE1-CD2 4.42Å; Y52-F382 HydrophobicContact CE1-CE2 4.19Å; Y52-F382 AromaticContact CE2-CD2 3.78Å; Y52-F382 HydrophobicContact CE2-CD2 3.78Å; Y52-F382 HydrophobicContact CE2-CE2 4.28Å; Y52-F382 AromaticContact CZ-CD2 3.71Å; Y52-F382 AromaticContact CZ-CE2 3.71Å; Y52-F382 WeakPolarHBondContact OH-CE2 3.44Å
53	E	93.3	Very high	93.7	Very high	120 Å²	120	45 Å²	45	56%	0.561	22%	0.216	S	C	*	.	H	α-helix	trans	-65.7	-37.9	175.9	-70.8	-176.2	129.8	0	0	112.5	H49 Q50	H49-E53 IonicContact CE1-OE1 2.94Å; H49-E53 PolarHBondContact CE1-OE1 3.19Å; H49-E53 IonicContact CE1-OE2 2.86Å; H49-E53 PolarHBondContact CE1-OE2 2.62Å; H49-E53 VanDerWaalsContact CE1-OE2 3.25Å; H49-E53 IonicContact ND1-OE1 3.76Å; H49-E53 IonicContact ND1-OE2 3.47Å; H49-E53 PolarHBondContact ND1-OE2 2.81Å; H49-E53 IonicContact NE2-OE1 3.49Å; H49-E53 WeakPolarHBondContact O-CG 3.39Å; H49-E53 PolarHBondContact O-N 2.95Å; Q50-E53 PolarHBondContact O-N 3.47Å
54	T	92.3	Very high	94	Very high	65 Å²	65	44.8 Å²	44.8	40%	0.399	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	17.3	-178.4	72.7	0	0	0	0	113.2	Q50 F51 P56 Y390	Q50-T54 HydrophobicContact CG-CG2 4.39Å; Q50-T54 WeakPolarHBondContact O-CG2 3.41Å; Q50-T54 PolarHBondContact O-N 2.9Å; Q50-T54 PolarHBondContact O-OG1 3.23Å; Q50-T54 VanDerWaalsContact O-OG1 3.06Å; F51-T54 CarbonylContact O-C 3.49Å; T54-P56 WeakPolarHBondContact O-CD 3.32Å; T54-Y390 WeakPolarHBondContact OG1-CE1 3.21Å; T54-Y390 PolarHBondContact OG1-OH 3.31Å
55	L	92.6	Very high	94.2	Very high	19 Å²	19	49.4 Å²	49.4	10%	0.099	24%	0.236	C	C	.	.			trans	-60.7	121.1	-171.3	177.9	66.3	0	0	0	111.7	F51 Y52 T57 M59 R60 T63	F51-L55 HydrophobicContact CD1-CD1 4.49Å; F51-L55 HydrophobicContact CE1-CD1 3.62Å; F51-L55 HydrophobicContact CE2-CD1 4.37Å; F51-L55 HydrophobicContact CZ-CD1 3.56Å; F51-L55 VanDerWaalsContact O-CA 3.32Å; F51-L55 WeakPolarHBondContact O-CA 3.26Å; F51-L55 WeakPolarHBondContact O-CB 3.43Å; F51-L55 PolarHBondContact O-N 2.96Å; Y52-L55 WeakPolarHBondContact O-CB 3.46Å; L55-T57 PolarHBondContact O-N 2.97Å; L55-M59 HydrophobicContact CD1-CB 3.82Å; L55-R60 HydrophobicContact CD2-CB 4.46Å; L55-R60 HydrophobicContact CD2-CG 3.79Å; L55-R60 HydrophobicContact CG-CG 4.11Å; L55-T63 HydrophobicContact CD1-CG2 4.04Å; L55-T63 VanDerWaalsContact CD2-OG1 3.26Å; L55-T63 WeakPolarHBondContact CD2-OG1 3.32Å
56	P	92.7	Very high	94.4	Very high	18 Å²	18	50 Å²	50	12%	0.117	24%	0.235	C	C	.	.			trans	-56.7	138.4	175.4	-26.4	35.5	0	0	0	112	T54 E58 M59 R60 Y323	T54-P56 WeakPolarHBondContact O-CD 3.32Å; P56-E58 PolarHBondContact O-N 2.65Å; P56-M59 HydrophobicContact CB-CB 4.46Å; P56-M59 HydrophobicContact CB-CG 4.22Å; P56-M59 HydrophobicContact CB-SD 4.49Å; P56-M59 HydrophobicContact CG-SD 4.15Å; P56-M59 WeakPolarHBondContact O-CB 3.32Å; P56-M59 PolarHBondContact O-N 2.58Å; P56-R60 PolarHBondContact O-N 2.77Å; P56-Y323 HydrophobicContact CG-CE2 3.77Å; P56-Y323 WeakPolarHBondContact CG-OH 3.15Å
57	T	92.8	Very high	94.6	Very high	93 Å²	93	50 Å²	50	57%	0.571	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-57.2	-38.4	-174.8	-57	0	0	0	0	112	L55 M59 R60	L55-T57 PolarHBondContact O-N 2.97Å; T57-M59 PolarHBondContact O-N 3.18Å; T57-R60 WeakPolarHBondContact O-CB 3.33Å; T57-R60 PolarHBondContact O-N 3.07Å
58	E	93.6	Very high	94.7	Very high	109 Å²	109	49.6 Å²	49.6	51%	0.509	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-65.4	-26.9	179.4	-59.9	83.5	172.6	0	0	112.7	P56 V316	P56-E58 PolarHBondContact O-N 2.65Å; E58-V316 HydrophobicContact CB-CG1 3.86Å; E58-V316 HydrophobicContact CB-CG2 4.34Å
59	M	94.9	Very high	94.7	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-86.8	-15.8	179.1	-68.2	-169.6	68.7	0	0	113.5	F51 L55 P56 T57 K61 F62 T63 V316 L317 Q320 F325 M379	F51-M59 HydrophobicContact CZ-CE 3.98Å; L55-M59 HydrophobicContact CD1-CB 3.82Å; P56-M59 HydrophobicContact CB-CB 4.46Å; P56-M59 HydrophobicContact CB-CG 4.22Å; P56-M59 HydrophobicContact CB-SD 4.49Å; P56-M59 HydrophobicContact CG-SD 4.15Å; P56-M59 WeakPolarHBondContact O-CB 3.32Å; P56-M59 PolarHBondContact O-N 2.58Å; T57-M59 PolarHBondContact O-N 3.18Å; M59-K61 VanDerWaalsContact C-N 3.26Å; M59-K61 PolarHBondContact O-N 2.88Å; M59-F62 CarbonylContact O-C 3.58Å; M59-F62 WeakPolarHBondContact O-CA 3.28Å; M59-F62 PolarHBondContact O-N 3.26Å; M59-T63 PolarHBondContact O-N 3.07Å; M59-T63 PolarHBondContact O-OG1 3.18Å; M59-V316 HydrophobicContact CG-CG1 3.82Å; M59-L317 HydrophobicContact CE-CD2 3.8Å; M59-L317 HydrophobicContact SD-CD2 4.34Å; M59-Q320 HydrophobicContact CG-CG 4.12Å; M59-Q320 HydrophobicContact SD-CG 3.83Å; M59-F325 HydrophobicContact CE-CE1 3.83Å; M59-F325 HydrophobicContact CE-CZ 3.56Å; M59-F325 HydrophobicContact SD-CZ 4.01Å; M59-M379 HydrophobicContact CE-CE 4.1Å; M59-M379 HydrophobicContact CE-SD 3.8Å
60	R	94.8	Very high	94.7	Very high	145 Å²	145	50.3 Å²	50.3	55%	0.547	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-55	-40.6	-177.4	-68.2	-179.6	-175.5	175.8	1.2	112.7	L55 P56 T57 F62 T63	L55-R60 HydrophobicContact CD2-CB 4.46Å; L55-R60 HydrophobicContact CD2-CG 3.79Å; L55-R60 HydrophobicContact CG-CG 4.11Å; P56-R60 PolarHBondContact O-N 2.77Å; T57-R60 WeakPolarHBondContact O-CB 3.33Å; T57-R60 PolarHBondContact O-N 3.07Å; R60-F62 PolarHBondContact O-N 2.86Å; R60-F62 VanDerWaalsContact O-N 3.16Å; R60-T63 PolarHBondContact O-N 2.92Å; R60-T63 VanDerWaalsContact O-O 3.07Å; R60-T63 PolarHBondContact O-OG1 3Å
61	K	95.1	Very high	94.6	Very high	111 Å²	111	49 Å²	49	48%	0.483	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-66.2	-16.3	178	69.2	173.4	179.5	165.9	0	114.2	M59 E312	M59-K61 VanDerWaalsContact C-N 3.26Å; M59-K61 PolarHBondContact O-N 2.88Å; K61-E312 IonicContact NZ-OE2 2.87Å; K61-E312 PolarHBondContact NZ-OE2 3.42Å
62	F	97.3	Very high	94.4	Very high	5 Å²	5	49 Å²	49	2%	0.022	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-111.6	10.6	-178.3	-62.5	-62	0	0	0	113.5	M59 R60 E312 L313 V316 R378 M379	M59-F62 CarbonylContact O-C 3.58Å; M59-F62 WeakPolarHBondContact O-CA 3.28Å; M59-F62 PolarHBondContact O-N 3.26Å; R60-F62 PolarHBondContact O-N 2.86Å; R60-F62 VanDerWaalsContact O-N 3.16Å; F62-E312 HydrophobicContact CZ-CB 3.7Å; F62-L313 HydrophobicContact CB-CD1 3.82Å; F62-L313 HydrophobicContact CD1-CB 4.02Å; F62-L313 HydrophobicContact CD1-CD1 4.23Å; F62-L313 HydrophobicContact CD2-CB 4.26Å; F62-L313 HydrophobicContact CD2-CD1 3.65Å; F62-L313 HydrophobicContact CE1-CB 3.84Å; F62-L313 HydrophobicContact CE2-CB 4.04Å; F62-L313 HydrophobicContact CE2-CD1 4.19Å; F62-L313 HydrophobicContact CG-CB 4.23Å; F62-L313 HydrophobicContact CG-CD1 3.66Å; F62-L313 HydrophobicContact CG-CG 4.43Å; F62-L313 HydrophobicContact CZ-CB 3.84Å; F62-L313 VanDerWaalsContact CZ-N 3.3Å; F62-V316 HydrophobicContact CD2-CG2 4.45Å; F62-V316 HydrophobicContact CE2-CB 4.22Å; F62-V316 HydrophobicContact CE2-CG2 3.83Å; F62-R378 CarbonylContact O-C 3.57Å; F62-R378 VanDerWaalsContact O-CA 3.3Å; F62-R378 WeakPolarHBondContact O-CA 3.38Å; F62-M379 PolarHBondContact O-N 3.49Å
63	T	97.1	Very high	94	Very high	1 Å²	1	49 Å²	49	1%	0.006	24%	0.242	C	C	.	.	S	Bend	trans	-133	148.7	179.3	52.2	0	0	0	0	108.7	F51 L55 M59 R60 Q65 R378 M379 F382	F51-T63 HydrophobicContact CE1-CG2 4.34Å; L55-T63 HydrophobicContact CD1-CG2 4.04Å; L55-T63 VanDerWaalsContact CD2-OG1 3.26Å; L55-T63 WeakPolarHBondContact CD2-OG1 3.32Å; M59-T63 PolarHBondContact O-N 3.07Å; M59-T63 PolarHBondContact O-OG1 3.18Å; R60-T63 PolarHBondContact O-N 2.92Å; R60-T63 VanDerWaalsContact O-O 3.07Å; R60-T63 PolarHBondContact O-OG1 3Å; T63-Q65 PolarHBondContact O-N 3.37Å; T63-R378 PolarHBondContact O-NH1 3.43Å; T63-M379 HydrophobicContact CG2-CB 4.34Å; T63-F382 HydrophobicContact CG2-CE1 4.48Å; T63-F382 HydrophobicContact CG2-CE2 4.09Å; T63-F382 HydrophobicContact CG2-CZ 3.6Å
64	P	97	Very high	93.5	Very high	4 Å²	4	43.9 Å²	43.9	3%	0.026	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-52.8	139.3	172.9	-23.6	31.4	0	0	0	110.9	Y52 Y66 L205 E206 L208 M379 I380	Y52-P64 WeakPolarHBondContact CE1-O 3.46Å; P64-Y66 PolarHBondContact O-N 3.32Å; P64-L205 HydrophobicContact CB-CB 4.14Å; P64-E206 HydrophobicContact CB-CB 4.19Å; P64-L208 HydrophobicContact CG-CD1 4.11Å; P64-L208 HydrophobicContact CG-CG 4.46Å; P64-M379 VanDerWaalsContact CD-O 3.26Å; P64-M379 WeakPolarHBondContact CD-O 3.26Å; P64-I380 HydrophobicContact CG-CG2 3.94Å
65	Q	96.3	Very high	93	Very high	112 Å²	112	44.3 Å²	44.3	52%	0.523	22%	0.216	S	C	.	.	P	Polyproline II helix	trans	-60.6	133.5	172.9	-177.1	175.1	-23.6	0	0	110.1	T63 E67 L205 E206	T63-Q65 PolarHBondContact O-N 3.37Å; Q65-E67 VanDerWaalsContact CD-OE1 3.3Å; Q65-E67 PolarHBondContact NE2-OE1 3.49Å; Q65-L205 CarbonylContact O-C 3.47Å; Q65-L205 VanDerWaalsContact O-CA 3.29Å; Q65-L205 WeakPolarHBondContact O-CA 3.38Å; Q65-E206 HydrophobicContact CB-CB 3.97Å; Q65-E206 PolarHBondContact N-OE2 2.91Å; Q65-E206 PolarHBondContact O-N 2.86Å
66	Y	96.6	Very high	92.3	Very high	59 Å²	59	50.1 Å²	50.1	23%	0.231	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	126.4	175	177.2	-121.3	0	0	0	110.2	H49 Y52 P64 G68 V69 I203 L204 L205	H49-Y66 AromaticContact CD2-CZ 3.87Å; H49-Y66 PolarHBondContact CD2-OH 2.6Å; H49-Y66 AromaticContact NE2-CZ 3.92Å; H49-Y66 PolarHBondContact NE2-OH 3.43Å; Y52-Y66 HydrophobicContact CG-CD2 4.26Å; Y52-Y66 HydrophobicContact CG-CG 4.3Å; P64-Y66 PolarHBondContact O-N 3.32Å; Y66-G68 WeakPolarHBondContact CE2-O 3.42Å; Y66-G68 VanDerWaalsContact CZ-CA 3.49Å; Y66-V69 WeakPolarHBondContact OH-CG2 3.49Å; Y66-I203 HydrophobicContact CE2-CB 4.15Å; Y66-I203 HydrophobicContact CE2-CG2 4.25Å; Y66-L204 WeakPolarHBondContact CD2-O 3.37Å; Y66-L205 HydrophobicContact CD2-CD2 4.07Å
67	E	94.8	Very high	91.4	Very high	89 Å²	89	52 Å²	52	42%	0.416	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	3.3	-173.5	-58.5	-69.4	177	0	0	112.6	T39 Q65 L204	T39-E67 HydrophobicContact CG2-CB 4.43Å; T39-E67 HydrophobicContact CG2-CG 4.36Å; Q65-E67 VanDerWaalsContact CD-OE1 3.3Å; Q65-E67 PolarHBondContact NE2-OE1 3.49Å; E67-L204 HydrophobicContact CB-CB 3.74Å; E67-L204 PolarHBondContact N-O 2.85Å
68	G	94.5	Very high	90.5	Very high	20 Å²	20	57.2 Å²	57.2	21%	0.206	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	112.1	-160.2	176.4	0	0	0	0	0	114.8	Y66 L204	Y66-G68 WeakPolarHBondContact CE2-O 3.42Å; Y66-G68 VanDerWaalsContact CZ-CA 3.49Å; G68-L204 PolarHBondContact O-N 2.88Å
69	V	95	Very high	89.5	Confident	30 Å²	30	58.8 Å²	58.8	18%	0.182	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	141.9	-177.9	-171.9	0	0	0	0	110.3	L44 H49 Y66 L89 K201 F202 I203	L44-V69 HydrophobicContact CD1-CG1 3.73Å; L44-V69 HydrophobicContact CD1-CG2 3.91Å; H49-V69 WeakPolarHBondContact NE2-CG2 3.49Å; Y66-V69 WeakPolarHBondContact OH-CG2 3.49Å; V69-L89 HydrophobicContact CB-CD1 3.77Å; V69-L89 HydrophobicContact CG1-CD1 3.71Å; V69-L89 WeakPolarHBondContact O-CD1 3.47Å; V69-K201 HydrophobicContact CG1-CB 4Å; V69-K201 HydrophobicContact CG1-CG 4.42Å; V69-F202 VanDerWaalsContact CA-O 3.31Å; V69-F202 WeakPolarHBondContact CA-O 3.48Å; V69-F202 VanDerWaalsContact CG1-O 3.28Å; V69-F202 WeakPolarHBondContact CG1-O 3.24Å; V69-I203 HydrophobicContact CG2-CG2 4.39Å
70	V	93.9	Very high	88.1	Confident	7 Å²	7	60.8 Å²	60.8	4%	0.042	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	154.8	172.5	-69.7	0	0	0	0	111.2	F35 V72 A86 K201 F202 L204	F35-V70 HydrophobicContact CE2-CG1 4.29Å; V70-V72 HydrophobicContact CG2-CG2 4.19Å; V70-A86 HydrophobicContact CB-CB 4.43Å; V70-A86 HydrophobicContact CG2-CB 4.15Å; V70-K201 WeakPolarHBondContact O-CA 3.46Å; V70-F202 HydrophobicContact CG2-CB 4.04Å; V70-F202 PolarHBondContact N-O 2.99Å; V70-F202 PolarHBondContact O-N 3.15Å; V70-L204 HydrophobicContact CG1-CD1 3.63Å; V70-L204 HydrophobicContact CG1-CD2 4.27Å; V70-L204 HydrophobicContact CG1-CG 4.05Å; V70-L204 HydrophobicContact CG2-CD2 3.89Å; V70-L204 HydrophobicContact CG2-CG 4.15Å
71	S	92.3	Very high	86.8	Confident	13 Å²	13	58.2 Å²	58.2	9%	0.091	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	134.8	168.2	-171.1	0	0	0	0	109.2	A86 Y87 Y200	S71-A86 CarbonylContact O-C 3.57Å; S71-A86 WeakPolarHBondContact O-CA 3.29Å; S71-Y87 PolarHBondContact N-O 2.98Å; S71-Y87 PolarHBondContact O-N 3.29Å; S71-Y200 CarbonylContact C-O 3.52Å
72	V	90.4	Very high	85.6	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	127.7	-179.8	-178.7	0	0	0	0	109.3	L19 V70 L84 I85 A86 Q199 Y200 F202	L19-V72 HydrophobicContact CD1-CG1 3.73Å; L19-V72 HydrophobicContact CD1-CG2 3.89Å; V70-V72 HydrophobicContact CG2-CG2 4.19Å; V72-L84 HydrophobicContact CG1-CB 4.25Å; V72-L84 HydrophobicContact CG1-CD2 3.57Å; V72-I85 CarbonylContact C-O 3.59Å; V72-I85 VanDerWaalsContact CA-O 3.28Å; V72-I85 WeakPolarHBondContact CA-O 3.42Å; V72-A86 HydrophobicContact CG2-CB 4.08Å; V72-Q199 WeakPolarHBondContact O-CA 3.33Å; V72-Y200 PolarHBondContact N-O 3.27Å; V72-Y200 PolarHBondContact O-N 2.87Å; V72-F202 HydrophobicContact CB-CD2 3.64Å; V72-F202 HydrophobicContact CB-CE2 3.78Å; V72-F202 HydrophobicContact CB-CG 4.3Å; V72-F202 HydrophobicContact CG1-CD2 4.4Å; V72-F202 HydrophobicContact CG1-CE2 4.14Å; V72-F202 HydrophobicContact CG1-CZ 4.45Å; V72-F202 HydrophobicContact CG2-CB 3.84Å; V72-F202 HydrophobicContact CG2-CD1 4.22Å; V72-F202 HydrophobicContact CG2-CD2 3.4Å; V72-F202 VanDerWaalsContact CG2-CD2 3.4Å; V72-F202 HydrophobicContact CG2-CE2 3.98Å; V72-F202 HydrophobicContact CG2-CG 3.57Å
73	S	87.1	Confident	84.8	Confident	8 Å²	8	56.9 Å²	56.9	6%	0.056	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	156.5	174.3	59	0	0	0	0	112.1	E75 L84 I85 Y87 N198	S73-E75 PolarHBondContact OG-OE1 2.89Å; S73-E75 VanDerWaalsContact OG-OE1 3.12Å; S73-L84 WeakPolarHBondContact O-CA 3.36Å; S73-I85 PolarHBondContact N-O 3.21Å; S73-I85 PolarHBondContact O-N 3.33Å; S73-Y87 VanDerWaalsContact OG-CE2 3.31Å; S73-Y87 WeakPolarHBondContact OG-CE2 3.47Å; S73-N198 WeakPolarHBondContact CA-O 3.14Å; S73-N198 WeakPolarHBondContact CB-O 3.4Å
74	F	82.2	Confident	84.2	Confident	13 Å²	13	57.2 Å²	57.2	6%	0.057	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	127.8	168	-66	-93.4	0	0	0	108.8	L82 C83 L84 M190 A194 N198 Y200	F74-L82 HydrophobicContact CB-CD2 4.49Å; F74-C83 WeakPolarHBondContact CA-O 3.47Å; F74-L84 HydrophobicContact CD1-CD2 3.91Å; F74-L84 HydrophobicContact CD1-CG 4.36Å; F74-L84 HydrophobicContact CD2-CD2 4.48Å; F74-L84 HydrophobicContact CE1-CD2 3.43Å; F74-L84 VanDerWaalsContact CE1-CD2 3.43Å; F74-L84 HydrophobicContact CE1-CG 4.03Å; F74-L84 HydrophobicContact CE2-CD2 4.03Å; F74-L84 HydrophobicContact CG-CD2 4.39Å; F74-L84 HydrophobicContact CZ-CD2 3.46Å; F74-L84 VanDerWaalsContact CZ-CD2 3.46Å; F74-L84 HydrophobicContact CZ-CG 4.49Å; F74-M190 HydrophobicContact CE1-CB 3.91Å; F74-M190 HydrophobicContact CE2-CB 3.92Å; F74-M190 HydrophobicContact CZ-CB 3.23Å; F74-M190 HydrophobicContact CZ-CG 4.13Å; F74-M190 HydrophobicContact CZ-SD 3.96Å; F74-A194 HydrophobicContact CB-CB 4.42Å; F74-A194 HydrophobicContact CD2-CB 3.89Å; F74-A194 HydrophobicContact CG-CB 4.17Å; F74-N198 WeakPolarHBondContact CB-OD1 3.28Å; F74-N198 PolarHBondContact N-OD1 3.49Å; F74-N198 PolarHBondContact O-ND2 3.44Å; F74-N198 PolarHBondContact O-OD1 3.01Å; F74-Y200 HydrophobicContact CD2-CD2 4.1Å; F74-Y200 AromaticContact CD2-CE2 3.77Å; F74-Y200 HydrophobicContact CD2-CE2 3.77Å; F74-Y200 AromaticContact CE2-CD2 3.58Å; F74-Y200 HydrophobicContact CE2-CD2 3.58Å; F74-Y200 AromaticContact CE2-CE2 3.36Å; F74-Y200 HydrophobicContact CE2-CE2 3.36Å
75	E	81.5	Confident	83.8	Confident	74 Å²	74	58.2 Å²	58.2	35%	0.346	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	150.7	177	-59.7	-166.3	-168.8	0	0	109.3	S73 L82 C83 I85 Y87	S73-E75 PolarHBondContact OG-OE1 2.89Å; S73-E75 VanDerWaalsContact OG-OE1 3.12Å; E75-L82 CarbonylContact O-C 3.56Å; E75-L82 WeakPolarHBondContact O-CA 3.33Å; E75-C83 PolarHBondContact N-O 3.05Å; E75-C83 PolarHBondContact O-N 2.7Å; E75-I85 HydrophobicContact CB-CD1 4.13Å; E75-I85 HydrophobicContact CB-CG1 4.41Å; E75-I85 VanDerWaalsContact CD-CD1 3.47Å; E75-I85 HydrophobicContact CG-CD1 4.08Å; E75-I85 HydrophobicContact CG-CG1 4.29Å; E75-I85 VanDerWaalsContact OE2-CD1 3.24Å; E75-I85 WeakPolarHBondContact OE2-CD1 3.35Å; E75-Y87 PolarHBondContact OE1-OH 2.82Å
76	E	77.9	Confident	83.6	Confident	141 Å²	141	52.9 Å²	52.9	66%	0.659	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	128.7	171.3	-69.9	-178.1	170.8	0	0	107.9	N81 L82	E76-N81 CarbonylContact C-O 3.58Å; E76-N81 VanDerWaalsContact CA-O 3.3Å; E76-N81 WeakPolarHBondContact CA-O 3.32Å; E76-L82 HydrophobicContact CG-CD2 3.76Å
77	D	73.5	Confident	83.3	Confident	57 Å²	57	53.2 Å²	53.2	31%	0.305	28%	0.282	S	S	.	.			trans	-72.5	176.3	172.1	69.7	13.7	0	0	0	111.4	D79 G80 N81	D77-D79 PolarHBondContact O-N 2.92Å; D77-D79 VanDerWaalsContact O-N 3.12Å; D77-D79 WeakPolarHBondContact OD1-CA 3.46Å; D77-D79 WeakPolarHBondContact OD1-CB 3.4Å; D77-D79 PolarHBondContact OD1-N 3.17Å; D77-G80 PolarHBondContact O-N 2.94Å; D77-G80 PolarHBondContact OD1-N 3.2Å; D77-N81 PolarHBondContact N-O 3.24Å; D77-N81 WeakPolarHBondContact OD1-CA 3.18Å; D77-N81 WeakPolarHBondContact OD1-CB 3.15Å; D77-N81 PolarHBondContact OD1-N 3.48Å; D77-N81 PolarHBondContact OD1-ND2 3.39Å; D77-N81 WeakPolarHBondContact OD2-CB 3.39Å; D77-N81 PolarHBondContact OD2-ND2 2.79Å; D77-N81 VanDerWaalsContact OD2-ND2 3.16Å
78	E	75.6	Confident	82.7	Confident	204 Å²	204	51.9 Å²	51.9	95%	0.953	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-22.4	-179.3	-60.6	-174.1	168.5	0	0	113.2
79	D	72.4	Confident	82	Confident	141 Å²	141	55 Å²	55	75%	0.754	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	0	178	-67.4	-44.7	0	0	0	112.6	D77 N81	D77-D79 PolarHBondContact O-N 2.92Å; D77-D79 VanDerWaalsContact O-N 3.12Å; D77-D79 WeakPolarHBondContact OD1-CA 3.46Å; D77-D79 WeakPolarHBondContact OD1-CB 3.4Å; D77-D79 PolarHBondContact OD1-N 3.17Å; D79-N81 VanDerWaalsContact C-N 3.32Å; D79-N81 WeakPolarHBondContact CB-ND2 3.5Å
80	G	65.1	Low	80.1	Confident	42 Å²	42	58.9 Å²	58.9	43%	0.433	32%	0.321	S	S	.	.	S	Bend	trans	76.4	14.3	-177.9	0	0	0	0	0	114.4	D77	D77-G80 PolarHBondContact O-N 2.94Å; D77-G80 PolarHBondContact OD1-N 3.2Å
81	N	67.1	Low	77.9	Confident	92 Å²	92	62.1 Å²	62.1	49%	0.492	36%	0.356	S	S	.	.			trans	-81.5	150.9	170.3	-47.6	-67.8	0	0	0	110.1	E76 D77 D79	E76-N81 CarbonylContact C-O 3.58Å; E76-N81 VanDerWaalsContact CA-O 3.3Å; E76-N81 WeakPolarHBondContact CA-O 3.32Å; D77-N81 PolarHBondContact N-O 3.24Å; D77-N81 WeakPolarHBondContact OD1-CA 3.18Å; D77-N81 WeakPolarHBondContact OD1-CB 3.15Å; D77-N81 PolarHBondContact OD1-N 3.48Å; D77-N81 PolarHBondContact OD1-ND2 3.39Å; D77-N81 WeakPolarHBondContact OD2-CB 3.39Å; D77-N81 PolarHBondContact OD2-ND2 2.79Å; D77-N81 VanDerWaalsContact OD2-ND2 3.16Å; D79-N81 VanDerWaalsContact C-N 3.32Å; D79-N81 WeakPolarHBondContact CB-ND2 3.5Å
82	L	71.2	Confident	75.3	Confident	59 Å²	59	69.2 Å²	69.2	31%	0.309	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	129.2	175.6	-76.1	175.2	0	0	0	112.1	F74 E75 E76 K191	F74-L82 HydrophobicContact CB-CD2 4.49Å; E75-L82 CarbonylContact O-C 3.56Å; E75-L82 WeakPolarHBondContact O-CA 3.33Å; E76-L82 HydrophobicContact CG-CD2 3.76Å; L82-K191 HydrophobicContact CD1-CB 3.65Å; L82-K191 HydrophobicContact CD1-CD 3.19Å; L82-K191 HydrophobicContact CD1-CG 3.41Å; L82-K191 VanDerWaalsContact CD1-CG 3.41Å; L82-K191 VanDerWaalsContact CD1-NZ 3.28Å; L82-K191 HydrophobicContact CG-CD 4.37Å
83	C	78.6	Confident	73.4	Confident	28 Å²	28	77.8 Å²	77.8	19%	0.189	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	152.6	170.5	-66.2	0	0	0	0	110.5	L18 F74 E75	L18-C83 HydrophobicContact CD1-CB 3.64Å; F74-C83 WeakPolarHBondContact CA-O 3.47Å; E75-C83 PolarHBondContact N-O 3.05Å; E75-C83 PolarHBondContact O-N 2.7Å
84	L	85.6	Confident	71.2	Confident	8 Å²	8	83.9 Å²	83.9	4%	0.042	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	122.2	173	-80.3	156.4	0	0	0	108	L19 L33 V72 S73 F74 L187	L19-L84 HydrophobicContact CB-CB 3.94Å; L19-L84 HydrophobicContact CD1-CB 4.16Å; L19-L84 HydrophobicContact CG-CB 4.37Å; L19-L84 PolarHBondContact N-O 3.5Å; L33-L84 HydrophobicContact CD1-CD1 3.54Å; L33-L84 HydrophobicContact CD2-CD1 4Å; L33-L84 HydrophobicContact CG-CD1 4.41Å; V72-L84 HydrophobicContact CG1-CB 4.25Å; V72-L84 HydrophobicContact CG1-CD2 3.57Å; S73-L84 WeakPolarHBondContact O-CA 3.36Å; F74-L84 HydrophobicContact CD1-CD2 3.91Å; F74-L84 HydrophobicContact CD1-CG 4.36Å; F74-L84 HydrophobicContact CD2-CD2 4.48Å; F74-L84 HydrophobicContact CE1-CD2 3.43Å; F74-L84 VanDerWaalsContact CE1-CD2 3.43Å; F74-L84 HydrophobicContact CE1-CG 4.03Å; F74-L84 HydrophobicContact CE2-CD2 4.03Å; F74-L84 HydrophobicContact CG-CD2 4.39Å; F74-L84 HydrophobicContact CZ-CD2 3.46Å; F74-L84 VanDerWaalsContact CZ-CD2 3.46Å; F74-L84 HydrophobicContact CZ-CG 4.49Å; L84-L187 HydrophobicContact CD1-CD1 4.48Å; L84-L187 HydrophobicContact CD1-CD2 3.21Å; L84-L187 HydrophobicContact CD1-CG 4.46Å; L84-L187 HydrophobicContact CG-CD2 4.27Å
85	I	89.1	Confident	69	Low	26 Å²	26	90.5 Å²	90.5	13%	0.133	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	126.9	-179.2	-48.4	-168.1	0	0	0	109.5	V17 V72 S73 E75 Y87	V17-I85 CarbonylContact O-C 3.54Å; V17-I85 WeakPolarHBondContact O-CA 3.49Å; V72-I85 CarbonylContact C-O 3.59Å; V72-I85 VanDerWaalsContact CA-O 3.28Å; V72-I85 WeakPolarHBondContact CA-O 3.42Å; S73-I85 PolarHBondContact N-O 3.21Å; S73-I85 PolarHBondContact O-N 3.33Å; E75-I85 HydrophobicContact CB-CD1 4.13Å; E75-I85 HydrophobicContact CB-CG1 4.41Å; E75-I85 VanDerWaalsContact CD-CD1 3.47Å; E75-I85 HydrophobicContact CG-CD1 4.08Å; E75-I85 HydrophobicContact CG-CG1 4.29Å; E75-I85 VanDerWaalsContact OE2-CD1 3.24Å; E75-I85 WeakPolarHBondContact OE2-CD1 3.35Å; I85-Y87 HydrophobicContact CB-CE2 3.79Å; I85-Y87 HydrophobicContact CG2-CD2 4.39Å; I85-Y87 HydrophobicContact CG2-CE1 4.3Å; I85-Y87 HydrophobicContact CG2-CE2 3.6Å; I85-Y87 WeakPolarHBondContact CG2-OH 3.25Å
86	A	91.4	Very high	67.1	Low	0 Å²	0	93.3 Å²	93.3	0%	0	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	130.5	177.4	0	0	0	0	0	111.4	G16 V17 L19 F35 V70 S71 V72	G16-A86 CarbonylContact C-O 3.46Å; G16-A86 VanDerWaalsContact CA-O 3.29Å; G16-A86 WeakPolarHBondContact CA-O 3.46Å; V17-A86 HydrophobicContact CB-CB 4.43Å; V17-A86 PolarHBondContact N-O 2.91Å; V17-A86 PolarHBondContact O-N 3.48Å; L19-A86 HydrophobicContact CD1-CB 4.13Å; L19-A86 HydrophobicContact CD2-CB 3.82Å; L19-A86 HydrophobicContact CG-CB 4.05Å; F35-A86 HydrophobicContact CD2-CB 3.89Å; F35-A86 HydrophobicContact CE2-CB 3.68Å; V70-A86 HydrophobicContact CB-CB 4.43Å; V70-A86 HydrophobicContact CG2-CB 4.15Å; S71-A86 CarbonylContact O-C 3.57Å; S71-A86 WeakPolarHBondContact O-CA 3.29Å; V72-A86 HydrophobicContact CG2-CB 4.08Å
87	Y	90	Very high	65.1	Low	66 Å²	66	94.4 Å²	94.4	26%	0.259	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	139.2	177.8	-63	-87.8	0	0	0	110.1	S71 S73 E75 I85 L89	S71-Y87 PolarHBondContact N-O 2.98Å; S71-Y87 PolarHBondContact O-N 3.29Å; S73-Y87 VanDerWaalsContact OG-CE2 3.31Å; S73-Y87 WeakPolarHBondContact OG-CE2 3.47Å; E75-Y87 PolarHBondContact OE1-OH 2.82Å; I85-Y87 HydrophobicContact CB-CE2 3.79Å; I85-Y87 HydrophobicContact CG2-CD2 4.39Å; I85-Y87 HydrophobicContact CG2-CE1 4.3Å; I85-Y87 HydrophobicContact CG2-CE2 3.6Å; I85-Y87 WeakPolarHBondContact CG2-OH 3.25Å; Y87-L89 PolarHBondContact O-N 3.32Å
88	P	83.5	Confident	63.8	Low	60 Å²	60	98.4 Å²	98.4	39%	0.39	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	139.3	168.7	-15.9	26.9	0	0	0	110.1	Y13 S90	Y13-P88 HydrophobicContact CD1-CG 4.06Å; Y13-P88 HydrophobicContact CG-CG 4.46Å; P88-S90 PolarHBondContact O-N 2.78Å
89	L	78.4	Confident	62.1	Low	85 Å²	85	94.2 Å²	94.2	45%	0.445	53%	0.527	S	S	.	.			trans	-74.2	108.8	168.9	-68.8	171.9	0	0	0	108	V69 Y87	V69-L89 HydrophobicContact CB-CD1 3.77Å; V69-L89 HydrophobicContact CG1-CD1 3.71Å; V69-L89 WeakPolarHBondContact O-CD1 3.47Å; Y87-L89 PolarHBondContact O-N 3.32Å
90	S	56	Low	60.5	Low	113 Å²	113	92.9 Å²	92.9	79%	0.79	52%	0.52	S	S	*	.			trans	-62.9	134.6	171.1	-51.1	0	0	0	0	109.3	P88 D92	P88-S90 PolarHBondContact O-N 2.78Å; S90-D92 PolarHBondContact O-N 2.86Å
91	G	47	Very low	59.5	Low	75 Å²	75	92.2 Å²	92.2	77%	0.773	51%	0.506	S	S	*	.	S	Bend	trans	-67	27.7	-161.8	0	0	0	0	0	119.1	H93	G91-H93 PolarHBondContact O-N 3.06Å
92	D	37.9	Very low	58.2	Low	161 Å²	161	90.1 Å²	90.1	86%	0.861	50%	0.499	S	S	*	.			trans	-89.5	86.1	170.2	-74.9	-22.9	0	0	0	109.8	S90 D94	S90-D92 PolarHBondContact O-N 2.86Å; D92-D94 PolarHBondContact O-N 3.38Å; D92-D94 VanDerWaalsContact O-N 3.1Å
93	H	51.5	Low	56.7	Low	180 Å²	180	92.3 Å²	92.3	83%	0.833	51%	0.511	S	S	*	.			trans	-65.9	96.7	158.2	-97	-91.1	0	0	0	108.7	G91	G91-H93 PolarHBondContact O-N 3.06Å
94	D	39.5	Very low	54.8	Low	136 Å²	136	93.5 Å²	93.5	73%	0.727	52%	0.519	S	S	*	.	S	Bend	trans	167.8	130.7	135.6	-90.2	-21.4	0	0	0	109	D92	D92-D94 PolarHBondContact O-N 3.38Å; D92-D94 VanDerWaalsContact O-N 3.1Å
95	N	35.8	Very low	52.3	Low	153 Å²	153	96.8 Å²	96.8	82%	0.818	53%	0.534	S	S	*	.			trans	91.6	41	170.5	-45.5	-56.1	0	0	0	119.1
96	L	41.2	Very low	49.5	Very low	133 Å²	133	100.3 Å²	100.3	70%	0.696	56%	0.559	S	S	*	*	S	Bend	trans	-114	106.7	141.1	-119.3	86.8	0	0	0	107.8	N98	L96-N98 PolarHBondContact O-N 2.98Å
97	E	37.1	Very low	46.5	Very low	163 Å²	163	105.7 Å²	105.7	76%	0.762	58%	0.582	S	S	*	*			trans	-40.6	134	-175.7	-65.3	-179.3	157.1	0	0	112.4	L99	E97-L99 PolarHBondContact O-N 3.16Å
98	N	45.6	Very low	43.7	Very low	142 Å²	142	106.6 Å²	106.6	76%	0.759	60%	0.598	S	S	*	*			trans	-62.5	77.7	169.4	-74.3	-42.3	0	0	0	109.5	L96	L96-N98 PolarHBondContact O-N 2.98Å
99	L	40.7	Very low	41	Very low	116 Å²	116	111.2 Å²	111.2	61%	0.607	61%	0.612	S	S	*	*			trans	-100.5	97.3	176.7	-132.8	76.7	0	0	0	109.7	E97 N101 R197	E97-L99 PolarHBondContact O-N 3.16Å; L99-N101 PolarHBondContact O-N 3.01Å; L99-R197 PolarHBondContact O-NH1 3.41Å; L99-R197 VanDerWaalsContact O-NH1 3.13Å
100	D	38.6	Very low	38.6	Very low	113 Å²	113	115.3 Å²	115.3	60%	0.604	63%	0.633	S	S	*	*			trans	-24.1	117.7	174.9	-167.7	15.1	0	0	0	114.5	S102	D100-S102 VanDerWaalsContact CG-OG 3.27Å; D100-S102 PolarHBondContact O-N 2.94Å; D100-S102 WeakPolarHBondContact OD1-CB 3.26Å; D100-S102 PolarHBondContact OD1-N 3.47Å; D100-S102 WeakPolarHBondContact OD2-CB 3.49Å; D100-S102 PolarHBondContact OD2-OG 2.98Å
101	N	43.6	Very low	37	Very low	27 Å²	27	117.2 Å²	117.2	14%	0.144	63%	0.634	C	S	.	*			trans	-79	17.2	173.7	-93	-11.9	0	0	0	112.4	L44 L99 D103 C104	L44-N101 WeakPolarHBondContact O-CB 3.3Å; L44-N101 PolarHBondContact O-ND2 2.99Å; L99-N101 PolarHBondContact O-N 3.01Å; N101-D103 PolarHBondContact O-N 3.12Å; N101-C104 PolarHBondContact O-N 2.74Å
102	S	40	Very low	35.9	Very low	48 Å²	48	124 Å²	124	34%	0.336	64%	0.636	S	S	.	*	G	3₁₀ helix	trans	-57.9	-11.2	-179.6	62.5	0	0	0	0	114.9	D100 C104 E105	D100-S102 VanDerWaalsContact CG-OG 3.27Å; D100-S102 PolarHBondContact O-N 2.94Å; D100-S102 WeakPolarHBondContact OD1-CB 3.26Å; D100-S102 PolarHBondContact OD1-N 3.47Å; D100-S102 WeakPolarHBondContact OD2-CB 3.49Å; D100-S102 PolarHBondContact OD2-OG 2.98Å; S102-C104 PolarHBondContact O-N 2.77Å; S102-E105 PolarHBondContact O-N 3.48Å
103	D	39.6	Very low	35	Very low	105 Å²	105	127 Å²	127	56%	0.561	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-72.7	-1	171.6	-81.8	-22.7	0	0	0	114.8	N101 E105 K107	N101-D103 PolarHBondContact O-N 3.12Å; D103-E105 VanDerWaalsContact C-N 3.35Å; D103-K107 WeakPolarHBondContact OD1-CE 3.43Å; D103-K107 IonicContact OD1-NZ 2.77Å; D103-K107 PolarHBondContact OD1-NZ 3.26Å
104	C	38.9	Very low	33.7	Very low	53 Å²	53	123.9 Å²	123.9	36%	0.358	63%	0.629	S	S	.	*	G	3₁₀ helix	trans	-82.1	-10.6	168.2	-67.1	0	0	0	0	113.6	N101 S102	N101-C104 PolarHBondContact O-N 2.74Å; S102-C104 PolarHBondContact O-N 2.77Å
105	E	34	Very low	33	Very low	78 Å²	78	124.2 Å²	124.2	36%	0.364	63%	0.631	S	S	.	*	S	Bend	trans	-85.1	146.3	170.3	-71.2	-149.1	145.6	0	0	111.6	S102 D103 K107 K235 H384	S102-E105 PolarHBondContact O-N 3.48Å; D103-E105 VanDerWaalsContact C-N 3.35Å; E105-K107 PolarHBondContact O-N 2.9Å; E105-K235 IonicContact OE1-NZ 3.25Å; E105-K235 PolarHBondContact OE1-NZ 2.75Å; E105-K235 IonicContact OE2-NZ 2.6Å; E105-K235 PolarHBondContact OE2-NZ 2.82Å; E105-H384 IonicContact OE1-CE1 2.74Å; E105-H384 PolarHBondContact OE1-CE1 3.45Å; E105-H384 IonicContact OE1-NE2 3.19Å; E105-H384 PolarHBondContact OE1-NE2 3.24Å
106	P	29.6	Very low	32.6	Very low	99 Å²	99	126.5 Å²	126.5	64%	0.643	63%	0.634	S	S	*	*			trans	-67.1	91.7	-176	28.2	-33.3	0	0	0	110.7	S108	P106-S108 PolarHBondContact O-N 3.06Å
107	K	29.1	Very low	31.9	Very low	114 Å²	114	130.2 Å²	130.2	50%	0.496	64%	0.644	S	S	.	*			trans	-72.6	103.9	159.2	-70	176.9	-175.2	165.3	0	106.3	D103 E105 K109	D103-K107 WeakPolarHBondContact OD1-CE 3.43Å; D103-K107 IonicContact OD1-NZ 2.77Å; D103-K107 PolarHBondContact OD1-NZ 3.26Å; E105-K107 PolarHBondContact O-N 2.9Å; K107-K109 HydrophobicContact CB-CG 4.43Å; K107-K109 PolarHBondContact O-N 3.21Å
108	S	30.7	Very low	31.1	Very low	84 Å²	84	127.2 Å²	127.2	59%	0.587	64%	0.637	S	S	*	*			trans	-66.4	57.3	170.9	48.8	0	0	0	0	110.8	P106 L110	P106-S108 PolarHBondContact O-N 3.06Å; S108-L110 PolarHBondContact O-N 2.81Å
109	K	26.1	Very low	30	Very low	157 Å²	157	127.8 Å²	127.8	68%	0.683	64%	0.637	S	S	*	*			trans	-95.5	95.2	173.9	-70.3	-171.6	179.2	179.8	0	108.5	K107 L111	K107-K109 HydrophobicContact CB-CG 4.43Å; K107-K109 PolarHBondContact O-N 3.21Å; K109-L111 HydrophobicContact CB-CD1 3.96Å; K109-L111 PolarHBondContact O-N 3.08Å
110	L	27.4	Very low	29.1	Very low	171 Å²	171	128.6 Å²	128.6	90%	0.895	64%	0.642	S	S	*	*			trans	-63.7	82.5	168.1	-168.4	80.1	0	0	0	109.2	S108 R112	S108-L110 PolarHBondContact O-N 2.81Å; L110-R112 PolarHBondContact O-N 2.83Å
111	L	23.2	Very low	28.4	Very low	154 Å²	154	129.5 Å²	129.5	81%	0.806	65%	0.646	S	S	*	*			trans	-82.1	104.1	168	-93.3	94.3	0	0	0	109.7	K109 W113	K109-L111 HydrophobicContact CB-CD1 3.96Å; K109-L111 PolarHBondContact O-N 3.08Å; L111-W113 PolarHBondContact O-N 3.38Å
112	R	23.3	Very low	27.5	Very low	217 Å²	217	136 Å²	136	82%	0.819	68%	0.675	S	S	*	*			trans	-59.2	109.9	171.1	174.9	176.9	53.8	-146.3	-8	110.7	L110 T114	L110-R112 PolarHBondContact O-N 2.83Å; R112-T114 HydrophobicContact CG-CG2 4.32Å
113	W	20.4	Very low	26.8	Very low	224 Å²	224	140 Å²	140	85%	0.848	69%	0.693	S	S	*	*			trans	-84.4	108.8	168.1	-156.7	-49	0	0	0	109	L111 N115	L111-W113 PolarHBondContact O-N 3.38Å; W113-N115 PolarHBondContact NE1-OD1 2.75Å
114	T	22.5	Very low	26.5	Very low	114 Å²	114	141.7 Å²	141.7	70%	0.699	70%	0.702	S	S	*	*			trans	-97.7	115.8	166.1	37.5	0	0	0	0	109	R112	R112-T114 HydrophobicContact CG-CG2 4.32Å
115	N	26.1	Very low	25.9	Very low	143 Å²	143	148.3 Å²	148.3	77%	0.765	73%	0.725	S	S	*	*			trans	-74.9	131.5	170.6	-88.3	-20	0	0	0	110.3	W113	W113-N115 PolarHBondContact NE1-OD1 2.75Å
116	K	26.8	Very low	26.3	Very low	202 Å²	202	152.9 Å²	152.9	88%	0.878	75%	0.75	S	S	*	*			trans	-62.9	132.3	171.5	-83.6	173.8	171.3	172.4	0	110.6
117	K	26.3	Very low	26.4	Very low	210 Å²	210	152.8 Å²	152.8	91%	0.913	75%	0.749	S	S	*	*			trans	-137.6	135.4	145.1	-141.3	177	-174.2	178.5	0	109.1
118	T	21.2	Very low	26.6	Very low	100 Å²	100	157.5 Å²	157.5	61%	0.613	77%	0.77	S	S	*	*			trans	-99.9	155	-164.7	-38.8	0	0	0	0	111.4
119	M	21.2	Very low	26.5	Very low	154 Å²	154	160.9 Å²	160.9	76%	0.759	78%	0.776	S	S	*	*			trans	82.6	137.3	161.8	-53.3	-78.3	121.6	0	0	115.8
120	L	22.6	Very low	26.5	Very low	134 Å²	134	164 Å²	164	70%	0.702	78%	0.783	S	S	*	*			cis	-167.3	151.6	-2.3	-115.1	162.7	0	0	0	107.8
121	L	23.9	Very low	26.7	Very low	132 Å²	132	161.9 Å²	161.9	69%	0.691	78%	0.778	S	S	*	*			trans	67.7	114.9	152.3	-82.2	150.2	0	0	0	123.1
122	E	23.8	Very low	27.1	Very low	162 Å²	162	164.9 Å²	164.9	76%	0.757	78%	0.778	S	S	*	*				90.8	117.5	128.8	-101.7	171.9	-168	0	0	123.3
123	N	25.5	Very low	27.4	Very low	133 Å²	133	161.2 Å²	161.2	71%	0.711	77%	0.771	S	S	*	*			trans	68.6	114.3	145.3	-75.1	-8	0	0	0	122.2
124	D	33.7	Very low	27.8	Very low	140 Å²	140	155.9 Å²	155.9	75%	0.749	76%	0.755	S	S	*	*			trans	40.8	100	132.9	-75.4	-16.3	0	0	0	118.1
125	K	27.4	Very low	28.2	Very low	193 Å²	193	160 Å²	160	84%	0.839	76%	0.757	S	S	*	*				172.7	139	110.5	-89.5	156.1	-171.3	179.3	0	109.1	P127	K125-P127 VanDerWaalsContact O-CD 3.29Å; K125-P127 WeakPolarHBondContact O-CD 3.43Å
126	I	41.3	Very low	28.3	Very low	174 Å²	174	161.1 Å²	161.1	89%	0.892	76%	0.756	S	S	*	*			trans	-70.4	130.9	170.7	-61.6	163.1	0	0	0	108.8
127	P	32.4	Very low	28.7	Very low	96 Å²	96	156.8 Å²	156.8	62%	0.623	74%	0.738	S	S	*	*			trans	-145.7	129.2	142.3	28.1	-6.2	0	0	0	115.4	K125 E129	K125-P127 VanDerWaalsContact O-CD 3.29Å; K125-P127 WeakPolarHBondContact O-CD 3.43Å; P127-E129 VanDerWaalsContact C-N 3.35Å; P127-E129 PolarHBondContact O-N 3.23Å
128	K	33.8	Very low	29	Very low	214 Å²	214	153.2 Å²	153.2	93%	0.93	73%	0.725	S	S	*	*	S	Bend	trans	40.4	31.3	133.4	-66.6	-176.8	176.3	177	0	121.2
129	E	27	Very low	29.6	Very low	155 Å²	155	155.4 Å²	155.4	72%	0.724	73%	0.726	S	S	*	*			trans	-110	-5.9	169.5	-82.5	-165.2	143.4	0	0	115.6	P127 V131 R132	P127-E129 VanDerWaalsContact C-N 3.35Å; P127-E129 PolarHBondContact O-N 3.23Å; E129-V131 PolarHBondContact O-N 3.1Å; E129-R132 PolarHBondContact O-N 3.08Å
130	W	26.4	Very low	29.9	Very low	221 Å²	221	155.3 Å²	155.3	84%	0.837	73%	0.726	S	S	*	*	H	α-helix	trans	-65.9	-6.4	-176.7	-105.2	59.8	0	0	0	116.2
131	V	31.9	Very low	30.6	Very low	128 Å²	128	155.4 Å²	155.4	78%	0.776	72%	0.72	S	S	*	*	H	α-helix	trans	-96.3	-17.2	-177.9	-176.8	0	0	0	0	112.8	E129	E129-V131 PolarHBondContact O-N 3.1Å
132	R	31.2	Very low	31	Very low	217 Å²	217	151.7 Å²	151.7	82%	0.819	71%	0.705	S	S	*	*	H	α-helix	trans	-92.7	-21.9	-178.6	-81.7	-178.9	174.8	175	-1.3	114.5	E129	E129-R132 PolarHBondContact O-N 3.08Å
133	Q	29.4	Very low	31.3	Very low	140 Å²	140	149 Å²	149	65%	0.654	69%	0.692	S	S	*	*	H	α-helix	trans	-84.2	-36	-177.7	-148	162.2	-10.1	0	0	112.3	R135 K136 E137	Q133-R135 VanDerWaalsContact C-N 3.27Å; Q133-R135 PolarHBondContact O-N 3.16Å; Q133-K136 PolarHBondContact O-N 2.91Å; Q133-E137 PolarHBondContact O-N 3.29Å
134	H	28.5	Very low	31.8	Very low	111 Å²	111	150.1 Å²	150.1	51%	0.514	69%	0.691	S	S	.	*	H	α-helix	trans	-61.4	-32.5	174.6	-112	-82.1	0	0	0	113.3	E138	H134-E138 PolarHBondContact O-N 3.41Å
135	R	31.4	Very low	31.8	Very low	201 Å²	201	148.1 Å²	148.1	76%	0.758	68%	0.68	S	S	*	*	H	α-helix	trans	-76.7	-23.7	179.9	-147.3	-178.1	-127.1	-138.5	1.9	113.5	Q133 K139	Q133-R135 VanDerWaalsContact C-N 3.27Å; Q133-R135 PolarHBondContact O-N 3.16Å; R135-K139 WeakPolarHBondContact O-CB 3.41Å; R135-K139 PolarHBondContact O-N 3.33Å
136	K	29.7	Very low	32	Very low	167 Å²	167	143.6 Å²	143.6	73%	0.726	66%	0.661	S	S	*	*	H	α-helix	trans	-83.3	-38.1	175.7	-89	-174.6	174.7	-178	0	111.8	Q133 K139 M140	Q133-K136 PolarHBondContact O-N 2.91Å; K136-K139 PolarHBondContact O-N 3.01Å; K136-M140 WeakPolarHBondContact O-CB 3.28Å; K136-M140 PolarHBondContact O-N 3.45Å
137	E	33.5	Very low	31.8	Very low	110 Å²	110	141.4 Å²	141.4	51%	0.514	65%	0.647	S	S	.	*	H	α-helix	trans	-69	-36.5	174.8	-76.4	-173.1	174.4	0	0	112.8	Q133 M140 K141	Q133-E137 PolarHBondContact O-N 3.29Å; E137-M140 PolarHBondContact O-N 2.8Å; E137-K141 VanDerWaalsContact O-CB 3.32Å; E137-K141 WeakPolarHBondContact O-CB 3.46Å; E137-K141 WeakPolarHBondContact O-CG 3.31Å; E137-K141 PolarHBondContact O-N 2.93Å
138	E	33.1	Very low	32.3	Very low	135 Å²	135	141.7 Å²	141.7	63%	0.631	64%	0.64	S	S	*	*	H	α-helix	trans	-67.2	-39.7	171.5	-76.7	-163.1	151.5	0	0	112.3	H134 K141 S142	H134-E138 PolarHBondContact O-N 3.41Å; E138-K141 PolarHBondContact O-N 3.06Å; E138-S142 WeakPolarHBondContact O-CB 3.39Å; E138-S142 PolarHBondContact O-N 2.82Å
139	K	33.1	Very low	32.3	Very low	147 Å²	147	137.1 Å²	137.1	64%	0.639	62%	0.621	S	S	*	*	H	α-helix	trans	-66.2	-36.1	174.6	-95.5	-172	168.9	-169.7	0	113.1	R135 K136 H143	R135-K139 WeakPolarHBondContact O-CB 3.41Å; R135-K139 PolarHBondContact O-N 3.33Å; K136-K139 PolarHBondContact O-N 3.01Å; K139-H143 WeakPolarHBondContact O-CB 3.18Å; K139-H143 PolarHBondContact O-CD2 2.9Å; K139-H143 PolarHBondContact O-N 2.93Å
140	M	29.4	Very low	32.5	Very low	152 Å²	152	135.8 Å²	135.8	75%	0.749	62%	0.615	S	S	*	*	H	α-helix	trans	-78.8	-30.2	179.7	-148.6	152	100.6	0	0	112.1	K136 E137 K144	K136-M140 WeakPolarHBondContact O-CB 3.28Å; K136-M140 PolarHBondContact O-N 3.45Å; E137-M140 PolarHBondContact O-N 2.8Å; M140-K144 WeakPolarHBondContact O-CB 3.48Å; M140-K144 PolarHBondContact O-N 3.17Å; M140-K144 VanDerWaalsContact O-N 3.08Å
141	K	35.9	Very low	33	Very low	136 Å²	136	134.5 Å²	134.5	59%	0.591	61%	0.61	S	S	*	*	H	α-helix	trans	-71.7	-38.9	167.8	-77.2	174.8	179.1	170	0	112.2	E137 E138 L145	E137-K141 VanDerWaalsContact O-CB 3.32Å; E137-K141 WeakPolarHBondContact O-CB 3.46Å; E137-K141 WeakPolarHBondContact O-CG 3.31Å; E137-K141 PolarHBondContact O-N 2.93Å; E138-K141 PolarHBondContact O-N 3.06Å; K141-L145 WeakPolarHBondContact O-CB 3.33Å; K141-L145 PolarHBondContact O-N 2.94Å
142	S	33.4	Very low	33.2	Very low	53 Å²	53	132.6 Å²	132.6	37%	0.371	60%	0.595	S	S	.	*	H	α-helix	trans	-62.1	-50.7	172.9	-172.2	0	0	0	0	110.2	E138 K144 L145 E146	E138-S142 WeakPolarHBondContact O-CB 3.39Å; E138-S142 PolarHBondContact O-N 2.82Å; S142-K144 PolarHBondContact O-N 3.17Å; S142-L145 CarbonylContact O-C 3.31Å; S142-L145 PolarHBondContact O-N 2.72Å; S142-E146 VanDerWaalsContact C-OE2 3.27Å; S142-E146 VanDerWaalsContact O-CB 3.23Å; S142-E146 WeakPolarHBondContact O-CB 3.48Å; S142-E146 VanDerWaalsContact O-CG 3.29Å; S142-E146 WeakPolarHBondContact O-CG 3.35Å; S142-E146 PolarHBondContact O-N 3.18Å; S142-E146 PolarHBondContact OG-OE2 3.17Å
143	H	29.6	Very low	33.4	Very low	106 Å²	106	130 Å²	130	49%	0.491	59%	0.589	S	S	.	*	H	α-helix	trans	-62.7	-37.4	178.6	-96.6	-88.5	0	0	0	113.3	K139 E146 E147	K139-H143 WeakPolarHBondContact O-CB 3.18Å; K139-H143 PolarHBondContact O-CD2 2.9Å; K139-H143 PolarHBondContact O-N 2.93Å; H143-E146 PolarHBondContact O-N 2.87Å; H143-E147 WeakPolarHBondContact O-CB 3.4Å; H143-E147 WeakPolarHBondContact O-CG 3.32Å; H143-E147 PolarHBondContact O-N 3.47Å
144	K	35.8	Very low	33.6	Very low	156 Å²	156	131.3 Å²	131.3	68%	0.678	59%	0.593	S	S	*	*	H	α-helix	trans	-71.9	-32.8	178	-159	175	-173.3	-179.7	0	112.7	M140 S142 E148	M140-K144 WeakPolarHBondContact O-CB 3.48Å; M140-K144 PolarHBondContact O-N 3.17Å; M140-K144 VanDerWaalsContact O-N 3.08Å; S142-K144 PolarHBondContact O-N 3.17Å; K144-E148 PolarHBondContact O-N 3.07Å
145	L	34.6	Very low	33.9	Very low	98 Å²	98	129.6 Å²	129.6	51%	0.513	59%	0.594	S	S	.	*	H	α-helix	trans	-74.3	-36.9	169.8	-90.9	155.3	0	0	0	111.7	K141 S142 E148 F149	K141-L145 WeakPolarHBondContact O-CB 3.33Å; K141-L145 PolarHBondContact O-N 2.94Å; S142-L145 CarbonylContact O-C 3.31Å; S142-L145 PolarHBondContact O-N 2.72Å; L145-E148 PolarHBondContact O-N 3.16Å; L145-F149 WeakPolarHBondContact O-CB 3.49Å; L145-F149 VanDerWaalsContact O-CD2 3.28Å; L145-F149 WeakPolarHBondContact O-CD2 3.38Å; L145-F149 PolarHBondContact O-N 3.43Å
146	E	31.7	Very low	34.8	Very low	98 Å²	98	127.9 Å²	127.9	46%	0.458	59%	0.594	S	S	.	*	H	α-helix	trans	-69	-39.3	177.7	-80.3	169	134.8	0	0	111.4	S142 H143 F149 E150	S142-E146 VanDerWaalsContact C-OE2 3.27Å; S142-E146 VanDerWaalsContact O-CB 3.23Å; S142-E146 WeakPolarHBondContact O-CB 3.48Å; S142-E146 VanDerWaalsContact O-CG 3.29Å; S142-E146 WeakPolarHBondContact O-CG 3.35Å; S142-E146 PolarHBondContact O-N 3.18Å; S142-E146 PolarHBondContact OG-OE2 3.17Å; H143-E146 PolarHBondContact O-N 2.87Å; E146-F149 CarbonylContact O-C 3.31Å; E146-F149 PolarHBondContact O-N 3.33Å; E146-E150 WeakPolarHBondContact O-CB 3.32Å; E146-E150 WeakPolarHBondContact O-CG 3.44Å; E146-E150 PolarHBondContact O-N 2.88Å
147	E	36.2	Very low	35.8	Very low	128 Å²	128	121.5 Å²	121.5	60%	0.598	57%	0.569	S	S	*	*	H	α-helix	trans	-66.4	-39.3	171.6	-78.8	176.6	173.3	0	0	112	H143 F149 E150 W151	H143-E147 WeakPolarHBondContact O-CB 3.4Å; H143-E147 WeakPolarHBondContact O-CG 3.32Å; H143-E147 PolarHBondContact O-N 3.47Å; E147-F149 VanDerWaalsContact C-N 3.28Å; E147-F149 PolarHBondContact O-N 3.01Å; E147-E150 PolarHBondContact O-N 3.2Å; E147-W151 PolarHBondContact O-N 2.89Å
148	E	42.8	Very low	36.7	Very low	102 Å²	102	119.2 Å²	119.2	48%	0.477	56%	0.56	S	S	.	*	H	α-helix	trans	-64	-32.1	170.1	-90.9	-160.8	129	0	0	112.2	K144 L145 L152 K181	K144-E148 PolarHBondContact O-N 3.07Å; L145-E148 PolarHBondContact O-N 3.16Å; E148-L152 WeakPolarHBondContact O-CB 3.38Å; E148-K181 IonicContact OE1-NZ 3.56Å; E148-K181 PolarHBondContact OE1-NZ 2.64Å
149	F	33.6	Very low	37.4	Very low	118 Å²	118	118.1 Å²	118.1	52%	0.518	55%	0.551	S	S	.	*	H	α-helix	trans	-82.1	-28.4	177.9	-99.7	-99.5	0	0	0	113.7	L145 E146 E147 L152 K153	L145-F149 WeakPolarHBondContact O-CB 3.49Å; L145-F149 VanDerWaalsContact O-CD2 3.28Å; L145-F149 WeakPolarHBondContact O-CD2 3.38Å; L145-F149 PolarHBondContact O-N 3.43Å; E146-F149 CarbonylContact O-C 3.31Å; E146-F149 PolarHBondContact O-N 3.33Å; E147-F149 VanDerWaalsContact C-N 3.28Å; E147-F149 PolarHBondContact O-N 3.01Å; F149-L152 WeakPolarHBondContact O-CB 3.38Å; F149-L152 PolarHBondContact O-N 2.65Å; F149-K153 WeakPolarHBondContact O-CG 3.41Å; F149-K153 PolarHBondContact O-N 3.5Å; F149-K153 VanDerWaalsContact O-N 3.11Å
150	E	31.2	Very low	38.3	Very low	128 Å²	128	114 Å²	114	60%	0.598	53%	0.532	S	S	*	.	H	α-helix	trans	-74.3	-36.8	-179.8	-88.1	-172.6	161.3	0	0	112.5	E146 E147 L152 K153	E146-E150 WeakPolarHBondContact O-CB 3.32Å; E146-E150 WeakPolarHBondContact O-CG 3.44Å; E146-E150 PolarHBondContact O-N 2.88Å; E147-E150 PolarHBondContact O-N 3.2Å; E150-L152 VanDerWaalsContact C-N 3.31Å; E150-K153 PolarHBondContact O-N 3.34Å
151	W	37.2	Very low	39.2	Very low	193 Å²	193	110.3 Å²	110.3	73%	0.731	52%	0.518	S	S	*	.	H	α-helix	trans	-68.7	-33.3	170.4	-168.5	81.8	0	0	0	111.6	E147 K153 K154	E147-W151 PolarHBondContact O-N 2.89Å; W151-K153 VanDerWaalsContact C-N 3.27Å; W151-K153 PolarHBondContact O-N 2.99Å; W151-K154 PolarHBondContact O-N 3.43Å
152	L	36	Very low	39.7	Very low	88 Å²	88	106.8 Å²	106.8	46%	0.461	51%	0.508	S	S	.	.	H	α-helix	trans	-71.3	-18.8	177.4	-151.5	75.9	0	0	0	113.7	E148 F149 E150	E148-L152 WeakPolarHBondContact O-CB 3.38Å; F149-L152 WeakPolarHBondContact O-CB 3.38Å; F149-L152 PolarHBondContact O-N 2.65Å; E150-L152 VanDerWaalsContact C-N 3.31Å
153	K	35.9	Very low	40.2	Very low	162 Å²	162	110.9 Å²	110.9	70%	0.704	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-8.7	175.1	-84.4	178.6	177.5	178.1	0	113.6	F149 E150 W151	F149-K153 WeakPolarHBondContact O-CG 3.41Å; F149-K153 PolarHBondContact O-N 3.5Å; F149-K153 VanDerWaalsContact O-N 3.11Å; E150-K153 PolarHBondContact O-N 3.34Å; W151-K153 VanDerWaalsContact C-N 3.27Å; W151-K153 PolarHBondContact O-N 2.99Å
154	K	32.8	Very low	40.6	Very low	169 Å²	169	115.7 Å²	115.7	74%	0.735	54%	0.54	S	S	*	.	S	Bend	trans	-90.4	-1.4	-166.4	-89.9	-179.5	176.4	176.1	0	116.8	W151	W151-K154 PolarHBondContact O-N 3.43Å
155	S	36.1	Very low	40.9	Very low	75 Å²	75	118.9 Å²	118.9	52%	0.524	55%	0.554	S	S	.	*			trans	-161.8	120	160.5	-81.1	0	0	0	0	110.3	V157	S155-V157 PolarHBondContact O-N 3.25Å
156	E	49	Very low	40.7	Very low	165 Å²	165	117 Å²	117	77%	0.771	56%	0.559	S	S	*	*	S	Bend	trans	-73	-15.5	-172.4	-65.2	-178.4	145.8	0	0	113.3
157	V	50.3	Low	40.5	Very low	33 Å²	33	119.6 Å²	119.6	20%	0.2	58%	0.576	C	S	.	*	S	Bend	trans	-143	128.7	172.2	176.5	0	0	0	0	107.2	S155 Y159 M269	S155-V157 PolarHBondContact O-N 3.25Å; V157-Y159 HydrophobicContact CB-CE2 4.06Å; V157-Y159 HydrophobicContact CG1-CD2 4.26Å; V157-Y159 HydrophobicContact CG1-CE2 3.69Å; V157-M269 HydrophobicContact CG1-CB 4.46Å; V157-M269 HydrophobicContact CG1-CE 3.92Å; V157-M269 HydrophobicContact CG1-CG 3.15Å; V157-M269 HydrophobicContact CG1-SD 3.91Å
158	L	52.5	Low	40.5	Very low	62 Å²	62	119.9 Å²	119.9	33%	0.325	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.5	133.2	179	-64.4	170.2	0	0	0	109.9	Y160 M269 F270	L158-Y160 HydrophobicContact CB-CE2 3.69Å; L158-M269 WeakPolarHBondContact O-CA 3.48Å; L158-F270 PolarHBondContact O-N 3.12Å
159	Y	48.5	Very low	39.7	Very low	112 Å²	112	120.7 Å²	120.7	44%	0.439	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.9	134.4	178.2	-65.4	-95.1	0	0	0	110.6	V157 Q262 L268 M269	V157-Y159 HydrophobicContact CB-CE2 4.06Å; V157-Y159 HydrophobicContact CG1-CD2 4.26Å; V157-Y159 HydrophobicContact CG1-CE2 3.69Å; Y159-Q262 HydrophobicContact CE1-CG 4.35Å; Y159-L268 CarbonylContact C-O 3.55Å; Y159-L268 VanDerWaalsContact CA-O 3.31Å; Y159-L268 WeakPolarHBondContact CA-O 3.42Å; Y159-M269 HydrophobicContact CD1-CB 4.45Å; Y159-M269 HydrophobicContact CE1-CB 4.35Å; Y159-M269 HydrophobicContact CE1-CE 3.89Å; Y159-M269 HydrophobicContact CE1-CG 4.2Å; Y159-M269 WeakPolarHBondContact OH-CE 3.48Å
160	Y	52.3	Low	39.6	Very low	61 Å²	61	117.1 Å²	117.1	24%	0.239	59%	0.593	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-132.4	127.3	-179.3	-67.3	-87.1	0	0	0	112.8	L158 P177 Q267 L268 F270	L158-Y160 HydrophobicContact CB-CE2 3.69Å; Y160-P177 HydrophobicContact CE1-CG 4.39Å; Y160-P177 HydrophobicContact CE2-CG 4.22Å; Y160-P177 WeakPolarHBondContact OH-CG 3.29Å; Y160-Q267 CarbonylContact O-C 3.33Å; Y160-Q267 WeakPolarHBondContact O-CA 3.35Å; Y160-Q267 VanDerWaalsContact O-CB 3.28Å; Y160-Q267 WeakPolarHBondContact O-CB 3.43Å; Y160-L268 PolarHBondContact N-O 3.39Å; Y160-L268 PolarHBondContact O-N 2.86Å; Y160-F270 AromaticContact CD2-CD2 3.52Å; Y160-F270 HydrophobicContact CD2-CD2 3.52Å; Y160-F270 AromaticContact CD2-CE2 3.41Å; Y160-F270 HydrophobicContact CD2-CE2 3.41Å; Y160-F270 VanDerWaalsContact CD2-CE2 3.41Å; Y160-F270 AromaticContact CE2-CD2 3.73Å; Y160-F270 HydrophobicContact CE2-CD2 3.73Å; Y160-F270 AromaticContact CE2-CE2 3.93Å; Y160-F270 HydrophobicContact CE2-CE2 3.93Å; Y160-F270 HydrophobicContact CG-CE2 4.32Å
161	T	46.9	Very low	39.8	Very low	73 Å²	73	117.6 Å²	117.6	45%	0.448	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73	131.5	179.7	-47.6	0	0	0	0	113.2	H174 Q267	T161-H174 PolarHBondContact O-ND1 2.88Å; T161-Q267 PolarHBondContact OG1-NE2 3.15Å; T161-Q267 VanDerWaalsContact OG1-NE2 3.08Å
162	V	48.4	Very low	39.7	Very low	63 Å²	63	116.8 Å²	116.8	38%	0.382	60%	0.597	S	S	.	*			trans	-86.4	103.2	168.9	-177.1	0	0	0	0	107.7	Y261 G266 L268	V162-Y261 HydrophobicContact CB-CE2 4.38Å; V162-Y261 HydrophobicContact CG2-CD2 4.24Å; V162-Y261 HydrophobicContact CG2-CE2 3.84Å; V162-G266 VanDerWaalsContact CB-O 3.31Å; V162-G266 WeakPolarHBondContact CB-O 3.21Å; V162-G266 WeakPolarHBondContact CG2-O 3.35Å; V162-G266 PolarHBondContact N-O 2.95Å; V162-L268 HydrophobicContact CG2-CG 4.31Å
163	E	42.7	Very low	39.8	Very low	138 Å²	138	120.8 Å²	120.8	65%	0.645	61%	0.611	S	S	*	*			trans	-76.3	142.2	177.4	-71	-173.3	170.4	0	0	111.4	K165	E163-K165 PolarHBondContact O-N 3.17Å
164	K	37.5	Very low	40.5	Very low	208 Å²	208	116.4 Å²	116.4	90%	0.904	59%	0.592	S	S	*	*			trans	-71.7	123	172.1	-78.2	179.5	176	177.5	0	109.1	G166	K164-G166 PolarHBondContact O-N 3.09Å
165	K	42.4	Very low	41.8	Very low	222 Å²	222	110.5 Å²	110.5	97%	0.965	57%	0.567	S	S	*	*	S	Bend	trans	-8.7	107.2	174.3	-77.4	-176.3	173.9	179.6	0	114.9	E163	E163-K165 PolarHBondContact O-N 3.17Å
166	G	31.4	Very low	42.9	Very low	60 Å²	60	107.5 Å²	107.5	62%	0.619	55%	0.546	S	S	*	.			trans	-158.7	112.5	166.8	0	0	0	0	0	111.9	K164	K164-G166 PolarHBondContact O-N 3.09Å
167	N	26.9	Very low	43.4	Very low	151 Å²	151	101.8 Å²	101.8	81%	0.807	52%	0.523	S	S	*	.			trans	61.2	131.6	171.1	-81	-10.5	0	0	0	120.8	S169 S170	N167-S169 PolarHBondContact O-N 3.02Å; N167-S170 PolarHBondContact O-OG 2.99Å
168	V	35.4	Very low	43.7	Very low	135 Å²	135	102.2 Å²	102.2	82%	0.818	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	13.9	-167.3	-177.6	0	0	0	0	114.6
169	S	27.3	Very low	44.1	Very low	118 Å²	118	99.3 Å²	99.3	83%	0.825	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.6	-3.4	-175.5	-168.1	0	0	0	0	114.6	N167	N167-S169 PolarHBondContact O-N 3.02Å
170	S	30.8	Very low	44.7	Very low	44 Å²	44	96 Å²	96	31%	0.308	50%	0.495	S	S	.	.			trans	-109	18.6	-176.6	57.2	0	0	0	0	115.1	N167 F172 K173	N167-S170 PolarHBondContact O-OG 2.99Å; S170-F172 PolarHBondContact O-N 3.15Å; S170-K173 PolarHBondContact O-N 2.88Å
171	Q	35.3	Very low	45.2	Very low	138 Å²	138	97.6 Å²	97.6	65%	0.645	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-15.7	-177.2	-78.6	-175.8	-11	0	0	114.6	H175	Q171-H175 PolarHBondContact O-CE1 3.11Å
172	F	35	Very low	45.9	Very low	175 Å²	175	95.4 Å²	95.4	77%	0.768	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-0.5	-175.4	-69.2	-79.3	0	0	0	116.5	S170	S170-F172 PolarHBondContact O-N 3.15Å
173	K	37.9	Very low	46.6	Very low	173 Å²	173	92.9 Å²	92.9	75%	0.752	47%	0.474	S	S	*	.	S	Bend	trans	-101.1	2.1	-172	-75.9	-175.8	178.8	177.4	0	116.7	S170	S170-K173 PolarHBondContact O-N 2.88Å
174	H	50.7	Low	47.7	Very low	69 Å²	69	92.2 Å²	92.2	32%	0.319	47%	0.471	S	S	.	.	S	Bend	trans	-114.2	17.3	-169.5	-56.6	-67.4	0	0	0	115.4	T161	T161-H174 PolarHBondContact O-ND1 2.88Å
175	H	59.8	Low	49.1	Very low	46 Å²	46	86.8 Å²	86.8	21%	0.213	45%	0.449	C	S	.	.	S	Bend	trans	-106.4	154.4	-168.7	-56.1	125.1	0	0	0	113.7	V23 Q171 P177 M180	V23-H175 VanDerWaalsContact CB-CD2 3.43Å; V23-H175 WeakPolarHBondContact CB-CD2 3.3Å; V23-H175 WeakPolarHBondContact CG1-CD2 3.25Å; V23-H175 WeakPolarHBondContact CG1-NE2 3.39Å; Q171-H175 PolarHBondContact O-CE1 3.11Å; H175-P177 WeakPolarHBondContact O-CD 3.43Å; H175-M180 HydrophobicContact CB-CG 4.07Å
176	N	60.3	Low	50.2	Low	12 Å²	12	77.2 Å²	77.2	6%	0.064	41%	0.408	C	S	.	.			trans	-55.6	109.9	166.5	-177.2	-8.6	0	0	0	109.2	Q25 W178 S179 M180 F270	Q25-N176 PolarHBondContact O-ND2 3.45Å; N176-W178 PolarHBondContact O-N 3.28Å; N176-W178 VanDerWaalsContact O-N 3.08Å; N176-W178 VanDerWaalsContact OD1-CB 3.28Å; N176-W178 WeakPolarHBondContact OD1-CB 3.27Å; N176-W178 PolarHBondContact OD1-N 3.26Å; N176-S179 WeakPolarHBondContact O-CB 3.36Å; N176-S179 PolarHBondContact O-N 2.94Å; N176-M180 PolarHBondContact O-N 3.06Å; N176-F270 HydrophobicContact CB-CD1 4.13Å; N176-F270 HydrophobicContact CB-CE1 3.62Å; N176-F270 HydrophobicContact CB-CZ 4.21Å
177	P	59	Low	52	Low	45 Å²	45	76.4 Å²	76.4	29%	0.292	39%	0.389	S	S	.	.	H	α-helix	trans	-62.3	-25.9	-175.6	-13	22.3	0	0	0	112.1	Y160 H175 K181	Y160-P177 HydrophobicContact CE1-CG 4.39Å; Y160-P177 HydrophobicContact CE2-CG 4.22Å; Y160-P177 WeakPolarHBondContact OH-CG 3.29Å; H175-P177 WeakPolarHBondContact O-CD 3.43Å; P177-K181 PolarHBondContact O-N 2.85Å
178	W	56.5	Low	54	Low	41 Å²	41	73.8 Å²	73.8	16%	0.155	37%	0.372	C	S	.	.	H	α-helix	trans	-72.1	-41.3	178.2	-171.4	76.3	0	0	0	112.1	G28 N176 M180 K181 C182 K273	G28-W178 WeakPolarHBondContact O-CH2 3.26Å; N176-W178 PolarHBondContact O-N 3.28Å; N176-W178 VanDerWaalsContact O-N 3.08Å; N176-W178 VanDerWaalsContact OD1-CB 3.28Å; N176-W178 WeakPolarHBondContact OD1-CB 3.27Å; N176-W178 PolarHBondContact OD1-N 3.26Å; W178-M180 VanDerWaalsContact C-N 3.31Å; W178-M180 PolarHBondContact O-N 3.09Å; W178-K181 PolarHBondContact O-N 3.21Å; W178-C182 WeakPolarHBondContact CZ2-SG 3.41Å; W178-C182 WeakPolarHBondContact O-CB 3.31Å; W178-C182 PolarHBondContact O-N 2.8Å; W178-K273 HydrophobicContact CH2-CD 4.19Å; W178-K273 HydrophobicContact CZ2-CD 3.92Å; W178-K273 VanDerWaalsContact CZ2-CE 3.48Å; W178-K273 HydrophobicContact CZ2-CG 4.48Å; W178-K273 VanDerWaalsContact CZ2-NZ 3.34Å
179	S	60.3	Low	55.7	Low	2 Å²	2	74 Å²	74	1%	0.014	36%	0.358	C	S	.	.	H	α-helix	trans	-56.9	-48.6	172.4	179.8	0	0	0	0	109.9	F22 N176 K181 C182 H183	F22-S179 PolarHBondContact O-OG 2.96Å; N176-S179 WeakPolarHBondContact O-CB 3.36Å; N176-S179 PolarHBondContact O-N 2.94Å; S179-K181 PolarHBondContact O-N 3.47Å; S179-C182 PolarHBondContact O-N 2.83Å; S179-H183 WeakPolarHBondContact O-CB 3.24Å; S179-H183 PolarHBondContact O-N 3.27Å
180	M	62.4	Low	57.6	Low	43 Å²	43	68.8 Å²	68.8	21%	0.212	32%	0.321	C	S	.	.	H	α-helix	trans	-62.1	-42.2	179.5	-65.6	-57.9	-64.8	0	0	113.1	P21 H175 N176 W178 H183 Q184	P21-M180 HydrophobicContact CB-SD 4.2Å; H175-M180 HydrophobicContact CB-CG 4.07Å; N176-M180 PolarHBondContact O-N 3.06Å; W178-M180 VanDerWaalsContact C-N 3.31Å; W178-M180 PolarHBondContact O-N 3.09Å; M180-H183 PolarHBondContact O-N 3.08Å; M180-Q184 WeakPolarHBondContact O-CB 3.23Å; M180-Q184 VanDerWaalsContact O-CG 3.29Å; M180-Q184 WeakPolarHBondContact O-CG 3.35Å; M180-Q184 PolarHBondContact O-N 3.26Å
181	K	63.1	Low	59.4	Low	94 Å²	94	70.2 Å²	70.2	41%	0.409	32%	0.321	S	S	.	.	H	α-helix	trans	-66.4	-43	177.1	-173	174	-179.9	176.2	0	111.6	E148 P177 W178 S179 H183 Q185	E148-K181 IonicContact OE1-NZ 3.56Å; E148-K181 PolarHBondContact OE1-NZ 2.64Å; P177-K181 PolarHBondContact O-N 2.85Å; W178-K181 PolarHBondContact O-N 3.21Å; S179-K181 PolarHBondContact O-N 3.47Å; K181-H183 VanDerWaalsContact C-N 3.34Å; K181-Q185 WeakPolarHBondContact O-CB 3.45Å; K181-Q185 VanDerWaalsContact O-CG 3.31Å; K181-Q185 WeakPolarHBondContact O-CG 3.44Å; K181-Q185 PolarHBondContact O-N 3.38Å
182	C	60.3	Low	61	Low	26 Å²	26	68.8 Å²	68.8	18%	0.176	32%	0.315	C	S	.	.	H	α-helix	trans	-64.7	-41.7	176.5	-79.6	0	0	0	0	111.6	W178 S179 Q185 Q186	W178-C182 WeakPolarHBondContact CZ2-SG 3.41Å; W178-C182 WeakPolarHBondContact O-CB 3.31Å; W178-C182 PolarHBondContact O-N 2.8Å; S179-C182 PolarHBondContact O-N 2.83Å; C182-Q185 PolarHBondContact O-N 3.16Å; C182-Q186 WeakPolarHBondContact O-CB 3.46Å; C182-Q186 PolarHBondContact O-N 3.05Å
183	H	64.4	Low	62.5	Low	10 Å²	10	64.1 Å²	64.1	5%	0.046	30%	0.298	C	S	.	.	H	α-helix	trans	-58	-54.7	175	-168.2	68.8	0	0	0	111.1	P21 C31 L33 S179 M180 K181 Q185 Q186 L187	P21-H183 WeakPolarHBondContact CG-NE2 3.31Å; C31-H183 PolarHBondContact SG-CE1 2.89Å; C31-H183 PolarHBondContact SG-ND1 2.65Å; L33-H183 WeakPolarHBondContact CD2-CE1 2.98Å; S179-H183 WeakPolarHBondContact O-CB 3.24Å; S179-H183 PolarHBondContact O-N 3.27Å; M180-H183 PolarHBondContact O-N 3.08Å; K181-H183 VanDerWaalsContact C-N 3.34Å; H183-Q185 VanDerWaalsContact C-N 3.34Å; H183-Q185 PolarHBondContact O-N 3.13Å; H183-Q186 PolarHBondContact O-N 2.76Å; H183-Q186 VanDerWaalsContact O-N 3.15Å; H183-L187 WeakPolarHBondContact NE2-CD1 3.24Å; H183-L187 WeakPolarHBondContact O-CB 3.41Å; H183-L187 WeakPolarHBondContact O-CG 3.49Å; H183-L187 PolarHBondContact O-N 3.11Å
184	Q	65.9	Low	63.7	Low	124 Å²	124	56.8 Å²	56.8	58%	0.579	27%	0.269	S	S	*	.	H	α-helix	trans	-57.5	-43.3	177.6	-75.2	174.7	-6.8	0	0	112.8	M180 Q186 Q188	M180-Q184 WeakPolarHBondContact O-CB 3.23Å; M180-Q184 VanDerWaalsContact O-CG 3.29Å; M180-Q184 WeakPolarHBondContact O-CG 3.35Å; M180-Q184 PolarHBondContact O-N 3.26Å; Q184-Q186 VanDerWaalsContact C-N 3.34Å; Q184-Q186 PolarHBondContact O-N 3.16Å; Q184-Q188 VanDerWaalsContact O-CB 3.27Å; Q184-Q188 WeakPolarHBondContact O-CB 3.33Å; Q184-Q188 PolarHBondContact O-N 2.74Å
185	Q	65.9	Low	64.2	Low	94 Å²	94	61.6 Å²	61.6	44%	0.439	29%	0.289	S	S	.	.	H	α-helix	trans	-64.1	-38.9	178.4	-76.1	-178.8	1.4	0	0	112.5	K181 C182 H183 R189	K181-Q185 WeakPolarHBondContact O-CB 3.45Å; K181-Q185 VanDerWaalsContact O-CG 3.31Å; K181-Q185 WeakPolarHBondContact O-CG 3.44Å; K181-Q185 PolarHBondContact O-N 3.38Å; C182-Q185 PolarHBondContact O-N 3.16Å; H183-Q185 VanDerWaalsContact C-N 3.34Å; H183-Q185 PolarHBondContact O-N 3.13Å; Q185-R189 WeakPolarHBondContact O-CG 3.43Å; Q185-R189 PolarHBondContact O-N 2.99Å
186	Q	66.4	Low	64.2	Low	22 Å²	22	67.7 Å²	67.7	10%	0.103	32%	0.317	C	S	.	.	H	α-helix	trans	-74.9	-41.7	179.4	-174.7	159.4	-5.6	0	0	112	H29 C31 C182 H183 Q184 Q188 R189 M190	H29-Q186 PolarHBondContact O-OE1 3.41Å; H29-Q186 VanDerWaalsContact O-OE1 3.05Å; C31-Q186 HydrophobicContact CB-CB 4.07Å; C31-Q186 HydrophobicContact CB-CG 3.77Å; C31-Q186 VanDerWaalsContact CB-OE1 3.22Å; C31-Q186 VanDerWaalsContact N-CD 3.3Å; C182-Q186 WeakPolarHBondContact O-CB 3.46Å; C182-Q186 PolarHBondContact O-N 3.05Å; H183-Q186 PolarHBondContact O-N 2.76Å; H183-Q186 VanDerWaalsContact O-N 3.15Å; Q184-Q186 VanDerWaalsContact C-N 3.34Å; Q184-Q186 PolarHBondContact O-N 3.16Å; Q186-Q188 VanDerWaalsContact C-N 3.28Å; Q186-Q188 PolarHBondContact O-N 3.33Å; Q186-R189 PolarHBondContact O-N 3.29Å; Q186-M190 HydrophobicContact CG-CE 3.87Å; Q186-M190 HydrophobicContact CG-CG 4.5Å; Q186-M190 HydrophobicContact CG-SD 4.22Å; Q186-M190 WeakPolarHBondContact O-CG 3.15Å; Q186-M190 PolarHBondContact O-N 3.28Å
187	L	68.9	Low	64.4	Low	42 Å²	42	71.3 Å²	71.3	22%	0.22	33%	0.33	C	S	.	.	H	α-helix	trans	-58.6	-41.9	172.8	-69.3	-169.9	0	0	0	111.7	L84 H183 R189 M190 K191	L84-L187 HydrophobicContact CD1-CD1 4.48Å; L84-L187 HydrophobicContact CD1-CD2 3.21Å; L84-L187 HydrophobicContact CD1-CG 4.46Å; L84-L187 HydrophobicContact CG-CD2 4.27Å; H183-L187 WeakPolarHBondContact NE2-CD1 3.24Å; H183-L187 WeakPolarHBondContact O-CB 3.41Å; H183-L187 WeakPolarHBondContact O-CG 3.49Å; H183-L187 PolarHBondContact O-N 3.11Å; L187-R189 VanDerWaalsContact C-N 3.35Å; L187-R189 PolarHBondContact O-N 3.38Å; L187-M190 PolarHBondContact O-N 2.74Å; L187-K191 WeakPolarHBondContact O-CB 3.26Å; L187-K191 PolarHBondContact O-N 3.19Å
188	Q	69.1	Low	65.1	Low	97 Å²	97	72.8 Å²	72.8	45%	0.453	34%	0.336	S	S	.	.	H	α-helix	trans	-63.3	-40.6	177.7	-173.3	63	22.8	0	0	112.2	Q184 Q186 K191 E192	Q184-Q188 VanDerWaalsContact O-CB 3.27Å; Q184-Q188 WeakPolarHBondContact O-CB 3.33Å; Q184-Q188 PolarHBondContact O-N 2.74Å; Q186-Q188 VanDerWaalsContact C-N 3.28Å; Q186-Q188 PolarHBondContact O-N 3.33Å; Q188-K191 WeakPolarHBondContact O-CB 3.48Å; Q188-K191 PolarHBondContact O-N 3.24Å; Q188-E192 WeakPolarHBondContact O-CG 3.26Å; Q188-E192 PolarHBondContact O-N 3.3Å
189	R	70.1	Confident	66.2	Low	139 Å²	139	76.2 Å²	76.2	53%	0.525	35%	0.354	S	S	.	.	H	α-helix	trans	-65.8	-43	174.8	-72.1	173.6	-174.7	-165.7	1.4	111.9	Q185 Q186 L187 K191 E192 N193	Q185-R189 WeakPolarHBondContact O-CG 3.43Å; Q185-R189 PolarHBondContact O-N 2.99Å; Q186-R189 PolarHBondContact O-N 3.29Å; L187-R189 VanDerWaalsContact C-N 3.35Å; L187-R189 PolarHBondContact O-N 3.38Å; R189-K191 VanDerWaalsContact C-N 3.32Å; R189-E192 PolarHBondContact O-N 2.9Å; R189-N193 PolarHBondContact O-N 3.49Å; R189-N193 PolarHBondContact O-ND2 2.79Å
190	M	68	Low	67.5	Low	8 Å²	8	77 Å²	77	4%	0.039	36%	0.356	C	S	.	.	H	α-helix	trans	-65	-38.8	176.8	-67	173.8	168.6	0	0	111	P43 F74 Q186 L187 E192 N193 A194 F202	P43-M190 HydrophobicContact CB-CE 4.28Å; P43-M190 HydrophobicContact CG-CE 3.45Å; P43-M190 VanDerWaalsContact CG-CE 3.45Å; F74-M190 HydrophobicContact CE1-CB 3.91Å; F74-M190 HydrophobicContact CE2-CB 3.92Å; F74-M190 HydrophobicContact CZ-CB 3.23Å; F74-M190 HydrophobicContact CZ-CG 4.13Å; F74-M190 HydrophobicContact CZ-SD 3.96Å; Q186-M190 HydrophobicContact CG-CE 3.87Å; Q186-M190 HydrophobicContact CG-CG 4.5Å; Q186-M190 HydrophobicContact CG-SD 4.22Å; Q186-M190 WeakPolarHBondContact O-CG 3.15Å; Q186-M190 PolarHBondContact O-N 3.28Å; L187-M190 PolarHBondContact O-N 2.74Å; M190-E192 PolarHBondContact O-N 3.45Å; M190-N193 CarbonylContact O-C 3.57Å; M190-N193 PolarHBondContact O-N 3.24Å; M190-A194 VanDerWaalsContact O-CB 3.31Å; M190-A194 WeakPolarHBondContact O-CB 3.39Å; M190-A194 PolarHBondContact O-N 3.13Å; M190-F202 HydrophobicContact CE-CZ 4.41Å
191	K	69.3	Low	68.8	Low	74 Å²	74	78.5 Å²	78.5	32%	0.322	36%	0.362	S	S	.	.	H	α-helix	trans	-56.3	-46.9	170.7	173.8	-178.9	-154.1	143.8	0	112.1	L82 L187 Q188 R189 N193 A194	L82-K191 HydrophobicContact CD1-CB 3.65Å; L82-K191 HydrophobicContact CD1-CD 3.19Å; L82-K191 HydrophobicContact CD1-CG 3.41Å; L82-K191 VanDerWaalsContact CD1-CG 3.41Å; L82-K191 VanDerWaalsContact CD1-NZ 3.28Å; L82-K191 HydrophobicContact CG-CD 4.37Å; L187-K191 WeakPolarHBondContact O-CB 3.26Å; L187-K191 PolarHBondContact O-N 3.19Å; Q188-K191 WeakPolarHBondContact O-CB 3.48Å; Q188-K191 PolarHBondContact O-N 3.24Å; R189-K191 VanDerWaalsContact C-N 3.32Å; K191-N193 VanDerWaalsContact C-N 3.25Å; K191-N193 PolarHBondContact O-N 3.12Å; K191-A194 WeakPolarHBondContact O-CB 3.27Å; K191-A194 PolarHBondContact O-N 2.86Å
192	E	68.4	Low	70.3	Confident	109 Å²	109	74.1 Å²	74.1	51%	0.509	34%	0.343	S	S	.	.	H	α-helix	trans	-61.2	-38.2	179	-75	169.2	-170.9	0	0	111.4	Q188 R189 M190	Q188-E192 WeakPolarHBondContact O-CG 3.26Å; Q188-E192 PolarHBondContact O-N 3.3Å; R189-E192 PolarHBondContact O-N 2.9Å; M190-E192 PolarHBondContact O-N 3.45Å
193	N	65.8	Low	72	Confident	76 Å²	76	72.9 Å²	72.9	41%	0.406	33%	0.334	S	S	.	.	H	α-helix	trans	-79.2	-24.2	176.9	-66.3	-19.9	0	0	0	113.6	R189 M190 K191 K195 H196 R197	R189-N193 PolarHBondContact O-N 3.49Å; R189-N193 PolarHBondContact O-ND2 2.79Å; M190-N193 CarbonylContact O-C 3.57Å; M190-N193 PolarHBondContact O-N 3.24Å; K191-N193 VanDerWaalsContact C-N 3.25Å; K191-N193 PolarHBondContact O-N 3.12Å; N193-K195 PolarHBondContact O-N 2.98Å; N193-K195 VanDerWaalsContact O-N 3.14Å; N193-H196 PolarHBondContact O-N 3.34Å; N193-R197 PolarHBondContact O-N 3.22Å
194	A	64	Low	73.5	Confident	19 Å²	19	73.1 Å²	73.1	16%	0.157	34%	0.336	C	S	.	.	H	α-helix	trans	-62.9	-22.6	-177.5	0	0	0	0	0	112.7	F74 M190 K191 H196 R197	F74-A194 HydrophobicContact CB-CB 4.42Å; F74-A194 HydrophobicContact CD2-CB 3.89Å; F74-A194 HydrophobicContact CG-CB 4.17Å; M190-A194 VanDerWaalsContact O-CB 3.31Å; M190-A194 WeakPolarHBondContact O-CB 3.39Å; M190-A194 PolarHBondContact O-N 3.13Å; K191-A194 WeakPolarHBondContact O-CB 3.27Å; K191-A194 PolarHBondContact O-N 2.86Å; A194-H196 PolarHBondContact O-N 3.2Å; A194-R197 WeakPolarHBondContact CA-O 3.34Å; A194-R197 CarbonylContact O-C 3.59Å; A194-R197 PolarHBondContact O-N 3Å
195	K	60.3	Low	74.9	Confident	170 Å²	170	67.4 Å²	67.4	74%	0.739	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-21.4	171.7	-65.2	-177.2	179.7	179	0	113.6	N193	N193-K195 PolarHBondContact O-N 2.98Å; N193-K195 VanDerWaalsContact O-N 3.14Å
196	H	59.5	Low	76.4	Confident	174 Å²	174	64.4 Å²	64.4	81%	0.806	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	-20.8	179.8	-61.4	-63.6	0	0	0	113.3	N193 A194	N193-H196 PolarHBondContact O-N 3.34Å; A194-H196 PolarHBondContact O-N 3.2Å
197	R	65.8	Low	77.8	Confident	88 Å²	88	63.8 Å²	63.8	33%	0.332	29%	0.292	S	S	.	.			trans	-153.6	113.7	-177.6	-177.9	177.8	-179.7	169.2	7	110.2	L99 N193 A194 Q199 Y200	L99-R197 PolarHBondContact O-NH1 3.41Å; L99-R197 VanDerWaalsContact O-NH1 3.13Å; N193-R197 PolarHBondContact O-N 3.22Å; A194-R197 WeakPolarHBondContact CA-O 3.34Å; A194-R197 CarbonylContact O-C 3.59Å; A194-R197 PolarHBondContact O-N 3Å; R197-Q199 PolarHBondContact NE-O 3.46Å; R197-Y200 WeakPolarHBondContact O-CE2 3.49Å; R197-Y200 PolarHBondContact O-OH 2.93Å
198	N	72.4	Confident	79	Confident	77 Å²	77	62.3 Å²	62.3	41%	0.412	29%	0.285	S	S	.	.			trans	-99.9	12	-178.7	-157.8	25.6	0	0	0	114.7	S73 F74	S73-N198 WeakPolarHBondContact CA-O 3.14Å; S73-N198 WeakPolarHBondContact CB-O 3.4Å; F74-N198 WeakPolarHBondContact CB-OD1 3.28Å; F74-N198 PolarHBondContact N-OD1 3.49Å; F74-N198 PolarHBondContact O-ND2 3.44Å; F74-N198 PolarHBondContact O-OD1 3.01Å
199	Q	80	Confident	80.1	Confident	113 Å²	113	58 Å²	58	53%	0.528	27%	0.265	S	S	.	.			trans	-134.6	124.3	177.7	-74.7	-175.6	-6.9	0	0	111.3	V72 R197	V72-Q199 WeakPolarHBondContact O-CA 3.33Å; R197-Q199 PolarHBondContact NE-O 3.46Å
200	Y	86.8	Confident	81.1	Confident	18 Å²	18	54.1 Å²	54.1	7%	0.071	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	136.9	-177.4	-64	-90.6	0	0	0	110	S71 V72 F74 R197	S71-Y200 CarbonylContact C-O 3.52Å; V72-Y200 PolarHBondContact N-O 3.27Å; V72-Y200 PolarHBondContact O-N 2.87Å; F74-Y200 HydrophobicContact CD2-CD2 4.1Å; F74-Y200 AromaticContact CD2-CE2 3.77Å; F74-Y200 HydrophobicContact CD2-CE2 3.77Å; F74-Y200 AromaticContact CE2-CD2 3.58Å; F74-Y200 HydrophobicContact CE2-CD2 3.58Å; F74-Y200 AromaticContact CE2-CE2 3.36Å; F74-Y200 HydrophobicContact CE2-CE2 3.36Å; R197-Y200 WeakPolarHBondContact O-CE2 3.49Å; R197-Y200 PolarHBondContact O-OH 2.93Å
201	K	91.4	Very high	82.2	Confident	75 Å²	75	58 Å²	58	33%	0.326	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	135.4	172.9	-65.5	-176.6	-178.8	179.6	0	110.3	L44 V69 V70	L44-K201 HydrophobicContact CB-CB 3.95Å; L44-K201 VanDerWaalsContact CB-O 3.23Å; L44-K201 WeakPolarHBondContact CB-O 3.29Å; L44-K201 HydrophobicContact CD1-CB 4.07Å; L44-K201 PolarHBondContact N-O 2.87Å; V69-K201 HydrophobicContact CG1-CB 4Å; V69-K201 HydrophobicContact CG1-CG 4.42Å; V70-K201 WeakPolarHBondContact O-CA 3.46Å
202	F	93.6	Very high	83.2	Confident	1 Å²	1	55.2 Å²	55.2	0%	0.004	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	139.7	174.9	-81.5	-123.5	0	0	0	109.3	L33 C41 K42 P43 V69 V70 V72 M190	L33-F202 HydrophobicContact CD1-CE1 3.78Å; L33-F202 HydrophobicContact CD1-CZ 4.41Å; C41-F202 HydrophobicContact CB-CB 4.26Å; C41-F202 HydrophobicContact CB-CD1 4.22Å; K42-F202 CarbonylContact O-C 3.53Å; K42-F202 WeakPolarHBondContact O-CA 3.32Å; K42-F202 WeakPolarHBondContact O-CB 3.39Å; K42-F202 WeakPolarHBondContact O-CD1 3.39Å; P43-F202 HydrophobicContact CB-CE1 4.46Å; P43-F202 HydrophobicContact CB-CE2 4.46Å; P43-F202 HydrophobicContact CB-CZ 4.29Å; P43-F202 HydrophobicContact CG-CD1 4.41Å; P43-F202 HydrophobicContact CG-CE1 3.73Å; P43-F202 HydrophobicContact CG-CE2 4.33Å; P43-F202 HydrophobicContact CG-CZ 3.69Å; V69-F202 VanDerWaalsContact CA-O 3.31Å; V69-F202 WeakPolarHBondContact CA-O 3.48Å; V69-F202 VanDerWaalsContact CG1-O 3.28Å; V69-F202 WeakPolarHBondContact CG1-O 3.24Å; V70-F202 HydrophobicContact CG2-CB 4.04Å; V70-F202 PolarHBondContact N-O 2.99Å; V70-F202 PolarHBondContact O-N 3.15Å; V72-F202 HydrophobicContact CB-CD2 3.64Å; V72-F202 HydrophobicContact CB-CE2 3.78Å; V72-F202 HydrophobicContact CB-CG 4.3Å; V72-F202 HydrophobicContact CG1-CD2 4.4Å; V72-F202 HydrophobicContact CG1-CE2 4.14Å; V72-F202 HydrophobicContact CG1-CZ 4.45Å; V72-F202 HydrophobicContact CG2-CB 3.84Å; V72-F202 HydrophobicContact CG2-CD1 4.22Å; V72-F202 HydrophobicContact CG2-CD2 3.4Å; V72-F202 VanDerWaalsContact CG2-CD2 3.4Å; V72-F202 HydrophobicContact CG2-CE2 3.98Å; V72-F202 HydrophobicContact CG2-CG 3.57Å; M190-F202 HydrophobicContact CE-CZ 4.41Å
203	I	95.3	Very high	84.2	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	141.1	170.2	57	167.4	0	0	0	109.8	C41 K42 L44 E48 H49 Y52 Y66 V69 L205	C41-I203 WeakPolarHBondContact CA-O 3.17Å; K42-I203 HydrophobicContact CD-CD1 4.28Å; K42-I203 HydrophobicContact CD-CG1 4.44Å; K42-I203 HydrophobicContact CG-CD1 3.96Å; K42-I203 HydrophobicContact CG-CG1 3.59Å; K42-I203 PolarHBondContact N-O 3.39Å; K42-I203 VanDerWaalsContact N-O 3.1Å; K42-I203 PolarHBondContact O-N 3.33Å; L44-I203 HydrophobicContact CB-CG2 4.03Å; L44-I203 HydrophobicContact CD1-CG2 3.73Å; L44-I203 HydrophobicContact CG-CG2 3.72Å; E48-I203 HydrophobicContact CG-CD1 3.96Å; H49-I203 HydrophobicContact CB-CG2 4.24Å; Y52-I203 HydrophobicContact CD2-CD1 4.22Å; Y52-I203 HydrophobicContact CE2-CD1 4.16Å; Y66-I203 HydrophobicContact CE2-CB 4.15Å; Y66-I203 HydrophobicContact CE2-CG2 4.25Å; V69-I203 HydrophobicContact CG2-CG2 4.39Å; I203-L205 HydrophobicContact CD1-CD1 4.16Å; I203-L205 HydrophobicContact CD1-CD2 4.45Å; I203-L205 HydrophobicContact CD1-CG 4.35Å
204	L	96.2	Very high	85.5	Confident	15 Å²	15	53.5 Å²	53.5	8%	0.079	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	131.1	175.2	-64.5	176.6	0	0	0	110.1	F35 T39 I40 C41 Y66 E67 G68 V70	F35-L204 HydrophobicContact CB-CD2 4.03Å; F35-L204 HydrophobicContact CD1-CD2 4.17Å; F35-L204 HydrophobicContact CD2-CD2 3.85Å; F35-L204 HydrophobicContact CE2-CD2 4.37Å; F35-L204 HydrophobicContact CG-CD2 3.75Å; T39-L204 HydrophobicContact CG2-CB 3.85Å; T39-L204 HydrophobicContact CG2-CD2 3.91Å; T39-L204 HydrophobicContact CG2-CG 4.37Å; I40-L204 WeakPolarHBondContact O-CA 3.37Å; C41-L204 HydrophobicContact CB-CD2 3.75Å; Y66-L204 WeakPolarHBondContact CD2-O 3.37Å; E67-L204 HydrophobicContact CB-CB 3.74Å; E67-L204 PolarHBondContact N-O 2.85Å; G68-L204 PolarHBondContact O-N 2.88Å; V70-L204 HydrophobicContact CG1-CD1 3.63Å; V70-L204 HydrophobicContact CG1-CD2 4.27Å; V70-L204 HydrophobicContact CG1-CG 4.05Å; V70-L204 HydrophobicContact CG2-CD2 3.89Å; V70-L204 HydrophobicContact CG2-CG 4.15Å
205	L	96.8	Very high	86.9	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.021	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	153.2	-178.1	-61.3	177.4	0	0	0	111.8	T39 I40 K42 Y52 P64 Q65 Y66 I203 N207	T39-L205 CarbonylContact C-O 3.49Å; T39-L205 WeakPolarHBondContact CA-O 3.4Å; T39-L205 WeakPolarHBondContact CG2-O 3.36Å; I40-L205 HydrophobicContact CD1-CB 4.47Å; I40-L205 HydrophobicContact CG1-CB 4.04Å; I40-L205 WeakPolarHBondContact CG1-O 3.23Å; I40-L205 PolarHBondContact N-O 3.45Å; I40-L205 PolarHBondContact O-N 2.86Å; K42-L205 HydrophobicContact CD-CD1 4.3Å; Y52-L205 HydrophobicContact CD1-CD2 4.12Å; Y52-L205 HydrophobicContact CD2-CD2 4.08Å; Y52-L205 HydrophobicContact CE1-CD2 3.69Å; Y52-L205 HydrophobicContact CE2-CD1 4.07Å; Y52-L205 HydrophobicContact CE2-CD2 3.65Å; Y52-L205 HydrophobicContact CG-CD2 4.3Å; Y52-L205 VanDerWaalsContact CZ-CD2 3.42Å; P64-L205 HydrophobicContact CB-CB 4.14Å; Q65-L205 CarbonylContact O-C 3.47Å; Q65-L205 VanDerWaalsContact O-CA 3.29Å; Q65-L205 WeakPolarHBondContact O-CA 3.38Å; Y66-L205 HydrophobicContact CD2-CD2 4.07Å; I203-L205 HydrophobicContact CD1-CD1 4.16Å; I203-L205 HydrophobicContact CD1-CD2 4.45Å; I203-L205 HydrophobicContact CD1-CG 4.35Å; L205-N207 PolarHBondContact O-N 2.84Å
206	E	96.5	Very high	88.5	Confident	31 Å²	31	44.7 Å²	44.7	15%	0.145	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-50.1	127.3	170.8	-172.5	-169.1	161.2	0	0	111.4	P64 Q65 L208 R211 R378	P64-E206 HydrophobicContact CB-CB 4.19Å; Q65-E206 HydrophobicContact CB-CB 3.97Å; Q65-E206 PolarHBondContact N-OE2 2.91Å; Q65-E206 PolarHBondContact O-N 2.86Å; E206-L208 HydrophobicContact CB-CD2 4.47Å; E206-L208 HydrophobicContact CG-CD2 4.15Å; E206-L208 PolarHBondContact O-N 3.25Å; E206-L208 VanDerWaalsContact O-N 3.1Å; E206-R211 IonicContact OE1-CZ 3.17Å; E206-R211 IonicContact OE1-NH1 2.75Å; E206-R211 PolarHBondContact OE1-NH1 3.47Å; E206-R378 IonicContact OE1-NH2 3.57Å; E206-R378 PolarHBondContact OE1-NH2 3.21Å; E206-R378 VanDerWaalsContact OE1-NH2 3.07Å; E206-R378 IonicContact OE2-CZ 2.89Å; E206-R378 IonicContact OE2-NH1 3.7Å; E206-R378 PolarHBondContact OE2-NH1 3.04Å; E206-R378 IonicContact OE2-NH2 3.92Å; E206-R378 PolarHBondContact OE2-NH2 3.04Å
207	N	94.9	Very high	90.3	Very high	9 Å²	9	36.6 Å²	36.6	5%	0.048	17%	0.173	C	C	.	.			trans	-76.3	94.7	166.4	-178.2	2.6	0	0	0	109.6	F22 D37 K38 I40 L205 T209 S210	F22-N207 WeakPolarHBondContact CE2-OD1 3.31Å; D37-N207 PolarHBondContact O-ND2 2.81Å; K38-N207 VanDerWaalsContact C-CB 3.45Å; K38-N207 WeakPolarHBondContact O-CB 3.03Å; K38-N207 PolarHBondContact O-N 3.42Å; I40-N207 HydrophobicContact CG2-CB 3.98Å; L205-N207 PolarHBondContact O-N 2.84Å; N207-T209 PolarHBondContact O-N 2.71Å; N207-T209 VanDerWaalsContact O-N 3.08Å; N207-T209 PolarHBondContact OD1-N 3.17Å; N207-T209 PolarHBondContact OD1-OG1 3.5Å; N207-S210 WeakPolarHBondContact O-CB 3.47Å; N207-S210 PolarHBondContact O-N 3.32Å; N207-S210 VanDerWaalsContact O-N 3.13Å; N207-S210 PolarHBondContact O-OG 3.41Å
208	L	94.8	Very high	91.8	Very high	11 Å²	11	32.4 Å²	32.4	6%	0.058	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-18.8	179.1	-59.6	178.1	0	0	0	114.1	P64 E206 R211 Y212 L331 I333 R378	P64-L208 HydrophobicContact CG-CD1 4.11Å; P64-L208 HydrophobicContact CG-CG 4.46Å; E206-L208 HydrophobicContact CB-CD2 4.47Å; E206-L208 HydrophobicContact CG-CD2 4.15Å; E206-L208 PolarHBondContact O-N 3.25Å; E206-L208 VanDerWaalsContact O-N 3.1Å; L208-R211 PolarHBondContact O-NH2 2.97Å; L208-Y212 VanDerWaalsContact O-CE2 3.24Å; L208-Y212 WeakPolarHBondContact O-CE2 3.45Å; L208-L331 HydrophobicContact CD1-CD2 3.93Å; L208-I333 HydrophobicContact CB-CD1 3.57Å; L208-I333 HydrophobicContact CD1-CD1 4.28Å; L208-R378 HydrophobicContact CD1-CB 3.69Å; L208-R378 HydrophobicContact CD1-CG 3.65Å; L208-R378 HydrophobicContact CD2-CG 3.81Å; L208-R378 HydrophobicContact CG-CG 4.38Å
209	T	93.3	Very high	93	Very high	8 Å²	8	29 Å²	29	5%	0.049	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-12.2	-178.9	67	0	0	0	0	113.8	F22 H24 N207 R211 Y212 P215 V217 I333	F22-T209 WeakPolarHBondContact CE2-OG1 3.22Å; F22-T209 HydrophobicContact CZ-CG2 3.93Å; F22-T209 WeakPolarHBondContact CZ-OG1 3.27Å; H24-T209 HydrophobicContact CB-CG2 3.84Å; H24-T209 PolarHBondContact ND1-OG1 2.79Å; N207-T209 PolarHBondContact O-N 2.71Å; N207-T209 VanDerWaalsContact O-N 3.08Å; N207-T209 PolarHBondContact OD1-N 3.17Å; N207-T209 PolarHBondContact OD1-OG1 3.5Å; T209-R211 PolarHBondContact O-N 2.92Å; T209-R211 VanDerWaalsContact O-N 3.16Å; T209-Y212 PolarHBondContact O-N 3.34Å; T209-Y212 VanDerWaalsContact O-N 3.16Å; T209-P215 HydrophobicContact CG2-CB 4.25Å; T209-P215 HydrophobicContact CG2-CG 4.5Å; T209-V217 HydrophobicContact CG2-CG2 4.29Å; T209-I333 HydrophobicContact CG2-CD1 4.39Å
210	S	91.2	Very high	93.8	Very high	57 Å²	57	23.6 Å²	23.6	40%	0.399	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-26.1	-171	61	0	0	0	0	115.1	D37 N207	D37-S210 WeakPolarHBondContact O-CB 3.49Å; N207-S210 WeakPolarHBondContact O-CB 3.47Å; N207-S210 PolarHBondContact O-N 3.32Å; N207-S210 VanDerWaalsContact O-N 3.13Å; N207-S210 PolarHBondContact O-OG 3.41Å
211	R	89.9	Confident	94.3	Very high	88 Å²	88	23.7 Å²	23.7	33%	0.332	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-5.1	-178.2	63.5	-174.8	158.1	-107.3	-17.2	114.6	E206 L208 T209 D376	E206-R211 IonicContact OE1-CZ 3.17Å; E206-R211 IonicContact OE1-NH1 2.75Å; E206-R211 PolarHBondContact OE1-NH1 3.47Å; L208-R211 PolarHBondContact O-NH2 2.97Å; T209-R211 PolarHBondContact O-N 2.92Å; T209-R211 VanDerWaalsContact O-N 3.16Å; R211-D376 IonicContact CZ-OD2 2.68Å; R211-D376 IonicContact NH1-OD2 3.84Å; R211-D376 VanDerWaalsContact NH2-CG 3.33Å; R211-D376 IonicContact NH2-OD2 2.64Å; R211-D376 PolarHBondContact NH2-OD2 3.32Å
212	Y	90.9	Very high	94.5	Very high	17 Å²	17	20.1 Å²	20.1	7%	0.067	10%	0.099	C	C	.	.			trans	-106.4	138.9	-175.9	-59.8	-70.5	0	0	0	110.6	L208 T209 P215 I333 D335 T374 D376	L208-Y212 VanDerWaalsContact O-CE2 3.24Å; L208-Y212 WeakPolarHBondContact O-CE2 3.45Å; T209-Y212 PolarHBondContact O-N 3.34Å; T209-Y212 VanDerWaalsContact O-N 3.16Å; Y212-P215 HydrophobicContact CD2-CB 4.4Å; Y212-P215 HydrophobicContact CG-CB 4.39Å; Y212-I333 HydrophobicContact CD2-CG2 3.6Å; Y212-I333 HydrophobicContact CE2-CB 3.99Å; Y212-I333 HydrophobicContact CE2-CG2 3.31Å; Y212-I333 HydrophobicContact CG-CG2 4.36Å; Y212-D335 HydrophobicContact CD1-CB 3.71Å; Y212-D335 HydrophobicContact CE1-CB 4.44Å; Y212-T374 VanDerWaalsContact CE1-O 3.23Å; Y212-T374 WeakPolarHBondContact CE1-O 3.24Å; Y212-T374 PolarHBondContact OH-O 3.01Å; Y212-D376 WeakPolarHBondContact OH-CB 3.49Å; Y212-D376 PolarHBondContact OH-N 3.25Å
213	E	89.7	Confident	94.6	Very high	128 Å²	128	20.3 Å²	20.3	60%	0.598	10%	0.101	S	C	*	.	S	Bend	trans	-74.7	-44	174.4	-167.1	-179.2	153.4	0	0	110.7	D335 K337	E213-D335 PolarHBondContact N-OD1 3.3Å; E213-D335 PolarHBondContact N-OD2 3.1Å; E213-K337 HydrophobicContact CG-CD 4.3Å; E213-K337 WeakPolarHBondContact OE1-CD 3.47Å; E213-K337 IonicContact OE1-NZ 2.62Å; E213-K337 PolarHBondContact OE1-NZ 3.04Å; E213-K337 WeakPolarHBondContact OE2-CD 3.28Å; E213-K337 IonicContact OE2-NZ 2.81Å; E213-K337 PolarHBondContact OE2-NZ 2.9Å
214	V	91.3	Very high	94.5	Very high	21 Å²	21	23 Å²	23	13%	0.127	12%	0.118	C	C	.	.	S	Bend	trans	-133.2	85	176.9	-170.7	0	0	0	0	109.1	C216 Y261 L268 D335 G336 K337	V214-C216 PolarHBondContact O-N 2.62Å; V214-Y261 HydrophobicContact CG1-CD1 4.36Å; V214-Y261 HydrophobicContact CG1-CD2 3.69Å; V214-Y261 HydrophobicContact CG1-CE2 4.35Å; V214-Y261 HydrophobicContact CG1-CG 3.68Å; V214-L268 HydrophobicContact CG1-CD2 4.19Å; V214-D335 PolarHBondContact N-OD1 2.71Å; V214-G336 WeakPolarHBondContact O-CA 3.47Å; V214-G336 PolarHBondContact O-N 3.42Å; V214-K337 HydrophobicContact CB-CB 4.42Å; V214-K337 HydrophobicContact CG2-CB 4.09Å
215	P	93.6	Very high	94.3	Very high	4 Å²	4	26.1 Å²	26.1	3%	0.026	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	123.3	-173.2	25.9	-33.8	0	0	0	111.6	T209 Y212 V217 Q259 I333	T209-P215 HydrophobicContact CG2-CB 4.25Å; T209-P215 HydrophobicContact CG2-CG 4.5Å; Y212-P215 HydrophobicContact CD2-CB 4.4Å; Y212-P215 HydrophobicContact CG-CB 4.39Å; P215-V217 HydrophobicContact CB-CG2 4.01Å; P215-Q259 PolarHBondContact O-NE2 2.97Å; P215-I333 HydrophobicContact CB-CG2 4.29Å
216	C	95.7	Very high	93.8	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	125.9	161	-66.3	0	0	0	0	108.1	V214 Q259 Y261 F291 I333 Y334 G336	V214-C216 PolarHBondContact O-N 2.62Å; C216-Q259 CarbonylContact C-O 3.58Å; C216-Q259 VanDerWaalsContact CA-O 3.25Å; C216-Q259 WeakPolarHBondContact CA-O 2.96Å; C216-Y261 PolarHBondContact SG-N 3.43Å; C216-F291 HydrophobicContact CB-CE2 4.22Å; C216-I333 VanDerWaalsContact O-CA 3.26Å; C216-I333 WeakPolarHBondContact O-CA 3.41Å; C216-I333 WeakPolarHBondContact O-CG2 3.32Å; C216-Y334 HydrophobicContact CB-CD1 3.78Å; C216-Y334 HydrophobicContact CB-CD2 4.11Å; C216-Y334 HydrophobicContact CB-CE1 3.33Å; C216-Y334 HydrophobicContact CB-CE2 3.7Å; C216-Y334 HydrophobicContact CB-CG 4.13Å; C216-Y334 PolarHBondContact N-O 3.05Å; C216-Y334 PolarHBondContact O-N 2.93Å; C216-Y334 VanDerWaalsContact O-N 3.12Å; C216-Y334 PolarHBondContact SG-OH 3.47Å; C216-Y334 VanDerWaalsContact SG-OH 3.38Å; C216-G336 VanDerWaalsContact SG-CA 3.58Å
217	V	96.5	Very high	93.5	Very high	3 Å²	3	25.7 Å²	25.7	2%	0.018	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	127.8	-169.6	-173.9	0	0	0	0	110.2	V26 T209 P215 M258 Q259 L331 I333	V26-V217 HydrophobicContact CG1-CB 3.91Å; V26-V217 HydrophobicContact CG1-CG1 4.14Å; V26-V217 HydrophobicContact CG2-CB 4.27Å; V26-V217 HydrophobicContact CG2-CG1 3.66Å; T209-V217 HydrophobicContact CG2-CG2 4.29Å; P215-V217 HydrophobicContact CB-CG2 4.01Å; V217-M258 CarbonylContact O-C 3.5Å; V217-M258 WeakPolarHBondContact O-CA 3.29Å; V217-Q259 PolarHBondContact N-O 2.92Å; V217-Q259 PolarHBondContact O-N 3.38Å; V217-L331 HydrophobicContact CG1-CD1 3.42Å; V217-L331 VanDerWaalsContact CG1-CD1 3.42Å; V217-L331 HydrophobicContact CG1-CD2 4.31Å; V217-L331 HydrophobicContact CG1-CG 3.97Å; V217-I333 HydrophobicContact CG1-CG1 4.39Å; V217-I333 HydrophobicContact CG2-CG2 4.2Å
218	L	97.7	Very high	93	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	120.2	174.1	175.7	67.9	0	0	0	110.1	L220 V255 M258 L288 F291 L331 I332	L218-L220 HydrophobicContact CD1-CD2 3.91Å; L218-L220 HydrophobicContact CD1-CG 4.5Å; L218-L220 HydrophobicContact CD2-CD1 4.06Å; L218-L220 HydrophobicContact CD2-CD2 3.95Å; L218-L220 HydrophobicContact CD2-CG 4.03Å; L218-L220 HydrophobicContact CG-CD1 4.46Å; L218-L220 HydrophobicContact CG-CD2 3.84Å; L218-L220 HydrophobicContact CG-CG 3.91Å; L218-V255 HydrophobicContact CD1-CG1 4.13Å; L218-V255 HydrophobicContact CD1-CG2 4.43Å; L218-M258 HydrophobicContact CD1-CB 4.08Å; L218-M258 HydrophobicContact CD1-CG 4.1Å; L218-M258 HydrophobicContact CD1-SD 4.24Å; L218-L288 HydrophobicContact CD2-CD2 3.56Å; L218-F291 HydrophobicContact CB-CD1 4.11Å; L218-F291 HydrophobicContact CB-CD2 3.64Å; L218-F291 HydrophobicContact CB-CE1 3.88Å; L218-F291 HydrophobicContact CB-CE2 3.41Å; L218-F291 VanDerWaalsContact CB-CE2 3.41Å; L218-F291 HydrophobicContact CB-CG 3.99Å; L218-F291 HydrophobicContact CB-CZ 3.52Å; L218-F291 HydrophobicContact CD2-CB 4.4Å; L218-F291 HydrophobicContact CD2-CD1 3.76Å; L218-F291 HydrophobicContact CD2-CD2 4.42Å; L218-F291 HydrophobicContact CD2-CE1 4.11Å; L218-F291 HydrophobicContact CD2-CG 3.92Å; L218-F291 HydrophobicContact CG-CD2 4.44Å; L218-F291 HydrophobicContact CG-CG 4.42Å; L218-L331 CarbonylContact O-C 3.52Å; L218-L331 WeakPolarHBondContact O-CA 3.18Å; L218-I332 HydrophobicContact CB-CB 4.42Å; L218-I332 HydrophobicContact CD2-CD1 4.42Å; L218-I332 PolarHBondContact N-O 2.75Å; L218-I332 PolarHBondContact O-N 3.09Å
219	D	97.4	Very high	92.6	Very high	5 Å²	5	27 Å²	27	3%	0.027	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	117.2	174.1	177.4	-15.2	0	0	0	109.4	V26 G27 C256 G257 S329 L331	V26-D219 HydrophobicContact CG2-CB 3.72Å; G27-D219 WeakPolarHBondContact CA-OD2 2.98Å; D219-C256 HydrophobicContact CB-CB 4.42Å; D219-C256 WeakPolarHBondContact O-CA 3.42Å; D219-C256 WeakPolarHBondContact O-CB 3.42Å; D219-C256 PolarHBondContact O-N 3.37Å; D219-G257 PolarHBondContact N-O 3.02Å; D219-G257 PolarHBondContact O-N 3.2Å; D219-S329 WeakPolarHBondContact OD1-CB 3.11Å; D219-S329 PolarHBondContact OD1-OG 3.13Å; D219-L331 HydrophobicContact CB-CD1 3.97Å
220	L	97.4	Very high	92.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	122.6	178.6	-60.9	178.1	0	0	0	110.1	L218 M222 V253 R254 V255 F284 S329 L330 I332 L411	L218-L220 HydrophobicContact CD1-CD2 3.91Å; L218-L220 HydrophobicContact CD1-CG 4.5Å; L218-L220 HydrophobicContact CD2-CD1 4.06Å; L218-L220 HydrophobicContact CD2-CD2 3.95Å; L218-L220 HydrophobicContact CD2-CG 4.03Å; L218-L220 HydrophobicContact CG-CD1 4.46Å; L218-L220 HydrophobicContact CG-CD2 3.84Å; L218-L220 HydrophobicContact CG-CG 3.91Å; L220-M222 HydrophobicContact CB-SD 4.11Å; L220-V253 HydrophobicContact CB-CG2 3.89Å; L220-V253 HydrophobicContact CD1-CG2 4.21Å; L220-V253 HydrophobicContact CD2-CG2 4.36Å; L220-V253 HydrophobicContact CG-CG2 4.38Å; L220-R254 CarbonylContact C-O 3.51Å; L220-R254 WeakPolarHBondContact CA-O 3.32Å; L220-V255 HydrophobicContact CD2-CG2 4.06Å; L220-F284 HydrophobicContact CD2-CE2 3.98Å; L220-F284 HydrophobicContact CD2-CZ 4.21Å; L220-S329 CarbonylContact O-C 3.56Å; L220-S329 WeakPolarHBondContact O-CA 3.48Å; L220-L330 HydrophobicContact CB-CB 4.41Å; L220-L330 PolarHBondContact N-O 3.15Å; L220-L330 PolarHBondContact O-N 3.23Å; L220-I332 HydrophobicContact CD1-CD1 4.26Å; L220-L411 HydrophobicContact CD1-CD1 3.81Å; L220-L411 HydrophobicContact CD1-CD2 3.53Å; L220-L411 HydrophobicContact CD1-CG 4.34Å
221	K	96.3	Very high	91.8	Very high	20 Å²	20	28.8 Å²	28.8	9%	0.087	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	126.6	171.3	-165.7	103.1	-72.3	173.4	0	109.1	V253 R254 C256 S327 S328 S329 D381	K221-V253 WeakPolarHBondContact O-CA 3.42Å; K221-R254 HydrophobicContact CB-CG 4.01Å; K221-R254 PolarHBondContact N-O 3.46Å; K221-R254 PolarHBondContact O-N 2.75Å; K221-R254 VanDerWaalsContact O-N 3.11Å; K221-C256 HydrophobicContact CB-CB 4.45Å; K221-S327 VanDerWaalsContact CE-C 3.49Å; K221-S327 WeakPolarHBondContact CE-O 3.46Å; K221-S327 PolarHBondContact NZ-O 2.97Å; K221-S328 WeakPolarHBondContact CE-O 3.23Å; K221-S329 WeakPolarHBondContact CE-OG 3.24Å; K221-S329 PolarHBondContact NZ-OG 2.86Å; K221-D381 IonicContact NZ-OD2 3.25Å
222	M	96.7	Very high	91.7	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	157	-172.4	-58	-57.7	-68.7	0	0	111.9	L220 G252 V253 S328 L330 Y404 L408	L220-M222 HydrophobicContact CB-SD 4.11Å; M222-G252 CarbonylContact C-O 3.48Å; M222-V253 HydrophobicContact CE-CG2 4.44Å; M222-V253 HydrophobicContact SD-CB 4.17Å; M222-V253 HydrophobicContact SD-CG2 3.6Å; M222-V253 VanDerWaalsContact SD-CG2 3.6Å; M222-S328 PolarHBondContact N-O 3.21Å; M222-L330 HydrophobicContact CG-CB 3.8Å; M222-L330 HydrophobicContact SD-CB 3.93Å; M222-L330 HydrophobicContact SD-CD2 4.38Å; M222-Y404 HydrophobicContact CB-CD1 4.39Å; M222-Y404 HydrophobicContact CB-CD2 3.54Å; M222-Y404 HydrophobicContact CB-CE1 4.13Å; M222-Y404 HydrophobicContact CB-CE2 3.25Å; M222-Y404 HydrophobicContact CB-CG 4.12Å; M222-Y404 HydrophobicContact CE-CD1 4.45Å; M222-Y404 HydrophobicContact CE-CE1 4.11Å; M222-Y404 HydrophobicContact CG-CD2 4.41Å; M222-Y404 HydrophobicContact CG-CE1 4.07Å; M222-Y404 HydrophobicContact CG-CE2 3.71Å; M222-Y404 VanDerWaalsContact CG-CZ 3.5Å; M222-Y404 WeakPolarHBondContact CG-OH 3.08Å; M222-L408 HydrophobicContact CE-CB 4.47Å; M222-L408 HydrophobicContact CE-CD2 3.77Å; M222-L408 HydrophobicContact CE-CG 3.83Å
223	G	95.3	Very high	91.6	Very high	5 Å²	5	33.6 Å²	33.6	5%	0.052	18%	0.176	C	C	.	.			trans	89.9	149.7	175.6	0	0	0	0	0	114.9	R225 G252	G223-R225 VanDerWaalsContact C-N 3.33Å; G223-G252 CarbonylContact C-O 3.46Å; G223-G252 PolarHBondContact N-O 3.31Å
224	T	92.8	Very high	91.6	Very high	58 Å²	58	33 Å²	33	36%	0.356	17%	0.173	S	C	.	.	S	Bend	trans	-80.6	-15.6	172	53.7	0	0	0	0	112.8	C243 F406	T224-C243 PolarHBondContact O-SG 3.22Å; T224-F406 HydrophobicContact CG2-CD1 3.78Å; T224-F406 HydrophobicContact CG2-CE1 4.12Å
225	R	91.4	Very high	91.3	Very high	79 Å²	79	34 Å²	34	30%	0.298	18%	0.176	S	C	.	.			trans	-124.8	132.4	174.4	178.2	-179.4	165.8	-171	-2.1	109.4	G223 H227 G228 D229 Y326	G223-R225 VanDerWaalsContact C-N 3.33Å; R225-H227 PolarHBondContact NE-CE1 2.97Å; R225-H227 PolarHBondContact NE-ND1 3.35Å; R225-H227 PolarHBondContact NE-NE2 2.8Å; R225-H227 PolarHBondContact NE-O 2.99Å; R225-H227 PolarHBondContact NH2-CE1 3.1Å; R225-H227 PolarHBondContact NH2-ND1 2.81Å; R225-H227 PolarHBondContact NH2-O 2.84Å; R225-G228 PolarHBondContact NH2-O 3.31Å; R225-D229 IonicContact CZ-OD1 3.23Å; R225-D229 IonicContact NH1-OD1 3.77Å; R225-D229 PolarHBondContact NH1-OD1 2.89Å; R225-D229 IonicContact NH2-OD1 3.93Å; R225-D229 PolarHBondContact NH2-OD1 3.08Å; R225-Y326 HydrophobicContact CB-CE1 4.45Å; R225-Y326 HydrophobicContact CG-CD1 4.2Å; R225-Y326 HydrophobicContact CG-CE1 4.02Å
226	Q	87.2	Confident	91.1	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.019	19%	0.188	C	C	.	.			trans	-125.4	-2.4	-173.9	-69.8	171.9	2.6	0	0	114	Q239 S248 R254 S327	Q226-Q239 PolarHBondContact O-NE2 2.8Å; Q226-Q239 VanDerWaalsContact O-NE2 3.12Å; Q226-S248 PolarHBondContact NE2-OG 2.8Å; Q226-S248 VanDerWaalsContact NE2-OG 3.1Å; Q226-R254 VanDerWaalsContact NE2-CZ 3.35Å; Q226-S327 PolarHBondContact O-OG 3.31Å
227	H	89.3	Confident	90.9	Very high	22 Å²	22	39.6 Å²	39.6	10%	0.102	21%	0.21	C	C	.	.			trans	-94.8	134.1	172.5	66.6	87.1	0	0	0	110	R225 A231 K236 Q239	R225-H227 PolarHBondContact NE-CE1 2.97Å; R225-H227 PolarHBondContact NE-ND1 3.35Å; R225-H227 PolarHBondContact NE-NE2 2.8Å; R225-H227 PolarHBondContact NE-O 2.99Å; R225-H227 PolarHBondContact NH2-CE1 3.1Å; R225-H227 PolarHBondContact NH2-ND1 2.81Å; R225-H227 PolarHBondContact NH2-O 2.84Å; H227-A231 HydrophobicContact CB-CB 4.22Å; H227-K236 HydrophobicContact CB-CB 4.36Å; H227-K236 HydrophobicContact CB-CG 4.23Å; H227-Q239 HydrophobicContact CB-CB 4.08Å
228	G	85.6	Confident	90.5	Very high	3 Å²	3	41.8 Å²	41.8	3%	0.031	22%	0.222	C	C	.	.			trans	-62.8	171.7	166.9	0	0	0	0	0	111.6	R225 D230	R225-G228 PolarHBondContact NH2-O 3.31Å; G228-D230 VanDerWaalsContact C-N 3.32Å
229	D	85.2	Confident	90	Very high	44 Å²	44	42.6 Å²	42.6	24%	0.235	23%	0.226	C	C	.	.	S	Bend	trans	-76.9	-23.7	174.6	-62.5	-51.6	0	0	0	111.8	R225 V395 H397	R225-D229 IonicContact CZ-OD1 3.23Å; R225-D229 IonicContact NH1-OD1 3.77Å; R225-D229 PolarHBondContact NH1-OD1 2.89Å; R225-D229 IonicContact NH2-OD1 3.93Å; R225-D229 PolarHBondContact NH2-OD1 3.08Å; D229-V395 HydrophobicContact CB-CB 4.16Å; D229-V395 HydrophobicContact CB-CG2 3.94Å; D229-H397 IonicContact OD1-NE2 3.03Å; D229-H397 IonicContact OD2-CD2 3.36Å; D229-H397 IonicContact OD2-CE1 2.68Å; D229-H397 IonicContact OD2-NE2 3.38Å; D229-H397 PolarHBondContact OD2-NE2 2.74Å
230	D	82.9	Confident	89.6	Confident	90 Å²	90	45.1 Å²	45.1	48%	0.481	24%	0.238	S	C	.	.	S	Bend	trans	-86.5	-4.1	178	66.6	-33	0	0	0	114	G228 S232	G228-D230 VanDerWaalsContact C-N 3.32Å; D230-S232 PolarHBondContact O-N 2.87Å
231	A	85.1	Confident	89.3	Confident	13 Å²	13	51.2 Å²	51.2	11%	0.107	26%	0.261	C	S	.	.			trans	-67.9	131.8	-174.6	0	0	0	0	0	111.9	H227 K235 K236	H227-A231 HydrophobicContact CB-CB 4.22Å; A231-K235 HydrophobicContact CB-CB 4.44Å; A231-K235 HydrophobicContact CB-CD 4.22Å; A231-K235 HydrophobicContact CB-CG 4.41Å; A231-K236 HydrophobicContact CB-CB 4.38Å
232	S	88.4	Confident	89	Confident	71 Å²	71	53.7 Å²	53.7	50%	0.497	27%	0.272	S	S	.	.			trans	-57	152.5	171.5	73.6	0	0	0	0	111.5	D230 E234 K235 K236	D230-S232 PolarHBondContact O-N 2.87Å; S232-E234 PolarHBondContact O-N 2.93Å; S232-E234 VanDerWaalsContact O-N 3.17Å; S232-K235 WeakPolarHBondContact O-CA 3.2Å; S232-K235 WeakPolarHBondContact O-CB 3.47Å; S232-K235 PolarHBondContact O-N 3.05Å; S232-K235 WeakPolarHBondContact OG-CB 3.39Å; S232-K235 PolarHBondContact OG-N 2.91Å; S232-K236 WeakPolarHBondContact O-CB 3.44Å; S232-K236 PolarHBondContact O-N 3.1Å
233	E	88.9	Confident	88.6	Confident	135 Å²	135	54.1 Å²	54.1	63%	0.631	28%	0.275	S	S	*	.	H	α-helix	trans	-56.9	-36.2	-178.5	-70.2	-56.9	134.9	0	0	112.8	K236 A237	E233-K236 IonicContact OE1-NZ 3.86Å; E233-A237 VanDerWaalsContact O-CB 3.24Å; E233-A237 WeakPolarHBondContact O-CB 3.33Å; E233-A237 PolarHBondContact O-N 3.19Å
234	E	88.6	Confident	88.4	Confident	116 Å²	116	60.4 Å²	60.4	54%	0.542	30%	0.303	S	S	.	.	H	α-helix	trans	-65.5	-44.2	173.8	-172.6	-174.5	171.1	0	0	112	S232 N238	S232-E234 PolarHBondContact O-N 2.93Å; S232-E234 VanDerWaalsContact O-N 3.17Å; E234-N238 WeakPolarHBondContact O-CB 3.41Å; E234-N238 PolarHBondContact O-N 3Å; E234-N238 PolarHBondContact O-ND2 3.04Å
235	K	86.3	Confident	88.3	Confident	42 Å²	42	64 Å²	64	18%	0.183	32%	0.316	C	S	.	.	H	α-helix	trans	-65.7	-44.6	179.1	-173.5	179.2	-178.6	-176.9	0	110.7	E105 A231 S232 N238 Q239 H384	E105-K235 IonicContact OE1-NZ 3.25Å; E105-K235 PolarHBondContact OE1-NZ 2.75Å; E105-K235 IonicContact OE2-NZ 2.6Å; E105-K235 PolarHBondContact OE2-NZ 2.82Å; A231-K235 HydrophobicContact CB-CB 4.44Å; A231-K235 HydrophobicContact CB-CD 4.22Å; A231-K235 HydrophobicContact CB-CG 4.41Å; S232-K235 WeakPolarHBondContact O-CA 3.2Å; S232-K235 WeakPolarHBondContact O-CB 3.47Å; S232-K235 PolarHBondContact O-N 3.05Å; S232-K235 WeakPolarHBondContact OG-CB 3.39Å; S232-K235 PolarHBondContact OG-N 2.91Å; K235-N238 PolarHBondContact O-N 2.76Å; K235-Q239 WeakPolarHBondContact O-CG 3.42Å; K235-Q239 PolarHBondContact O-N 2.6Å; K235-H384 PolarHBondContact NZ-CE1 3.25Å; K235-H384 PolarHBondContact NZ-NE2 3.32Å
236	K	89.4	Confident	88.3	Confident	65 Å²	65	60.7 Å²	60.7	28%	0.283	31%	0.305	S	S	.	.	H	α-helix	trans	-59.3	-51.8	175.5	179.9	174.1	175.5	-171.3	0	111.4	H227 A231 S232 E233 N238 Q239 I240	H227-K236 HydrophobicContact CB-CB 4.36Å; H227-K236 HydrophobicContact CB-CG 4.23Å; A231-K236 HydrophobicContact CB-CB 4.38Å; S232-K236 WeakPolarHBondContact O-CB 3.44Å; S232-K236 PolarHBondContact O-N 3.1Å; E233-K236 IonicContact OE1-NZ 3.86Å; K236-N238 VanDerWaalsContact C-N 3.28Å; K236-N238 PolarHBondContact O-N 3.03Å; K236-Q239 PolarHBondContact O-N 2.86Å; K236-Q239 VanDerWaalsContact O-N 3.17Å; K236-I240 HydrophobicContact CG-CD1 3.7Å; K236-I240 HydrophobicContact CG-CG1 4.45Å; K236-I240 WeakPolarHBondContact O-CB 3.23Å; K236-I240 VanDerWaalsContact O-CG1 3.24Å; K236-I240 WeakPolarHBondContact O-CG1 3.36Å; K236-I240 PolarHBondContact O-N 3.24Å
237	A	89.8	Confident	88.7	Confident	57 Å²	57	60.7 Å²	60.7	47%	0.471	31%	0.305	S	S	.	.	H	α-helix	trans	-57.6	-41.2	176.4	0	0	0	0	0	112.1	E233 R241	E233-A237 VanDerWaalsContact O-CB 3.24Å; E233-A237 WeakPolarHBondContact O-CB 3.33Å; E233-A237 PolarHBondContact O-N 3.19Å; A237-R241 WeakPolarHBondContact O-CB 3.24Å; A237-R241 PolarHBondContact O-N 3.4Å
238	N	88	Confident	89	Confident	48 Å²	48	59.6 Å²	59.6	26%	0.257	30%	0.3	S	S	.	.	H	α-helix	trans	-65.8	-42.1	176.4	-82.9	-47.7	0	0	0	113.3	E234 K235 K236 R241 K242	E234-N238 WeakPolarHBondContact O-CB 3.41Å; E234-N238 PolarHBondContact O-N 3Å; E234-N238 PolarHBondContact O-ND2 3.04Å; K235-N238 PolarHBondContact O-N 2.76Å; K236-N238 VanDerWaalsContact C-N 3.28Å; K236-N238 PolarHBondContact O-N 3.03Å; N238-R241 PolarHBondContact OD1-NH2 2.73Å; N238-K242 VanDerWaalsContact O-CG 3.24Å; N238-K242 WeakPolarHBondContact O-CG 3.42Å; N238-K242 PolarHBondContact O-N 3.33Å; N238-K242 VanDerWaalsContact O-N 3.07Å
239	Q	88.4	Confident	89.4	Confident	17 Å²	17	61.8 Å²	61.8	8%	0.079	32%	0.318	C	S	.	.	H	α-helix	trans	-68.9	-40.8	177.2	-78.1	168.3	-37.8	0	0	111.7	Q226 H227 K235 K236 K242 C243 S327	Q226-Q239 PolarHBondContact O-NE2 2.8Å; Q226-Q239 VanDerWaalsContact O-NE2 3.12Å; H227-Q239 HydrophobicContact CB-CB 4.08Å; K235-Q239 WeakPolarHBondContact O-CG 3.42Å; K235-Q239 PolarHBondContact O-N 2.6Å; K236-Q239 PolarHBondContact O-N 2.86Å; K236-Q239 VanDerWaalsContact O-N 3.17Å; Q239-K242 PolarHBondContact O-N 3.25Å; Q239-C243 WeakPolarHBondContact O-CB 3.33Å; Q239-C243 PolarHBondContact O-N 3.4Å; Q239-S327 PolarHBondContact NE2-OG 2.75Å
240	I	89.7	Confident	89.9	Confident	58 Å²	58	64.3 Å²	64.3	30%	0.297	33%	0.334	S	S	.	.	H	α-helix	trans	-59.4	-51.1	174.1	-70.3	168.4	0	0	0	110.2	K236 K242 C243 Q244	K236-I240 HydrophobicContact CG-CD1 3.7Å; K236-I240 HydrophobicContact CG-CG1 4.45Å; K236-I240 WeakPolarHBondContact O-CB 3.23Å; K236-I240 VanDerWaalsContact O-CG1 3.24Å; K236-I240 WeakPolarHBondContact O-CG1 3.36Å; K236-I240 PolarHBondContact O-N 3.24Å; I240-K242 VanDerWaalsContact C-N 3.32Å; I240-K242 PolarHBondContact O-N 3.18Å; I240-C243 WeakPolarHBondContact O-CB 3.1Å; I240-C243 PolarHBondContact O-N 3.29Å; I240-C243 VanDerWaalsContact O-N 3.08Å; I240-Q244 HydrophobicContact CG2-CG 4.28Å; I240-Q244 WeakPolarHBondContact O-CG 3.37Å; I240-Q244 PolarHBondContact O-N 3.15Å
241	R	90.8	Very high	90.5	Very high	128 Å²	128	60.5 Å²	60.5	48%	0.483	31%	0.314	S	S	.	.	H	α-helix	trans	-56.5	-45.6	177.6	179.4	176.5	60.4	154.2	-4.9	111.9	A237 N238 C243 Q244 Q245	A237-R241 WeakPolarHBondContact O-CB 3.24Å; A237-R241 PolarHBondContact O-N 3.4Å; N238-R241 PolarHBondContact OD1-NH2 2.73Å; R241-C243 VanDerWaalsContact C-N 3.32Å; R241-C243 PolarHBondContact O-N 2.93Å; R241-Q244 PolarHBondContact O-N 3.37Å; R241-Q245 HydrophobicContact CG-CG 4.44Å; R241-Q245 WeakPolarHBondContact O-CB 3.34Å; R241-Q245 VanDerWaalsContact O-CG 3.23Å; R241-Q245 WeakPolarHBondContact O-CG 3.42Å; R241-Q245 PolarHBondContact O-N 2.94Å
242	K	89.1	Confident	91.1	Very high	73 Å²	73	59.9 Å²	59.9	32%	0.317	31%	0.309	S	S	.	.	H	α-helix	trans	-62.3	-39.8	177.1	-73.3	168	-172.3	172.1	0	112	N238 Q239 I240 S246	N238-K242 VanDerWaalsContact O-CG 3.24Å; N238-K242 WeakPolarHBondContact O-CG 3.42Å; N238-K242 PolarHBondContact O-N 3.33Å; N238-K242 VanDerWaalsContact O-N 3.07Å; Q239-K242 PolarHBondContact O-N 3.25Å; I240-K242 VanDerWaalsContact C-N 3.32Å; I240-K242 PolarHBondContact O-N 3.18Å; K242-S246 WeakPolarHBondContact O-CB 3.47Å; K242-S246 PolarHBondContact O-OG 3.45Å
243	C	89.1	Confident	91.6	Very high	8 Å²	8	56.5 Å²	56.5	5%	0.054	29%	0.285	C	S	.	.	H	α-helix	trans	-64.4	-52.1	178.3	-168.7	0	0	0	0	110.7	T224 Q239 I240 R241 Q245 S246 S248 A249	T224-C243 PolarHBondContact O-SG 3.22Å; Q239-C243 WeakPolarHBondContact O-CB 3.33Å; Q239-C243 PolarHBondContact O-N 3.4Å; I240-C243 WeakPolarHBondContact O-CB 3.1Å; I240-C243 PolarHBondContact O-N 3.29Å; I240-C243 VanDerWaalsContact O-N 3.08Å; R241-C243 VanDerWaalsContact C-N 3.32Å; R241-C243 PolarHBondContact O-N 2.93Å; C243-Q245 VanDerWaalsContact C-N 3.28Å; C243-Q245 PolarHBondContact O-N 3.06Å; C243-S246 PolarHBondContact O-N 3.27Å; C243-S246 VanDerWaalsContact O-N 3.09Å; C243-S246 VanDerWaalsContact O-O 3.14Å; C243-S246 PolarHBondContact O-OG 3.43Å; C243-S248 WeakPolarHBondContact SG-CB 3.3Å; C243-A249 WeakPolarHBondContact O-CB 3.5Å; C243-A249 PolarHBondContact O-N 2.88Å
244	Q	90	Very high	91.9	Very high	138 Å²	138	50.8 Å²	50.8	65%	0.645	26%	0.258	S	S	*	.	H	α-helix	trans	-60.7	-33.6	-179.3	-71.8	174.9	-18.2	0	0	113.6	I240 R241 S246	I240-Q244 HydrophobicContact CG2-CG 4.28Å; I240-Q244 WeakPolarHBondContact O-CG 3.37Å; I240-Q244 PolarHBondContact O-N 3.15Å; R241-Q244 PolarHBondContact O-N 3.37Å; Q244-S246 PolarHBondContact O-N 2.9Å
245	Q	90.1	Very high	92.3	Very high	133 Å²	133	45.2 Å²	45.2	62%	0.621	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.4	3.6	179.6	-70.1	177.9	-15	0	0	113.8	R241 C243	R241-Q245 HydrophobicContact CG-CG 4.44Å; R241-Q245 WeakPolarHBondContact O-CB 3.34Å; R241-Q245 VanDerWaalsContact O-CG 3.23Å; R241-Q245 WeakPolarHBondContact O-CG 3.42Å; R241-Q245 PolarHBondContact O-N 2.94Å; C243-Q245 VanDerWaalsContact C-N 3.28Å; C243-Q245 PolarHBondContact O-N 3.06Å
246	S	93.2	Very high	92.6	Very high	9 Å²	9	44 Å²	44	6%	0.063	23%	0.228	C	C	.	.	S	Bend	trans	-132.2	173.3	-173.8	71.1	0	0	0	0	111.5	K242 C243 Q244 S248 A249 R254	K242-S246 WeakPolarHBondContact O-CB 3.47Å; K242-S246 PolarHBondContact O-OG 3.45Å; C243-S246 PolarHBondContact O-N 3.27Å; C243-S246 VanDerWaalsContact O-N 3.09Å; C243-S246 VanDerWaalsContact O-O 3.14Å; C243-S246 PolarHBondContact O-OG 3.43Å; Q244-S246 PolarHBondContact O-N 2.9Å; S246-S248 PolarHBondContact O-N 2.76Å; S246-S248 VanDerWaalsContact O-N 3.12Å; S246-S248 WeakPolarHBondContact OG-CB 3.45Å; S246-S248 PolarHBondContact OG-N 2.86Å; S246-S248 PolarHBondContact OG-OG 3.36Å; S246-A249 PolarHBondContact O-N 2.59Å; S246-R254 PolarHBondContact OG-NH1 3.1Å
247	T	94.9	Very high	92.7	Very high	4 Å²	4	40.9 Å²	40.9	3%	0.025	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-18.6	173.9	55	0	0	0	0	113.8	A249 V250 I251 V253 R254 L279 S280 F284	T247-A249 PolarHBondContact O-N 2.69Å; T247-V250 PolarHBondContact O-N 3.05Å; T247-I251 VanDerWaalsContact O-CG1 3.23Å; T247-I251 WeakPolarHBondContact O-CG1 3.31Å; T247-I251 PolarHBondContact O-N 2.79Å; T247-V253 CarbonylContact C-O 3.59Å; T247-V253 VanDerWaalsContact C-O 3.31Å; T247-V253 VanDerWaalsContact CB-O 3.31Å; T247-V253 WeakPolarHBondContact CB-O 3.35Å; T247-V253 PolarHBondContact OG1-O 3.18Å; T247-R254 VanDerWaalsContact OG1-CA 3.32Å; T247-R254 WeakPolarHBondContact OG1-CA 3.5Å; T247-R254 WeakPolarHBondContact OG1-CB 3.31Å; T247-L279 WeakPolarHBondContact CG2-O 3.32Å; T247-S280 WeakPolarHBondContact CG2-O 3.38Å; T247-F284 HydrophobicContact CG2-CB 4.07Å
248	S	95.1	Very high	92.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-55.7	-35.4	177.7	-61.5	0	0	0	0	113.3	Q226 C243 S246 V250 G252 V253 R254	Q226-S248 PolarHBondContact NE2-OG 2.8Å; Q226-S248 VanDerWaalsContact NE2-OG 3.1Å; C243-S248 WeakPolarHBondContact SG-CB 3.3Å; S246-S248 PolarHBondContact O-N 2.76Å; S246-S248 VanDerWaalsContact O-N 3.12Å; S246-S248 WeakPolarHBondContact OG-CB 3.45Å; S246-S248 PolarHBondContact OG-N 2.86Å; S246-S248 PolarHBondContact OG-OG 3.36Å; S248-V250 VanDerWaalsContact C-N 3.34Å; S248-G252 VanDerWaalsContact O-CA 3.24Å; S248-G252 WeakPolarHBondContact O-CA 3.25Å; S248-G252 PolarHBondContact O-N 2.9Å; S248-G252 VanDerWaalsContact O-N 3.11Å; S248-V253 PolarHBondContact N-O 2.87Å; S248-R254 WeakPolarHBondContact OG-CD 3.29Å; S248-R254 VanDerWaalsContact OG-CG 3.28Å; S248-R254 WeakPolarHBondContact OG-CG 3.35Å; S248-R254 PolarHBondContact OG-NH1 3.11Å
249	A	93.8	Very high	93.2	Very high	48 Å²	48	36.2 Å²	36.2	40%	0.397	18%	0.182	S	C	.	.	H	α-helix	trans	-71.5	-28.2	179.5	0	0	0	0	0	113.4	C243 S246 T247	C243-A249 WeakPolarHBondContact O-CB 3.5Å; C243-A249 PolarHBondContact O-N 2.88Å; S246-A249 PolarHBondContact O-N 2.59Å; T247-A249 PolarHBondContact O-N 2.69Å
250	V	95.8	Very high	93.5	Very high	97 Å²	97	35.4 Å²	35.4	59%	0.588	18%	0.178	S	C	*	.	H	α-helix	trans	-97.8	-46.5	-173.1	-175.9	0	0	0	0	111.5	T247 S248 V281 F406	T247-V250 PolarHBondContact O-N 3.05Å; S248-V250 VanDerWaalsContact C-N 3.34Å; V250-V281 HydrophobicContact CB-CG2 4.4Å; V250-V281 HydrophobicContact CG1-CG2 4.08Å; V250-F406 WeakPolarHBondContact O-CE1 3.41Å
251	I	97	Very high	93.6	Very high	11 Å²	11	34.5 Å²	34.5	6%	0.056	17%	0.171	C	C	.	.	H	α-helix	trans	-118.2	4.3	-173.1	61.6	167.6	0	0	0	113.2	T247 V253 V281 F284 N410 I414	T247-I251 VanDerWaalsContact O-CG1 3.23Å; T247-I251 WeakPolarHBondContact O-CG1 3.31Å; T247-I251 PolarHBondContact O-N 2.79Å; I251-V253 HydrophobicContact CD1-CG1 3.69Å; I251-V253 HydrophobicContact CG1-CG1 3.88Å; I251-V253 PolarHBondContact O-N 2.93Å; I251-V281 HydrophobicContact CG2-CG1 4.22Å; I251-V281 HydrophobicContact CG2-CG2 4.02Å; I251-F284 HydrophobicContact CD1-CD1 3.72Å; I251-F284 HydrophobicContact CD1-CE1 4Å; I251-F284 HydrophobicContact CD1-CG 4.07Å; I251-N410 HydrophobicContact CB-CB 4.16Å; I251-N410 WeakPolarHBondContact O-CB 3.44Å; I251-N410 PolarHBondContact O-ND2 2.91Å; I251-I414 HydrophobicContact CD1-CD1 4.05Å
252	G	96.9	Very high	93.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.152	C	C	.	.	S	Bend	trans	70.8	10.2	176.8	0	0	0	0	0	115.2	M222 G223 S248 G407	M222-G252 CarbonylContact C-O 3.48Å; G223-G252 CarbonylContact C-O 3.46Å; G223-G252 PolarHBondContact N-O 3.31Å; S248-G252 VanDerWaalsContact O-CA 3.24Å; S248-G252 WeakPolarHBondContact O-CA 3.25Å; S248-G252 PolarHBondContact O-N 2.9Å; S248-G252 VanDerWaalsContact O-N 3.11Å; G252-G407 WeakPolarHBondContact O-CA 3.49Å
253	V	97.7	Very high	93.6	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	148.9	179.8	61.8	0	0	0	0	111.2	L220 K221 M222 T247 S248 I251 F284	L220-V253 HydrophobicContact CB-CG2 3.89Å; L220-V253 HydrophobicContact CD1-CG2 4.21Å; L220-V253 HydrophobicContact CD2-CG2 4.36Å; L220-V253 HydrophobicContact CG-CG2 4.38Å; K221-V253 WeakPolarHBondContact O-CA 3.42Å; M222-V253 HydrophobicContact CE-CG2 4.44Å; M222-V253 HydrophobicContact SD-CB 4.17Å; M222-V253 HydrophobicContact SD-CG2 3.6Å; M222-V253 VanDerWaalsContact SD-CG2 3.6Å; T247-V253 CarbonylContact C-O 3.59Å; T247-V253 VanDerWaalsContact C-O 3.31Å; T247-V253 VanDerWaalsContact CB-O 3.31Å; T247-V253 WeakPolarHBondContact CB-O 3.35Å; T247-V253 PolarHBondContact OG1-O 3.18Å; S248-V253 PolarHBondContact N-O 2.87Å; I251-V253 HydrophobicContact CD1-CG1 3.69Å; I251-V253 HydrophobicContact CG1-CG1 3.88Å; I251-V253 PolarHBondContact O-N 2.93Å; V253-F284 HydrophobicContact CB-CZ 4.38Å; V253-F284 HydrophobicContact CG1-CE1 3.96Å; V253-F284 HydrophobicContact CG1-CE2 4.25Å; V253-F284 HydrophobicContact CG1-CZ 3.63Å; V253-F284 HydrophobicContact CG2-CE2 4.17Å; V253-F284 HydrophobicContact CG2-CZ 3.87Å
254	R	96.6	Very high	93.4	Very high	14 Å²	14	28.8 Å²	28.8	5%	0.053	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	158.1	169.4	71.3	173.1	177.8	-106.5	-8.5	112.4	L220 K221 Q226 S246 T247 S248 C256	L220-R254 CarbonylContact C-O 3.51Å; L220-R254 WeakPolarHBondContact CA-O 3.32Å; K221-R254 HydrophobicContact CB-CG 4.01Å; K221-R254 PolarHBondContact N-O 3.46Å; K221-R254 PolarHBondContact O-N 2.75Å; K221-R254 VanDerWaalsContact O-N 3.11Å; Q226-R254 VanDerWaalsContact NE2-CZ 3.35Å; S246-R254 PolarHBondContact OG-NH1 3.1Å; T247-R254 VanDerWaalsContact OG1-CA 3.32Å; T247-R254 WeakPolarHBondContact OG1-CA 3.5Å; T247-R254 WeakPolarHBondContact OG1-CB 3.31Å; S248-R254 WeakPolarHBondContact OG-CD 3.29Å; S248-R254 VanDerWaalsContact OG-CG 3.28Å; S248-R254 WeakPolarHBondContact OG-CG 3.35Å; S248-R254 PolarHBondContact OG-NH1 3.11Å; R254-C256 PolarHBondContact O-N 2.64Å
255	V	96	Very high	93.2	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	126.7	172.3	-177.5	0	0	0	0	110.6	L218 L220 M271 G276 L279 F284 A287	L218-V255 HydrophobicContact CD1-CG1 4.13Å; L218-V255 HydrophobicContact CD1-CG2 4.43Å; L220-V255 HydrophobicContact CD2-CG2 4.06Å; V255-M271 HydrophobicContact CG1-SD 3.97Å; V255-G276 WeakPolarHBondContact O-CA 3.23Å; V255-L279 HydrophobicContact CB-CD1 4.37Å; V255-L279 HydrophobicContact CG2-CD1 4.17Å; V255-F284 HydrophobicContact CG2-CD2 3.79Å; V255-F284 HydrophobicContact CG2-CE2 3.76Å; V255-A287 HydrophobicContact CG2-CB 4.16Å
256	C	92.7	Very high	93	Very high	16 Å²	16	20.6 Å²	20.6	11%	0.108	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-23.5	175	-104.2	0	0	0	0	112.7	D219 K221 R254 K273	D219-C256 HydrophobicContact CB-CB 4.42Å; D219-C256 WeakPolarHBondContact O-CA 3.42Å; D219-C256 WeakPolarHBondContact O-CB 3.42Å; D219-C256 PolarHBondContact O-N 3.37Å; K221-C256 HydrophobicContact CB-CB 4.45Å; R254-C256 PolarHBondContact O-N 2.64Å; C256-K273 VanDerWaalsContact O-CA 3.27Å; C256-K273 WeakPolarHBondContact O-CA 3.22Å; C256-K273 VanDerWaalsContact O-CB 3.22Å; C256-K273 WeakPolarHBondContact O-CB 3.36Å; C256-K273 PolarHBondContact O-N 3.41Å
257	G	92.4	Very high	92.7	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.5	149.5	175.1	0	0	0	0	0	110.7	V26 D219 M271	V26-G257 VanDerWaalsContact O-CA 3.29Å; V26-G257 WeakPolarHBondContact O-CA 3.28Å; D219-G257 PolarHBondContact N-O 3.02Å; D219-G257 PolarHBondContact O-N 3.2Å; G257-M271 CarbonylContact C-O 3.55Å; G257-M271 WeakPolarHBondContact CA-O 3.24Å
258	M	93.8	Very high	92.3	Very high	2 Å²	2	23.1 Å²	23.1	1%	0.01	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	138.5	177.5	-172.9	172.3	67.6	0	0	110.2	V217 L218 V260 F270 M271 Q290 F291	V217-M258 CarbonylContact O-C 3.5Å; V217-M258 WeakPolarHBondContact O-CA 3.29Å; L218-M258 HydrophobicContact CD1-CB 4.08Å; L218-M258 HydrophobicContact CD1-CG 4.1Å; L218-M258 HydrophobicContact CD1-SD 4.24Å; M258-V260 HydrophobicContact CE-CG2 4.5Å; M258-V260 HydrophobicContact CG-CG2 3.71Å; M258-V260 HydrophobicContact SD-CG2 3.97Å; M258-F270 VanDerWaalsContact O-CA 3.32Å; M258-F270 WeakPolarHBondContact O-CA 3.37Å; M258-M271 HydrophobicContact CB-CB 3.88Å; M258-M271 HydrophobicContact CE-CB 3.84Å; M258-M271 HydrophobicContact CE-CE 3.67Å; M258-M271 HydrophobicContact CE-SD 4.18Å; M258-M271 PolarHBondContact N-O 3.35Å; M258-M271 PolarHBondContact O-N 2.96Å; M258-Q290 HydrophobicContact CE-CB 4.43Å; M258-F291 HydrophobicContact CG-CD2 3.95Å; M258-F291 HydrophobicContact SD-CB 3.74Å; M258-F291 HydrophobicContact SD-CD2 4.15Å; M258-F291 HydrophobicContact SD-CG 4.4Å
259	Q	93.4	Very high	92	Very high	4 Å²	4	23.6 Å²	23.6	2%	0.019	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	123.6	169.3	174.5	-178.5	-61.3	0	0	107.9	V26 P215 C216 V217 L268 M269 F270	V26-Q259 HydrophobicContact CG1-CB 3.47Å; V26-Q259 VanDerWaalsContact CG1-CB 3.47Å; P215-Q259 PolarHBondContact O-NE2 2.97Å; C216-Q259 CarbonylContact C-O 3.58Å; C216-Q259 VanDerWaalsContact CA-O 3.25Å; C216-Q259 WeakPolarHBondContact CA-O 2.96Å; V217-Q259 PolarHBondContact N-O 2.92Å; V217-Q259 PolarHBondContact O-N 3.38Å; Q259-L268 HydrophobicContact CG-CD2 4.03Å; Q259-M269 CarbonylContact C-O 3.5Å; Q259-M269 WeakPolarHBondContact CA-O 3.31Å; Q259-F270 HydrophobicContact CB-CD1 3.96Å; Q259-F270 HydrophobicContact CB-CE1 3.79Å; Q259-F270 HydrophobicContact CG-CD1 4.12Å; Q259-F270 HydrophobicContact CG-CE1 3.53Å; Q259-F270 HydrophobicContact CG-CZ 3.93Å
260	V	94.3	Very high	91.8	Very high	0 Å²	0	22 Å²	22	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	131.6	-178.1	-177.1	0	0	0	0	109.9	M258 L268 M269 F291	M258-V260 HydrophobicContact CE-CG2 4.5Å; M258-V260 HydrophobicContact CG-CG2 3.71Å; M258-V260 HydrophobicContact SD-CG2 3.97Å; V260-L268 CarbonylContact O-C 3.57Å; V260-L268 WeakPolarHBondContact O-CA 3.28Å; V260-M269 HydrophobicContact CB-CB 4.38Å; V260-M269 PolarHBondContact N-O 3.46Å; V260-M269 PolarHBondContact O-N 3.32Å; V260-F291 HydrophobicContact CG2-CB 4.49Å; V260-F291 HydrophobicContact CG2-CD2 3.69Å; V260-F291 HydrophobicContact CG2-CE2 4.44Å
261	Y	93.8	Very high	91.4	Very high	39 Å²	39	17.8 Å²	17.8	15%	0.153	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	122.1	172.4	-177.6	-112.8	0	0	0	111.7	V162 V214 C216 A263 L268	V162-Y261 HydrophobicContact CB-CE2 4.38Å; V162-Y261 HydrophobicContact CG2-CD2 4.24Å; V162-Y261 HydrophobicContact CG2-CE2 3.84Å; V214-Y261 HydrophobicContact CG1-CD1 4.36Å; V214-Y261 HydrophobicContact CG1-CD2 3.69Å; V214-Y261 HydrophobicContact CG1-CE2 4.35Å; V214-Y261 HydrophobicContact CG1-CG 3.68Å; C216-Y261 PolarHBondContact SG-N 3.43Å; Y261-A263 HydrophobicContact CD1-CB 4.38Å; Y261-A263 HydrophobicContact CE1-CB 4.05Å; Y261-A263 PolarHBondContact O-N 3Å; Y261-L268 HydrophobicContact CD2-CD2 4.11Å
262	Q	91	Very high	90.9	Very high	18 Å²	18	19.5 Å²	19.5	8%	0.084	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	90.5	176	-60.8	-68.4	-34.4	0	0	108.7	Y159 G264 T265 G266 Q267 M269 N294 G295	Y159-Q262 HydrophobicContact CE1-CG 4.35Å; Q262-G264 PolarHBondContact O-N 3.04Å; Q262-G264 VanDerWaalsContact O-N 3.15Å; Q262-T265 PolarHBondContact O-N 3.44Å; Q262-T265 VanDerWaalsContact O-N 3.12Å; Q262-G266 WeakPolarHBondContact O-CA 2.99Å; Q262-G266 PolarHBondContact O-N 3.46Å; Q262-Q267 WeakPolarHBondContact CA-O 3.34Å; Q262-Q267 VanDerWaalsContact CB-O 3.31Å; Q262-Q267 WeakPolarHBondContact CB-O 3.37Å; Q262-Q267 PolarHBondContact N-O 3Å; Q262-Q267 PolarHBondContact O-N 3.08Å; Q262-M269 HydrophobicContact CG-CB 4.05Å; Q262-N294 CarbonylContact C-O 3.58Å; Q262-N294 VanDerWaalsContact C-O 3.31Å; Q262-N294 VanDerWaalsContact CA-O 3.31Å; Q262-N294 WeakPolarHBondContact CA-O 3.17Å; Q262-G295 VanDerWaalsContact OE1-N 3.12Å
263	A	89	Confident	90.4	Very high	28 Å²	28	20.3 Å²	20.3	23%	0.231	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-23.5	177.8	0	0	0	0	0	113.8	Y261 N294 K296	Y261-A263 HydrophobicContact CD1-CB 4.38Å; Y261-A263 HydrophobicContact CE1-CB 4.05Å; Y261-A263 PolarHBondContact O-N 3Å; A263-N294 HydrophobicContact CB-CB 4.22Å; A263-N294 PolarHBondContact N-O 3.07Å; A263-K296 WeakPolarHBondContact O-CE 3.46Å
264	G	83.3	Confident	90	Very high	44 Å²	44	25.2 Å²	25.2	45%	0.454	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-45.5	172.6	0	0	0	0	0	113.4	Q262 K296	Q262-G264 PolarHBondContact O-N 3.04Å; Q262-G264 VanDerWaalsContact O-N 3.15Å; G264-K296 VanDerWaalsContact CA-CE 3.48Å
265	T	85.9	Confident	89.6	Confident	84 Å²	84	27.2 Å²	27.2	52%	0.515	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-9.2	-174.4	56.9	0	0	0	0	113.1	Q262 Q267	Q262-T265 PolarHBondContact O-N 3.44Å; Q262-T265 VanDerWaalsContact O-N 3.12Å; T265-Q267 WeakPolarHBondContact OG1-CB 3.05Å; T265-Q267 WeakPolarHBondContact OG1-CG 3.41Å; T265-Q267 PolarHBondContact OG1-N 2.92Å
266	G	85.5	Confident	89.3	Confident	14 Å²	14	27.2 Å²	27.2	14%	0.144	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	28	-169.1	0	0	0	0	0	112.2	V162 Q262	V162-G266 VanDerWaalsContact CB-O 3.31Å; V162-G266 WeakPolarHBondContact CB-O 3.21Å; V162-G266 WeakPolarHBondContact CG2-O 3.35Å; V162-G266 PolarHBondContact N-O 2.95Å; Q262-G266 WeakPolarHBondContact O-CA 2.99Å; Q262-G266 PolarHBondContact O-N 3.46Å
267	Q	87.1	Confident	89.2	Confident	47 Å²	47	29 Å²	29	22%	0.22	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	151.7	-174.9	-63.1	-179.1	-33.5	0	0	113.5	Y160 T161 Q262 T265	Y160-Q267 CarbonylContact O-C 3.33Å; Y160-Q267 WeakPolarHBondContact O-CA 3.35Å; Y160-Q267 VanDerWaalsContact O-CB 3.28Å; Y160-Q267 WeakPolarHBondContact O-CB 3.43Å; T161-Q267 PolarHBondContact OG1-NE2 3.15Å; T161-Q267 VanDerWaalsContact OG1-NE2 3.08Å; Q262-Q267 WeakPolarHBondContact CA-O 3.34Å; Q262-Q267 VanDerWaalsContact CB-O 3.31Å; Q262-Q267 WeakPolarHBondContact CB-O 3.37Å; Q262-Q267 PolarHBondContact N-O 3Å; Q262-Q267 PolarHBondContact O-N 3.08Å; T265-Q267 WeakPolarHBondContact OG1-CB 3.05Å; T265-Q267 WeakPolarHBondContact OG1-CG 3.41Å; T265-Q267 PolarHBondContact OG1-N 2.92Å
268	L	86.9	Confident	89.2	Confident	19 Å²	19	37.3 Å²	37.3	10%	0.099	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	125.3	167.6	-69.7	170.9	0	0	0	110.3	Y159 Y160 V162 V214 Q259 V260 Y261 F270	Y159-L268 CarbonylContact C-O 3.55Å; Y159-L268 VanDerWaalsContact CA-O 3.31Å; Y159-L268 WeakPolarHBondContact CA-O 3.42Å; Y160-L268 PolarHBondContact N-O 3.39Å; Y160-L268 PolarHBondContact O-N 2.86Å; V162-L268 HydrophobicContact CG2-CG 4.31Å; V214-L268 HydrophobicContact CG1-CD2 4.19Å; Q259-L268 HydrophobicContact CG-CD2 4.03Å; V260-L268 CarbonylContact O-C 3.57Å; V260-L268 WeakPolarHBondContact O-CA 3.28Å; Y261-L268 HydrophobicContact CD2-CD2 4.11Å; L268-F270 HydrophobicContact CB-CD2 4.32Å; L268-F270 HydrophobicContact CB-CE2 3.5Å; L268-F270 VanDerWaalsContact CB-CE2 3.5Å; L268-F270 HydrophobicContact CB-CZ 3.88Å; L268-F270 HydrophobicContact CD1-CE2 4.43Å; L268-F270 HydrophobicContact CD1-CZ 4.09Å
269	M	89.6	Confident	89.2	Confident	11 Å²	11	38.3 Å²	38.3	5%	0.054	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	131.9	172.9	-174	-160.3	-103.9	0	0	109.6	V157 L158 Y159 Q259 V260 Q262	V157-M269 HydrophobicContact CG1-CB 4.46Å; V157-M269 HydrophobicContact CG1-CE 3.92Å; V157-M269 HydrophobicContact CG1-CG 3.15Å; V157-M269 HydrophobicContact CG1-SD 3.91Å; L158-M269 WeakPolarHBondContact O-CA 3.48Å; Y159-M269 HydrophobicContact CD1-CB 4.45Å; Y159-M269 HydrophobicContact CE1-CB 4.35Å; Y159-M269 HydrophobicContact CE1-CE 3.89Å; Y159-M269 HydrophobicContact CE1-CG 4.2Å; Y159-M269 WeakPolarHBondContact OH-CE 3.48Å; Q259-M269 CarbonylContact C-O 3.5Å; Q259-M269 WeakPolarHBondContact CA-O 3.31Å; V260-M269 HydrophobicContact CB-CB 4.38Å; V260-M269 PolarHBondContact N-O 3.46Å; V260-M269 PolarHBondContact O-N 3.32Å; Q262-M269 HydrophobicContact CG-CB 4.05Å
270	F	88.5	Confident	89.3	Confident	14 Å²	14	41.6 Å²	41.6	6%	0.061	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	140.5	179.1	-65.5	-89.7	0	0	0	113.4	L158 Y160 N176 M258 Q259 L268	L158-F270 PolarHBondContact O-N 3.12Å; Y160-F270 AromaticContact CD2-CD2 3.52Å; Y160-F270 HydrophobicContact CD2-CD2 3.52Å; Y160-F270 AromaticContact CD2-CE2 3.41Å; Y160-F270 HydrophobicContact CD2-CE2 3.41Å; Y160-F270 VanDerWaalsContact CD2-CE2 3.41Å; Y160-F270 AromaticContact CE2-CD2 3.73Å; Y160-F270 HydrophobicContact CE2-CD2 3.73Å; Y160-F270 AromaticContact CE2-CE2 3.93Å; Y160-F270 HydrophobicContact CE2-CE2 3.93Å; Y160-F270 HydrophobicContact CG-CE2 4.32Å; N176-F270 HydrophobicContact CB-CD1 4.13Å; N176-F270 HydrophobicContact CB-CE1 3.62Å; N176-F270 HydrophobicContact CB-CZ 4.21Å; M258-F270 VanDerWaalsContact O-CA 3.32Å; M258-F270 WeakPolarHBondContact O-CA 3.37Å; Q259-F270 HydrophobicContact CB-CD1 3.96Å; Q259-F270 HydrophobicContact CB-CE1 3.79Å; Q259-F270 HydrophobicContact CG-CD1 4.12Å; Q259-F270 HydrophobicContact CG-CE1 3.53Å; Q259-F270 HydrophobicContact CG-CZ 3.93Å; L268-F270 HydrophobicContact CB-CD2 4.32Å; L268-F270 HydrophobicContact CB-CE2 3.5Å; L268-F270 VanDerWaalsContact CB-CE2 3.5Å; L268-F270 HydrophobicContact CB-CZ 3.88Å; L268-F270 HydrophobicContact CD1-CE2 4.43Å; L268-F270 HydrophobicContact CD1-CZ 4.09Å
271	M	88.8	Confident	89.4	Confident	9 Å²	9	44 Å²	44	4%	0.044	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	130.1	167.4	-171.2	-172.3	-75.6	0	0	109.8	V255 G257 M258 H275 L279 A287	V255-M271 HydrophobicContact CG1-SD 3.97Å; G257-M271 CarbonylContact C-O 3.55Å; G257-M271 WeakPolarHBondContact CA-O 3.24Å; M258-M271 HydrophobicContact CB-CB 3.88Å; M258-M271 HydrophobicContact CE-CB 3.84Å; M258-M271 HydrophobicContact CE-CE 3.67Å; M258-M271 HydrophobicContact CE-SD 4.18Å; M258-M271 PolarHBondContact N-O 3.35Å; M258-M271 PolarHBondContact O-N 2.96Å; M271-H275 HydrophobicContact CG-CB 3.89Å; M271-H275 VanDerWaalsContact CG-CD2 3.48Å; M271-H275 WeakPolarHBondContact CG-CD2 3.43Å; M271-H275 PolarHBondContact SD-CD2 3.19Å; M271-L279 HydrophobicContact SD-CD1 4.18Å; M271-A287 HydrophobicContact CE-CB 3.98Å; M271-A287 HydrophobicContact SD-CB 4.28Å
272	N	86.8	Confident	89.4	Confident	47 Å²	47	47.1 Å²	47.1	25%	0.251	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	167.8	-179	68.4	47.7	0	0	0	112.3	Y274 H275 G276	N272-Y274 PolarHBondContact O-N 2.92Å; N272-Y274 VanDerWaalsContact O-N 3.11Å; N272-Y274 WeakPolarHBondContact OD1-CA 3.46Å; N272-Y274 VanDerWaalsContact OD1-CB 3.32Å; N272-Y274 WeakPolarHBondContact OD1-CB 3.5Å; N272-Y274 PolarHBondContact OD1-N 3.34Å; N272-H275 PolarHBondContact O-N 2.89Å; N272-H275 VanDerWaalsContact O-N 3.15Å; N272-H275 PolarHBondContact OD1-N 3.04Å; N272-G276 PolarHBondContact O-N 2.94Å
273	K	86.1	Confident	89.7	Confident	16 Å²	16	46.6 Å²	46.6	7%	0.07	25%	0.251	C	S	.	.	H	α-helix	trans	-56.5	-25.8	177.4	67.4	-176.8	-178.6	-165.5	0	115.6	H29 W178 C256 R277	H29-K273 PolarHBondContact CD2-NZ 3.11Å; H29-K273 PolarHBondContact CE1-NZ 3.34Å; H29-K273 PolarHBondContact NE2-NZ 3.12Å; W178-K273 HydrophobicContact CH2-CD 4.19Å; W178-K273 HydrophobicContact CZ2-CD 3.92Å; W178-K273 VanDerWaalsContact CZ2-CE 3.48Å; W178-K273 HydrophobicContact CZ2-CG 4.48Å; W178-K273 VanDerWaalsContact CZ2-NZ 3.34Å; C256-K273 VanDerWaalsContact O-CA 3.27Å; C256-K273 WeakPolarHBondContact O-CA 3.22Å; C256-K273 VanDerWaalsContact O-CB 3.22Å; C256-K273 WeakPolarHBondContact O-CB 3.36Å; C256-K273 PolarHBondContact O-N 3.41Å; K273-R277 WeakPolarHBondContact O-CB 3.43Å; K273-R277 VanDerWaalsContact O-CG 3.28Å; K273-R277 WeakPolarHBondContact O-CG 3.24Å; K273-R277 PolarHBondContact O-N 3.04Å; K273-R277 PolarHBondContact O-NH1 3.47Å; K273-R277 VanDerWaalsContact O-NH1 3.1Å
274	Y	88.3	Confident	90	Very high	103 Å²	103	45.3 Å²	45.3	40%	0.404	24%	0.24	S	C	.	.	H	α-helix	trans	-76.3	-38.5	-179.1	-59.4	-96.1	0	0	0	110.4	N272 K278	N272-Y274 PolarHBondContact O-N 2.92Å; N272-Y274 VanDerWaalsContact O-N 3.11Å; N272-Y274 WeakPolarHBondContact OD1-CA 3.46Å; N272-Y274 VanDerWaalsContact OD1-CB 3.32Å; N272-Y274 WeakPolarHBondContact OD1-CB 3.5Å; N272-Y274 PolarHBondContact OD1-N 3.34Å; Y274-K278 WeakPolarHBondContact O-CG 3.49Å
275	H	87.6	Confident	90.7	Very high	56 Å²	56	45 Å²	45	26%	0.259	23%	0.226	S	C	.	.	H	α-helix	trans	-67.1	-50.8	171.2	-171.2	93	0	0	0	110.4	M271 N272 R277 K278	M271-H275 HydrophobicContact CG-CB 3.89Å; M271-H275 VanDerWaalsContact CG-CD2 3.48Å; M271-H275 WeakPolarHBondContact CG-CD2 3.43Å; M271-H275 PolarHBondContact SD-CD2 3.19Å; N272-H275 PolarHBondContact O-N 2.89Å; N272-H275 VanDerWaalsContact O-N 3.15Å; N272-H275 PolarHBondContact OD1-N 3.04Å; H275-R277 PolarHBondContact O-N 3.3Å; H275-R277 VanDerWaalsContact O-N 3.09Å; H275-K278 PolarHBondContact O-N 2.86Å
276	G	91.3	Very high	91.1	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-56.5	-30.3	179.4	0	0	0	0	0	114.6	V255 N272	V255-G276 WeakPolarHBondContact O-CA 3.23Å; N272-G276 PolarHBondContact O-N 2.94Å
277	R	90.3	Very high	91.7	Very high	54 Å²	54	45.1 Å²	45.1	20%	0.204	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-23.8	174.3	-81	-168.3	-56.2	-86.2	3.8	114.7	K273 H275	K273-R277 WeakPolarHBondContact O-CB 3.43Å; K273-R277 VanDerWaalsContact O-CG 3.28Å; K273-R277 WeakPolarHBondContact O-CG 3.24Å; K273-R277 PolarHBondContact O-N 3.04Å; K273-R277 PolarHBondContact O-NH1 3.47Å; K273-R277 VanDerWaalsContact O-NH1 3.1Å; H275-R277 PolarHBondContact O-N 3.3Å; H275-R277 VanDerWaalsContact O-N 3.09Å
278	K	91.9	Very high	92.2	Very high	175 Å²	175	42.9 Å²	42.9	76%	0.761	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	-9	-178.9	-66.2	175.2	-177.7	-179.2	0	112.8	Y274 H275	Y274-K278 WeakPolarHBondContact O-CG 3.49Å; H275-K278 PolarHBondContact O-N 2.86Å
279	L	93.6	Very high	92.6	Very high	23 Å²	23	46.7 Å²	46.7	12%	0.12	22%	0.221	C	C	.	.			trans	-66	138.5	-177.2	-62.5	178.6	0	0	0	110.8	T247 V255 M271 A287	T247-L279 WeakPolarHBondContact CG2-O 3.32Å; V255-L279 HydrophobicContact CB-CD1 4.37Å; V255-L279 HydrophobicContact CG2-CD1 4.17Å; M271-L279 HydrophobicContact SD-CD1 4.18Å; L279-A287 HydrophobicContact CD1-CB 3.91Å
280	S	96.2	Very high	92.9	Very high	72 Å²	72	49.1 Å²	49.1	50%	0.503	23%	0.232	S	C	.	.			trans	-77.8	176.1	161.6	66.7	0	0	0	0	109.9	T247 Q282 G283 F284	T247-S280 WeakPolarHBondContact CG2-O 3.38Å; S280-Q282 VanDerWaalsContact C-N 3.25Å; S280-Q282 PolarHBondContact O-N 2.91Å; S280-Q282 PolarHBondContact OG-N 3.35Å; S280-G283 PolarHBondContact O-N 3.39Å; S280-G283 PolarHBondContact OG-N 3.08Å; S280-G283 VanDerWaalsContact OG-N 3.08Å; S280-F284 WeakPolarHBondContact O-CB 3.48Å; S280-F284 PolarHBondContact O-N 3.49Å
281	V	95.7	Very high	93.3	Very high	51 Å²	51	48.5 Å²	48.5	31%	0.309	23%	0.229	S	C	.	.	H	α-helix	trans	-58.2	-41.4	172.7	178.2	0	0	0	0	110.9	V250 I251 F284 K285	V250-V281 HydrophobicContact CB-CG2 4.4Å; V250-V281 HydrophobicContact CG1-CG2 4.08Å; I251-V281 HydrophobicContact CG2-CG1 4.22Å; I251-V281 HydrophobicContact CG2-CG2 4.02Å; V281-F284 WeakPolarHBondContact O-CB 3.22Å; V281-F284 PolarHBondContact O-N 2.84Å; V281-K285 PolarHBondContact O-N 3.49Å; V281-K285 VanDerWaalsContact O-N 3.09Å
282	Q	95	Very high	93.6	Very high	104 Å²	104	48 Å²	48	49%	0.486	23%	0.227	S	C	.	.	H	α-helix	trans	-64.4	-45.4	175	-173	59.5	30.4	0	0	111.8	S280 F284 K285 E286	S280-Q282 VanDerWaalsContact C-N 3.25Å; S280-Q282 PolarHBondContact O-N 2.91Å; S280-Q282 PolarHBondContact OG-N 3.35Å; Q282-F284 PolarHBondContact O-N 2.78Å; Q282-K285 WeakPolarHBondContact O-CB 3.44Å; Q282-K285 PolarHBondContact O-N 3.12Å; Q282-E286 WeakPolarHBondContact O-CG 3.31Å; Q282-E286 PolarHBondContact O-N 2.93Å
283	G	95.5	Very high	94	Very high	8 Å²	8	47.9 Å²	47.9	8%	0.082	23%	0.225	C	C	.	.	H	α-helix	trans	-62.6	-28.8	176	0	0	0	0	0	113.1	S280 A287	S280-G283 PolarHBondContact O-N 3.39Å; S280-G283 PolarHBondContact OG-N 3.08Å; S280-G283 VanDerWaalsContact OG-N 3.08Å; G283-A287 WeakPolarHBondContact O-CB 3.28Å; G283-A287 PolarHBondContact O-N 2.75Å
284	F	97.1	Very high	94.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-68.9	-42	171.8	-179.7	-91.1	0	0	0	112	L220 T247 I251 V253 V255 S280 V281 Q282 E286 A287 L288 L411 I414	L220-F284 HydrophobicContact CD2-CE2 3.98Å; L220-F284 HydrophobicContact CD2-CZ 4.21Å; T247-F284 HydrophobicContact CG2-CB 4.07Å; I251-F284 HydrophobicContact CD1-CD1 3.72Å; I251-F284 HydrophobicContact CD1-CE1 4Å; I251-F284 HydrophobicContact CD1-CG 4.07Å; V253-F284 HydrophobicContact CB-CZ 4.38Å; V253-F284 HydrophobicContact CG1-CE1 3.96Å; V253-F284 HydrophobicContact CG1-CE2 4.25Å; V253-F284 HydrophobicContact CG1-CZ 3.63Å; V253-F284 HydrophobicContact CG2-CE2 4.17Å; V253-F284 HydrophobicContact CG2-CZ 3.87Å; V255-F284 HydrophobicContact CG2-CD2 3.79Å; V255-F284 HydrophobicContact CG2-CE2 3.76Å; S280-F284 WeakPolarHBondContact O-CB 3.48Å; S280-F284 PolarHBondContact O-N 3.49Å; V281-F284 WeakPolarHBondContact O-CB 3.22Å; V281-F284 PolarHBondContact O-N 2.84Å; Q282-F284 PolarHBondContact O-N 2.78Å; F284-E286 VanDerWaalsContact C-N 3.34Å; F284-A287 PolarHBondContact O-N 3.1Å; F284-L288 HydrophobicContact CD1-CD1 4.01Å; F284-L288 HydrophobicContact CD1-CG 4.44Å; F284-L288 HydrophobicContact CE1-CD1 3.42Å; F284-L288 VanDerWaalsContact CE1-CD1 3.42Å; F284-L288 HydrophobicContact CE1-CG 4.04Å; F284-L288 HydrophobicContact CZ-CD1 3.99Å; F284-L288 HydrophobicContact CZ-CD2 4.49Å; F284-L288 HydrophobicContact CZ-CG 4.28Å; F284-L288 PolarHBondContact O-N 2.84Å; F284-L411 HydrophobicContact CE1-CD1 4.28Å; F284-L411 HydrophobicContact CZ-CD1 4.13Å; F284-I414 HydrophobicContact CD1-CD1 4.04Å; F284-I414 HydrophobicContact CE1-CD1 4.05Å
285	K	96.8	Very high	94.3	Very high	37 Å²	37	43.8 Å²	43.8	16%	0.161	22%	0.218	C	C	.	.	H	α-helix	trans	-59.1	-46	172.4	-65.2	-175.4	168.5	-175.2	0	111.3	V281 Q282 A287 L288 Y289 I414 E417	V281-K285 PolarHBondContact O-N 3.49Å; V281-K285 VanDerWaalsContact O-N 3.09Å; Q282-K285 WeakPolarHBondContact O-CB 3.44Å; Q282-K285 PolarHBondContact O-N 3.12Å; K285-A287 VanDerWaalsContact C-N 3.34Å; K285-A287 PolarHBondContact O-N 2.85Å; K285-L288 PolarHBondContact O-N 3.02Å; K285-Y289 PolarHBondContact O-N 3.07Å; K285-I414 HydrophobicContact CB-CG2 4.43Å; K285-I414 HydrophobicContact CG-CG2 3.77Å; K285-E417 WeakPolarHBondContact CE-OE2 3.45Å; K285-E417 IonicContact NZ-OE1 2.75Å; K285-E417 PolarHBondContact NZ-OE1 3.19Å; K285-E417 IonicContact NZ-OE2 3.16Å; K285-E417 PolarHBondContact NZ-OE2 3.11Å
286	E	95.5	Very high	94.4	Very high	100 Å²	100	47.7 Å²	47.7	47%	0.467	23%	0.234	S	C	.	.	H	α-helix	trans	-61.5	-40.6	176.2	-69.9	166.6	-167.4	0	0	112.2	Q282 F284 L288 Y289 Q290	Q282-E286 WeakPolarHBondContact O-CG 3.31Å; Q282-E286 PolarHBondContact O-N 2.93Å; F284-E286 VanDerWaalsContact C-N 3.34Å; E286-L288 VanDerWaalsContact C-N 3.34Å; E286-L288 PolarHBondContact O-N 2.74Å; E286-Y289 WeakPolarHBondContact O-CB 3.29Å; E286-Y289 PolarHBondContact O-N 2.77Å; E286-Q290 WeakPolarHBondContact O-CG 3.2Å; E286-Q290 PolarHBondContact O-N 2.9Å
287	A	96.6	Very high	94.4	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.008	25%	0.254	C	S	.	.	H	α-helix	trans	-63.7	-39	175.5	0	0	0	0	0	112.1	V255 M271 L279 G283 F284 K285 Q290 F291	V255-A287 HydrophobicContact CG2-CB 4.16Å; M271-A287 HydrophobicContact CE-CB 3.98Å; M271-A287 HydrophobicContact SD-CB 4.28Å; L279-A287 HydrophobicContact CD1-CB 3.91Å; G283-A287 WeakPolarHBondContact O-CB 3.28Å; G283-A287 PolarHBondContact O-N 2.75Å; F284-A287 PolarHBondContact O-N 3.1Å; K285-A287 VanDerWaalsContact C-N 3.34Å; K285-A287 PolarHBondContact O-N 2.85Å; A287-Q290 PolarHBondContact O-N 3.34Å; A287-F291 PolarHBondContact O-N 3.07Å
288	L	97.8	Very high	94.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-67	-40.4	173.1	-71.6	178.2	0	0	0	112.1	L218 F284 K285 E286 Q290 F291 F292 L411 I414 I415 I418	L218-L288 HydrophobicContact CD2-CD2 3.56Å; F284-L288 HydrophobicContact CD1-CD1 4.01Å; F284-L288 HydrophobicContact CD1-CG 4.44Å; F284-L288 HydrophobicContact CE1-CD1 3.42Å; F284-L288 VanDerWaalsContact CE1-CD1 3.42Å; F284-L288 HydrophobicContact CE1-CG 4.04Å; F284-L288 HydrophobicContact CZ-CD1 3.99Å; F284-L288 HydrophobicContact CZ-CD2 4.49Å; F284-L288 HydrophobicContact CZ-CG 4.28Å; F284-L288 PolarHBondContact O-N 2.84Å; K285-L288 PolarHBondContact O-N 3.02Å; E286-L288 VanDerWaalsContact C-N 3.34Å; E286-L288 PolarHBondContact O-N 2.74Å; L288-Q290 VanDerWaalsContact C-N 3.34Å; L288-Q290 PolarHBondContact O-N 3.35Å; L288-F291 WeakPolarHBondContact O-CB 3.32Å; L288-F291 PolarHBondContact O-N 3.14Å; L288-F292 WeakPolarHBondContact O-CD2 3.5Å; L288-F292 PolarHBondContact O-N 3.18Å; L288-F292 VanDerWaalsContact O-N 3.17Å; L288-L411 HydrophobicContact CD1-CD1 3.83Å; L288-L411 HydrophobicContact CD2-CD1 4.3Å; L288-I414 HydrophobicContact CD1-CB 4.47Å; L288-I414 HydrophobicContact CD1-CG2 3.62Å; L288-I415 HydrophobicContact CD1-CG1 4.19Å; L288-I418 HydrophobicContact CB-CD1 3.67Å; L288-I418 HydrophobicContact CD1-CD1 4.41Å
289	Y	96.1	Very high	94.6	Very high	99 Å²	99	42.9 Å²	42.9	39%	0.388	21%	0.213	S	C	.	.	H	α-helix	trans	-58.4	-48.2	173.2	-176.5	-82	0	0	0	110.9	K285 E286 F291 F292 H293 L298 I418	K285-Y289 PolarHBondContact O-N 3.07Å; E286-Y289 WeakPolarHBondContact O-CB 3.29Å; E286-Y289 PolarHBondContact O-N 2.77Å; Y289-F291 VanDerWaalsContact C-N 3.27Å; Y289-F291 PolarHBondContact O-N 2.9Å; Y289-F292 PolarHBondContact O-N 2.66Å; Y289-H293 HydrophobicContact CD1-CB 4.38Å; Y289-H293 HydrophobicContact CE1-CB 4.19Å; Y289-H293 AromaticContact CE1-CD2 3.74Å; Y289-H293 WeakPolarHBondContact O-CB 3.36Å; Y289-H293 PolarHBondContact O-N 3.26Å; Y289-H293 VanDerWaalsContact O-N 3.07Å; Y289-L298 HydrophobicContact CD2-CD1 4.17Å; Y289-L298 HydrophobicContact CE2-CD1 4.06Å; Y289-L298 HydrophobicContact CE2-CD2 4.09Å; Y289-I418 HydrophobicContact CD2-CG2 3.98Å
290	Q	94.9	Very high	94.5	Very high	63 Å²	63	46.5 Å²	46.5	29%	0.294	23%	0.225	S	C	.	.	H	α-helix	trans	-60.5	-37	175.6	-72.2	175.1	10.3	0	0	112.2	M258 E286 A287 L288 F292 H293	M258-Q290 HydrophobicContact CE-CB 4.43Å; E286-Q290 WeakPolarHBondContact O-CG 3.2Å; E286-Q290 PolarHBondContact O-N 2.9Å; A287-Q290 PolarHBondContact O-N 3.34Å; L288-Q290 VanDerWaalsContact C-N 3.34Å; L288-Q290 PolarHBondContact O-N 3.35Å; Q290-F292 VanDerWaalsContact C-N 3.3Å; Q290-F292 PolarHBondContact O-N 3.25Å; Q290-H293 PolarHBondContact O-N 3Å
291	F	97.2	Very high	94.3	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.8	-39.9	176.2	-179.3	-113.8	0	0	0	112.5	C216 L218 M258 V260 A287 L288 Y289 I332 Y334	C216-F291 HydrophobicContact CB-CE2 4.22Å; L218-F291 HydrophobicContact CB-CD1 4.11Å; L218-F291 HydrophobicContact CB-CD2 3.64Å; L218-F291 HydrophobicContact CB-CE1 3.88Å; L218-F291 HydrophobicContact CB-CE2 3.41Å; L218-F291 VanDerWaalsContact CB-CE2 3.41Å; L218-F291 HydrophobicContact CB-CG 3.99Å; L218-F291 HydrophobicContact CB-CZ 3.52Å; L218-F291 HydrophobicContact CD2-CB 4.4Å; L218-F291 HydrophobicContact CD2-CD1 3.76Å; L218-F291 HydrophobicContact CD2-CD2 4.42Å; L218-F291 HydrophobicContact CD2-CE1 4.11Å; L218-F291 HydrophobicContact CD2-CG 3.92Å; L218-F291 HydrophobicContact CG-CD2 4.44Å; L218-F291 HydrophobicContact CG-CG 4.42Å; M258-F291 HydrophobicContact CG-CD2 3.95Å; M258-F291 HydrophobicContact SD-CB 3.74Å; M258-F291 HydrophobicContact SD-CD2 4.15Å; M258-F291 HydrophobicContact SD-CG 4.4Å; V260-F291 HydrophobicContact CG2-CB 4.49Å; V260-F291 HydrophobicContact CG2-CD2 3.69Å; V260-F291 HydrophobicContact CG2-CE2 4.44Å; A287-F291 PolarHBondContact O-N 3.07Å; L288-F291 WeakPolarHBondContact O-CB 3.32Å; L288-F291 PolarHBondContact O-N 3.14Å; Y289-F291 VanDerWaalsContact C-N 3.27Å; Y289-F291 PolarHBondContact O-N 2.9Å; F291-I332 HydrophobicContact CE1-CB 4.12Å; F291-I332 HydrophobicContact CE1-CG2 3.75Å; F291-I332 HydrophobicContact CZ-CB 4.32Å; F291-I332 HydrophobicContact CZ-CG2 4.18Å; F291-I332 WeakPolarHBondContact CZ-O 3.24Å; F291-Y334 HydrophobicContact CD1-CE1 4.28Å; F291-Y334 HydrophobicContact CD2-CE1 4.36Å; F291-Y334 AromaticContact CE1-CD1 3.94Å; F291-Y334 HydrophobicContact CE1-CD1 3.94Å; F291-Y334 AromaticContact CE1-CE1 3.74Å; F291-Y334 HydrophobicContact CE1-CE1 3.74Å; F291-Y334 HydrophobicContact CE2-CD1 4.35Å; F291-Y334 AromaticContact CE2-CE1 3.79Å; F291-Y334 HydrophobicContact CE2-CE1 3.79Å; F291-Y334 AromaticContact CZ-CD1 3.65Å; F291-Y334 HydrophobicContact CZ-CD1 3.65Å; F291-Y334 AromaticContact CZ-CE1 3.47Å; F291-Y334 HydrophobicContact CZ-CE1 3.47Å; F291-Y334 VanDerWaalsContact CZ-CE1 3.47Å; F291-Y334 PolarHBondContact O-OH 3.2Å
292	F	96.1	Very high	94.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-90.5	-2.2	179.6	-65.1	-65.3	0	0	0	114	L288 Y289 Q290 L298 R299 L302 F303 V306 I415	L288-F292 WeakPolarHBondContact O-CD2 3.5Å; L288-F292 PolarHBondContact O-N 3.18Å; L288-F292 VanDerWaalsContact O-N 3.17Å; Y289-F292 PolarHBondContact O-N 2.66Å; Q290-F292 VanDerWaalsContact C-N 3.3Å; Q290-F292 PolarHBondContact O-N 3.25Å; F292-L298 HydrophobicContact CB-CD1 3.72Å; F292-R299 VanDerWaalsContact O-CB 3.3Å; F292-R299 WeakPolarHBondContact O-CB 3.44Å; F292-R299 WeakPolarHBondContact O-CG 3.32Å; F292-R299 PolarHBondContact O-N 2.88Å; F292-L302 HydrophobicContact CD1-CB 4.23Å; F292-L302 HydrophobicContact CD1-CD1 4.09Å; F292-L302 HydrophobicContact CE1-CB 4.36Å; F292-F303 HydrophobicContact CB-CE2 3.82Å; F292-F303 HydrophobicContact CB-CZ 3.86Å; F292-F303 HydrophobicContact CD1-CE2 4.48Å; F292-F303 HydrophobicContact CD2-CE1 4.01Å; F292-F303 HydrophobicContact CD2-CE2 4.24Å; F292-F303 AromaticContact CD2-CZ 3.67Å; F292-F303 HydrophobicContact CD2-CZ 3.67Å; F292-F303 HydrophobicContact CE2-CE1 4.35Å; F292-F303 HydrophobicContact CE2-CZ 4.42Å; F292-F303 AromaticContact CG-CE2 3.93Å; F292-F303 HydrophobicContact CG-CE2 3.93Å; F292-F303 AromaticContact CG-CZ 3.83Å; F292-F303 HydrophobicContact CG-CZ 3.83Å; F292-V306 HydrophobicContact CE1-CG2 3.89Å; F292-V306 HydrophobicContact CZ-CG1 4.43Å; F292-V306 HydrophobicContact CZ-CG2 4.01Å; F292-I415 HydrophobicContact CE2-CG1 4.47Å
293	H	93.9	Very high	94.3	Very high	43 Å²	43	39.7 Å²	39.7	20%	0.199	18%	0.182	C	C	.	.	B	Isolated β-bridge	trans	-98.9	117.3	-177.7	-166.8	-81.8	0	0	0	111.5	Y289 Q290 G295 Y297 L298	Y289-H293 HydrophobicContact CD1-CB 4.38Å; Y289-H293 HydrophobicContact CE1-CB 4.19Å; Y289-H293 AromaticContact CE1-CD2 3.74Å; Y289-H293 WeakPolarHBondContact O-CB 3.36Å; Y289-H293 PolarHBondContact O-N 3.26Å; Y289-H293 VanDerWaalsContact O-N 3.07Å; Q290-H293 PolarHBondContact O-N 3Å; H293-G295 WeakPolarHBondContact ND1-CA 3.22Å; H293-G295 PolarHBondContact ND1-N 2.6Å; H293-G295 PolarHBondContact O-N 2.81Å; H293-Y297 VanDerWaalsContact CD2-C 3.44Å; H293-L298 HydrophobicContact CB-CD1 4.36Å; H293-L298 PolarHBondContact CD2-N 3.41Å
294	N	91.6	Very high	94.3	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	20%	0.202	C	C	.	.			trans	-81.5	10	-176.7	74.1	0.8	0	0	0	113.8	Q262 A263 K296 Y297 R299 E338	Q262-N294 CarbonylContact C-O 3.58Å; Q262-N294 VanDerWaalsContact C-O 3.31Å; Q262-N294 VanDerWaalsContact CA-O 3.31Å; Q262-N294 WeakPolarHBondContact CA-O 3.17Å; A263-N294 HydrophobicContact CB-CB 4.22Å; A263-N294 PolarHBondContact N-O 3.07Å; N294-K296 VanDerWaalsContact C-N 3.29Å; N294-K296 PolarHBondContact O-N 2.71Å; N294-K296 WeakPolarHBondContact OD1-CA 3.49Å; N294-K296 WeakPolarHBondContact OD1-CB 3.2Å; N294-K296 PolarHBondContact OD1-N 3.2Å; N294-Y297 PolarHBondContact N-O 2.94Å; N294-Y297 VanDerWaalsContact N-O 3.07Å; N294-Y297 PolarHBondContact OD1-N 3.28Å; N294-Y297 PolarHBondContact OD1-O 3.31Å; N294-R299 HydrophobicContact CB-CG 4.09Å; N294-E338 PolarHBondContact ND2-OE1 3.4Å
295	G	89.4	Confident	94.3	Very high	32 Å²	32	46 Å²	46	33%	0.33	21%	0.213	S	C	.	.	S	Bend	trans	85.6	-6.1	-176.5	0	0	0	0	0	115	Q262 H293	Q262-G295 VanDerWaalsContact OE1-N 3.12Å; H293-G295 WeakPolarHBondContact ND1-CA 3.22Å; H293-G295 PolarHBondContact ND1-N 2.6Å; H293-G295 PolarHBondContact O-N 2.81Å
296	K	90.2	Very high	94.3	Very high	138 Å²	138	44.2 Å²	44.2	60%	0.6	21%	0.205	S	C	*	.	S	Bend	trans	-116.9	-45.1	171.2	-61.3	-177.5	-179.5	177.8	0	111.4	A263 G264 N294	A263-K296 WeakPolarHBondContact O-CE 3.46Å; G264-K296 VanDerWaalsContact CA-CE 3.48Å; N294-K296 VanDerWaalsContact C-N 3.29Å; N294-K296 PolarHBondContact O-N 2.71Å; N294-K296 WeakPolarHBondContact OD1-CA 3.49Å; N294-K296 WeakPolarHBondContact OD1-CB 3.2Å; N294-K296 PolarHBondContact OD1-N 3.2Å
297	Y	91.6	Very high	94.4	Very high	106 Å²	106	40 Å²	40	42%	0.416	19%	0.186	S	C	.	.	S	Bend	trans	-152.2	165.9	179.3	51	-89.5	0	0	0	111.3	H293 N294 E338	H293-Y297 VanDerWaalsContact CD2-C 3.44Å; N294-Y297 PolarHBondContact N-O 2.94Å; N294-Y297 VanDerWaalsContact N-O 3.07Å; N294-Y297 PolarHBondContact OD1-N 3.28Å; N294-Y297 PolarHBondContact OD1-O 3.31Å; Y297-E338 PolarHBondContact OH-OE1 3.29Å; Y297-E338 PolarHBondContact OH-OE2 3.4Å
298	L	93	Very high	94.5	Very high	12 Å²	12	46.4 Å²	46.4	6%	0.063	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-75.4	125.9	171.2	-170.4	69.6	0	0	0	110.1	Y289 F292 H293 R300 F303 I418 S422	Y289-L298 HydrophobicContact CD2-CD1 4.17Å; Y289-L298 HydrophobicContact CE2-CD1 4.06Å; Y289-L298 HydrophobicContact CE2-CD2 4.09Å; F292-L298 HydrophobicContact CB-CD1 3.72Å; H293-L298 HydrophobicContact CB-CD1 4.36Å; H293-L298 PolarHBondContact CD2-N 3.41Å; L298-R300 VanDerWaalsContact C-N 3.27Å; L298-R300 PolarHBondContact O-N 2.85Å; L298-F303 HydrophobicContact CD1-CE2 4.19Å; L298-F303 HydrophobicContact CD1-CZ 4.15Å; L298-F303 HydrophobicContact CD2-CE2 4.05Å; L298-F303 HydrophobicContact CD2-CZ 4.06Å; L298-F303 HydrophobicContact CG-CE2 3.95Å; L298-F303 HydrophobicContact CG-CZ 4.24Å; L298-I418 HydrophobicContact CD2-CG2 4.47Å; L298-S422 VanDerWaalsContact CD2-OG 3.28Å; L298-S422 WeakPolarHBondContact CD2-OG 3.37Å
299	R	92.9	Very high	94.5	Very high	11 Å²	11	49.4 Å²	49.4	4%	0.042	23%	0.227	C	C	.	.			trans	-77.5	70.9	-179.9	-62.6	-70.9	-60.9	-83.4	-16.3	111.2	F292 N294 E301 L302 E338	F292-R299 VanDerWaalsContact O-CB 3.3Å; F292-R299 WeakPolarHBondContact O-CB 3.44Å; F292-R299 WeakPolarHBondContact O-CG 3.32Å; F292-R299 PolarHBondContact O-N 2.88Å; N294-R299 HydrophobicContact CB-CG 4.09Å; R299-E301 VanDerWaalsContact CA-OE2 3.26Å; R299-E301 WeakPolarHBondContact CA-OE2 3.03Å; R299-E301 IonicContact CZ-OE1 2.65Å; R299-E301 IonicContact NE-OE1 3.19Å; R299-E301 PolarHBondContact NE-OE1 3.42Å; R299-E301 IonicContact NE-OE2 3.52Å; R299-E301 IonicContact NH2-OE1 3.8Å; R299-E301 PolarHBondContact NH2-OE1 3.43Å; R299-E301 PolarHBondContact O-N 3.27Å; R299-L302 HydrophobicContact CB-CD1 3.53Å; R299-L302 HydrophobicContact CB-CG 3.91Å; R299-L302 HydrophobicContact CG-CD1 4.31Å; R299-L302 WeakPolarHBondContact O-CB 3.29Å; R299-L302 PolarHBondContact O-N 3.36Å; R299-L302 VanDerWaalsContact O-N 3.16Å; R299-E338 WeakPolarHBondContact CD-OE1 3.47Å; R299-E338 IonicContact CZ-OE1 2.9Å; R299-E338 IonicContact NE-OE1 3.07Å; R299-E338 IonicContact NH1-OE1 3.02Å; R299-E338 PolarHBondContact NH1-OE1 3.04Å
300	R	91.9	Very high	94.6	Very high	99 Å²	99	44.7 Å²	44.7	37%	0.374	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-57.2	-33.1	-174.7	-68.5	-177.5	-172	-70.3	-23.1	113.7	L298 L302 F303 R419 S422 S423	L298-R300 VanDerWaalsContact C-N 3.27Å; L298-R300 PolarHBondContact O-N 2.85Å; R300-L302 PolarHBondContact O-N 2.92Å; R300-L302 VanDerWaalsContact O-N 3.08Å; R300-F303 WeakPolarHBondContact O-CD2 3.16Å; R300-F303 PolarHBondContact O-N 3.49Å; R300-F303 VanDerWaalsContact O-N 3.1Å; R300-R419 PolarHBondContact NH1-O 2.74Å; R300-S422 PolarHBondContact NH1-O 3.23Å; R300-S422 PolarHBondContact NH1-OG 2.92Å; R300-S422 VanDerWaalsContact NH2-C 3.27Å; R300-S422 PolarHBondContact NH2-O 2.76Å; R300-S422 PolarHBondContact NH2-OG 3.27Å; R300-S423 PolarHBondContact NH1-OG 2.94Å
301	E	92.3	Very high	94.8	Very high	81 Å²	81	44.9 Å²	44.9	38%	0.379	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-64.5	-14.4	-178.3	79.9	-68.8	170.8	0	0	113.1	R299 S373	R299-E301 VanDerWaalsContact CA-OE2 3.26Å; R299-E301 WeakPolarHBondContact CA-OE2 3.03Å; R299-E301 IonicContact CZ-OE1 2.65Å; R299-E301 IonicContact NE-OE1 3.19Å; R299-E301 PolarHBondContact NE-OE1 3.42Å; R299-E301 IonicContact NE-OE2 3.52Å; R299-E301 IonicContact NH2-OE1 3.8Å; R299-E301 PolarHBondContact NH2-OE1 3.43Å; R299-E301 PolarHBondContact O-N 3.27Å; E301-S373 PolarHBondContact O-OG 2.95Å
302	L	95.3	Very high	94.8	Very high	2 Å²	2	48 Å²	48	1%	0.01	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-81.7	-27.1	176.2	-55.3	177.7	0	0	0	112.9	F292 R299 R300 E304 S305 V306 Y334 V375	F292-L302 HydrophobicContact CD1-CB 4.23Å; F292-L302 HydrophobicContact CD1-CD1 4.09Å; F292-L302 HydrophobicContact CE1-CB 4.36Å; R299-L302 HydrophobicContact CB-CD1 3.53Å; R299-L302 HydrophobicContact CB-CG 3.91Å; R299-L302 HydrophobicContact CG-CD1 4.31Å; R299-L302 WeakPolarHBondContact O-CB 3.29Å; R299-L302 PolarHBondContact O-N 3.36Å; R299-L302 VanDerWaalsContact O-N 3.16Å; R300-L302 PolarHBondContact O-N 2.92Å; R300-L302 VanDerWaalsContact O-N 3.08Å; L302-E304 PolarHBondContact O-N 2.99Å; L302-S305 PolarHBondContact O-N 2.64Å; L302-V306 VanDerWaalsContact O-CG2 3.26Å; L302-V306 WeakPolarHBondContact O-CG2 3.36Å; L302-V306 PolarHBondContact O-N 3.41Å; L302-Y334 HydrophobicContact CD1-CD1 3.9Å; L302-Y334 HydrophobicContact CD1-CD2 3.48Å; L302-Y334 VanDerWaalsContact CD1-CD2 3.48Å; L302-Y334 HydrophobicContact CD1-CE1 4.08Å; L302-Y334 HydrophobicContact CD1-CE2 3.68Å; L302-Y334 HydrophobicContact CD1-CG 3.61Å; L302-Y334 HydrophobicContact CD2-CD2 4.38Å; L302-Y334 HydrophobicContact CD2-CG 4.4Å; L302-V375 HydrophobicContact CB-CG2 4.12Å; L302-V375 HydrophobicContact CD2-CG2 3.68Å; L302-V375 HydrophobicContact CG-CG2 4.46Å
303	F	95.7	Very high	94.9	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-63.4	-48.1	-168.8	-78.5	-100.9	0	0	0	112.4	F292 L298 R300 S305 V306 I307 I415 I418 R419	F292-F303 HydrophobicContact CB-CE2 3.82Å; F292-F303 HydrophobicContact CB-CZ 3.86Å; F292-F303 HydrophobicContact CD1-CE2 4.48Å; F292-F303 HydrophobicContact CD2-CE1 4.01Å; F292-F303 HydrophobicContact CD2-CE2 4.24Å; F292-F303 AromaticContact CD2-CZ 3.67Å; F292-F303 HydrophobicContact CD2-CZ 3.67Å; F292-F303 HydrophobicContact CE2-CE1 4.35Å; F292-F303 HydrophobicContact CE2-CZ 4.42Å; F292-F303 AromaticContact CG-CE2 3.93Å; F292-F303 HydrophobicContact CG-CE2 3.93Å; F292-F303 AromaticContact CG-CZ 3.83Å; F292-F303 HydrophobicContact CG-CZ 3.83Å; L298-F303 HydrophobicContact CD1-CE2 4.19Å; L298-F303 HydrophobicContact CD1-CZ 4.15Å; L298-F303 HydrophobicContact CD2-CE2 4.05Å; L298-F303 HydrophobicContact CD2-CZ 4.06Å; L298-F303 HydrophobicContact CG-CE2 3.95Å; L298-F303 HydrophobicContact CG-CZ 4.24Å; R300-F303 WeakPolarHBondContact O-CD2 3.16Å; R300-F303 PolarHBondContact O-N 3.49Å; R300-F303 VanDerWaalsContact O-N 3.1Å; F303-S305 VanDerWaalsContact C-N 3.31Å; F303-S305 PolarHBondContact O-N 3.3Å; F303-V306 PolarHBondContact O-N 3.26Å; F303-I307 HydrophobicContact CB-CD1 4.4Å; F303-I307 WeakPolarHBondContact O-CB 3.47Å; F303-I307 WeakPolarHBondContact O-CD1 3.31Å; F303-I307 VanDerWaalsContact O-CG1 3.24Å; F303-I307 WeakPolarHBondContact O-CG1 3.26Å; F303-I307 PolarHBondContact O-N 3.16Å; F303-I415 HydrophobicContact CD1-CG2 3.53Å; F303-I415 WeakPolarHBondContact CD1-O 3.3Å; F303-I415 HydrophobicContact CE1-CG2 3.98Å; F303-I415 WeakPolarHBondContact CE1-O 3.18Å; F303-I418 HydrophobicContact CE1-CB 4.05Å; F303-I418 HydrophobicContact CE1-CG2 3.73Å; F303-I418 HydrophobicContact CZ-CG2 3.71Å; F303-R419 HydrophobicContact CB-CB 4.29Å; F303-R419 HydrophobicContact CB-CG 4.04Å; F303-R419 HydrophobicContact CD1-CB 3.65Å; F303-R419 HydrophobicContact CD1-CG 4.3Å; F303-R419 HydrophobicContact CE1-CB 4.2Å; F303-R419 HydrophobicContact CG-CB 4.06Å; F303-R419 HydrophobicContact CG-CG 4.2Å
304	E	95	Very high	95.1	Very high	107 Å²	107	47.9 Å²	47.9	50%	0.5	23%	0.227	S	C	.	.	H	α-helix	trans	-59.5	-43.4	179.7	-67.3	-53.1	132.4	0	0	111.8	L302 K308 R419	L302-E304 PolarHBondContact O-N 2.99Å; E304-K308 VanDerWaalsContact O-CB 3.22Å; E304-K308 WeakPolarHBondContact O-CB 3.36Å; E304-K308 PolarHBondContact O-N 2.82Å; E304-R419 WeakPolarHBondContact OE1-CD 3.38Å; E304-R419 IonicContact OE1-CZ 2.85Å; E304-R419 IonicContact OE1-NE 3.12Å; E304-R419 IonicContact OE1-NH1 3.41Å; E304-R419 PolarHBondContact OE1-NH1 3.18Å; E304-R419 IonicContact OE2-NH1 2.65Å
305	S	95.8	Very high	95.4	Very high	34 Å²	34	50.2 Å²	50.2	24%	0.238	24%	0.244	C	C	.	.	H	α-helix	trans	-63.6	-43.5	177.1	-66.7	0	0	0	0	112.3	L302 F303 K309	L302-S305 PolarHBondContact O-N 2.64Å; F303-S305 VanDerWaalsContact C-N 3.31Å; F303-S305 PolarHBondContact O-N 3.3Å; S305-K309 WeakPolarHBondContact O-CG 3.43Å; S305-K309 PolarHBondContact O-N 3.19Å; S305-K309 VanDerWaalsContact O-N 3.15Å
306	V	97.7	Very high	95.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64.1	-52.5	176.4	175.5	0	0	0	0	110.6	F292 L302 F303 K308 K309 L310 I332 V375 I415	F292-V306 HydrophobicContact CE1-CG2 3.89Å; F292-V306 HydrophobicContact CZ-CG1 4.43Å; F292-V306 HydrophobicContact CZ-CG2 4.01Å; L302-V306 VanDerWaalsContact O-CG2 3.26Å; L302-V306 WeakPolarHBondContact O-CG2 3.36Å; L302-V306 PolarHBondContact O-N 3.41Å; F303-V306 PolarHBondContact O-N 3.26Å; V306-K308 VanDerWaalsContact C-N 3.3Å; V306-K308 PolarHBondContact O-N 3.12Å; V306-K309 PolarHBondContact O-N 3.13Å; V306-L310 HydrophobicContact CG1-CD1 3.64Å; V306-L310 HydrophobicContact CG1-CG 4.1Å; V306-L310 VanDerWaalsContact O-CG 3.29Å; V306-L310 WeakPolarHBondContact O-CG 3.48Å; V306-L310 PolarHBondContact O-N 2.59Å; V306-I332 HydrophobicContact CG1-CD1 4.16Å; V306-I332 HydrophobicContact CG2-CG2 4.2Å; V306-V375 HydrophobicContact CG2-CB 4.46Å; V306-V375 HydrophobicContact CG2-CG1 3.58Å; V306-V375 HydrophobicContact CG2-CG2 4.24Å; V306-I415 HydrophobicContact CG1-CD1 3.93Å
307	I	98	Very high	96	Very high	11 Å²	11	43.2 Å²	43.2	6%	0.056	21%	0.206	C	C	.	.	H	α-helix	trans	-58.9	-44.2	-177.2	-69.6	163.1	0	0	0	110.4	F303 L310 T311 I412 I415 K416	F303-I307 HydrophobicContact CB-CD1 4.4Å; F303-I307 WeakPolarHBondContact O-CB 3.47Å; F303-I307 WeakPolarHBondContact O-CD1 3.31Å; F303-I307 VanDerWaalsContact O-CG1 3.24Å; F303-I307 WeakPolarHBondContact O-CG1 3.26Å; F303-I307 PolarHBondContact O-N 3.16Å; I307-L310 PolarHBondContact O-N 3.43Å; I307-T311 WeakPolarHBondContact O-CB 3.24Å; I307-T311 PolarHBondContact O-N 2.93Å; I307-T311 PolarHBondContact O-OG1 2.85Å; I307-I412 HydrophobicContact CG2-CG2 4.43Å; I307-I415 HydrophobicContact CD1-CG2 4.04Å; I307-I415 HydrophobicContact CG1-CG2 3.71Å; I307-K416 HydrophobicContact CD1-CG 3.72Å; I307-K416 HydrophobicContact CG1-CG 4.3Å
308	K	97.6	Very high	96.2	Very high	135 Å²	135	41.2 Å²	41.2	59%	0.587	20%	0.2	S	C	*	.	H	α-helix	trans	-58.3	-52.3	176.3	-178.2	179.4	176.9	-178.1	0	111.2	E304 V306 L310 T311 E312	E304-K308 VanDerWaalsContact O-CB 3.22Å; E304-K308 WeakPolarHBondContact O-CB 3.36Å; E304-K308 PolarHBondContact O-N 2.82Å; V306-K308 VanDerWaalsContact C-N 3.3Å; V306-K308 PolarHBondContact O-N 3.12Å; K308-L310 PolarHBondContact O-N 2.93Å; K308-T311 PolarHBondContact O-N 3.32Å; K308-E312 WeakPolarHBondContact CE-OE1 3.34Å; K308-E312 WeakPolarHBondContact O-CG 3.26Å; K308-E312 PolarHBondContact O-N 2.8Å
309	K	97.9	Very high	96.2	Very high	64 Å²	64	47.8 Å²	47.8	28%	0.278	23%	0.228	S	C	.	.	H	α-helix	trans	-61.6	-41.2	179.9	-75	-170.4	169.2	-158.3	0	112.7	S305 V306 E312 L313 V375 D376 V377	S305-K309 WeakPolarHBondContact O-CG 3.43Å; S305-K309 PolarHBondContact O-N 3.19Å; S305-K309 VanDerWaalsContact O-N 3.15Å; V306-K309 PolarHBondContact O-N 3.13Å; K309-E312 PolarHBondContact O-N 3.14Å; K309-L313 WeakPolarHBondContact O-CB 3.49Å; K309-L313 PolarHBondContact O-N 3.49Å; K309-V375 WeakPolarHBondContact CE-O 3.46Å; K309-V375 PolarHBondContact NZ-O 3.25Å; K309-D376 IonicContact NZ-OD1 3.6Å; K309-D376 PolarHBondContact NZ-OD1 3.17Å; K309-V377 HydrophobicContact CB-CB 3.99Å; K309-V377 HydrophobicContact CB-CG2 3.83Å; K309-V377 HydrophobicContact CD-CB 4.19Å; K309-V377 HydrophobicContact CD-CG2 4.04Å
310	L	98.5	Very high	96.1	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.3	-41	176.2	-69	174.7	0	0	0	112.2	V306 I307 K308 L313 K314 L330 V377 L408 L411 I412 I415	V306-L310 HydrophobicContact CG1-CD1 3.64Å; V306-L310 HydrophobicContact CG1-CG 4.1Å; V306-L310 VanDerWaalsContact O-CG 3.29Å; V306-L310 WeakPolarHBondContact O-CG 3.48Å; V306-L310 PolarHBondContact O-N 2.59Å; I307-L310 PolarHBondContact O-N 3.43Å; K308-L310 PolarHBondContact O-N 2.93Å; L310-L313 PolarHBondContact O-N 3.1Å; L310-K314 WeakPolarHBondContact O-CB 3.39Å; L310-K314 PolarHBondContact O-N 3.4Å; L310-L330 HydrophobicContact CD2-CD2 3.5Å; L310-V377 HydrophobicContact CD2-CG1 3.84Å; L310-L408 HydrophobicContact CD2-CD2 4.05Å; L310-L411 HydrophobicContact CD1-CD2 4.14Å; L310-L411 HydrophobicContact CD1-CG 4.18Å; L310-L411 HydrophobicContact CD2-CD2 4.09Å; L310-I412 HydrophobicContact CB-CD1 3.92Å; L310-I412 HydrophobicContact CB-CG1 3.59Å; L310-I412 HydrophobicContact CD1-CG1 4.04Å; L310-I412 HydrophobicContact CG-CG1 4.45Å; L310-I415 HydrophobicContact CD1-CD1 3.71Å
311	T	98.4	Very high	95.9	Very high	67 Å²	67	49.5 Å²	49.5	41%	0.411	24%	0.241	S	C	.	.	H	α-helix	trans	-66.9	-42.9	178.7	-56.4	0	0	0	0	111	I307 K308 K314 S315	I307-T311 WeakPolarHBondContact O-CB 3.24Å; I307-T311 PolarHBondContact O-N 2.93Å; I307-T311 PolarHBondContact O-OG1 2.85Å; K308-T311 PolarHBondContact O-N 3.32Å; T311-K314 PolarHBondContact O-N 2.95Å; T311-S315 PolarHBondContact O-N 3.17Å
312	E	98	Very high	95.7	Very high	66 Å²	66	45.8 Å²	45.8	31%	0.308	22%	0.224	S	C	.	.	H	α-helix	trans	-62.7	-42.6	173.5	-70.7	179.8	-158.2	0	0	111.7	K61 F62 K308 K309 S315 V316	K61-E312 IonicContact NZ-OE2 2.87Å; K61-E312 PolarHBondContact NZ-OE2 3.42Å; F62-E312 HydrophobicContact CZ-CB 3.7Å; K308-E312 WeakPolarHBondContact CE-OE1 3.34Å; K308-E312 WeakPolarHBondContact O-CG 3.26Å; K308-E312 PolarHBondContact O-N 2.8Å; K309-E312 PolarHBondContact O-N 3.14Å; E312-S315 PolarHBondContact O-N 3.29Å; E312-V316 PolarHBondContact O-N 2.91Å
313	L	98.1	Very high	95.6	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61	-46.4	176.5	172.6	58.9	0	0	0	111.1	F62 K309 L310 S315 V316 L317 L330 M379 L408	F62-L313 HydrophobicContact CB-CD1 3.82Å; F62-L313 HydrophobicContact CD1-CB 4.02Å; F62-L313 HydrophobicContact CD1-CD1 4.23Å; F62-L313 HydrophobicContact CD2-CB 4.26Å; F62-L313 HydrophobicContact CD2-CD1 3.65Å; F62-L313 HydrophobicContact CE1-CB 3.84Å; F62-L313 HydrophobicContact CE2-CB 4.04Å; F62-L313 HydrophobicContact CE2-CD1 4.19Å; F62-L313 HydrophobicContact CG-CB 4.23Å; F62-L313 HydrophobicContact CG-CD1 3.66Å; F62-L313 HydrophobicContact CG-CG 4.43Å; F62-L313 HydrophobicContact CZ-CB 3.84Å; F62-L313 VanDerWaalsContact CZ-N 3.3Å; K309-L313 WeakPolarHBondContact O-CB 3.49Å; K309-L313 PolarHBondContact O-N 3.49Å; L310-L313 PolarHBondContact O-N 3.1Å; L313-S315 VanDerWaalsContact C-N 3.31Å; L313-S315 PolarHBondContact O-N 3.34Å; L313-V316 PolarHBondContact O-N 2.8Å; L313-V316 VanDerWaalsContact O-N 3.14Å; L313-L317 HydrophobicContact CD1-CD1 4.03Å; L313-L317 HydrophobicContact CD1-CD2 4.36Å; L313-L317 HydrophobicContact CD1-CG 3.86Å; L313-L317 HydrophobicContact CG-CD1 4.2Å; L313-L317 HydrophobicContact CG-CG 4.38Å; L313-L317 WeakPolarHBondContact O-CG 3.49Å; L313-L317 PolarHBondContact O-N 3.28Å; L313-L330 HydrophobicContact CD2-CD1 3.47Å; L313-L330 VanDerWaalsContact CD2-CD1 3.47Å; L313-M379 HydrophobicContact CD1-CG 4.2Å; L313-M379 HydrophobicContact CD1-SD 3.63Å; L313-M379 HydrophobicContact CD2-CG 4.02Å; L313-M379 HydrophobicContact CD2-SD 4.34Å; L313-L408 HydrophobicContact CD2-CD1 4.29Å; L313-L408 HydrophobicContact CD2-CD2 4.18Å; L313-L408 HydrophobicContact CG-CD1 4.11Å
314	K	97.9	Very high	95.6	Very high	39 Å²	39	47.6 Å²	47.6	17%	0.17	23%	0.231	C	C	.	.	H	α-helix	trans	-54.3	-49.4	175.2	177.8	173.7	176	-79.5	0	110.8	L310 T311 V316 L317 E318 V405 L408 I412	L310-K314 WeakPolarHBondContact O-CB 3.39Å; L310-K314 PolarHBondContact O-N 3.4Å; T311-K314 PolarHBondContact O-N 2.95Å; K314-V316 VanDerWaalsContact C-N 3.29Å; K314-V316 PolarHBondContact O-N 3.06Å; K314-L317 PolarHBondContact O-N 3.12Å; K314-E318 WeakPolarHBondContact CE-OE1 3.37Å; K314-E318 HydrophobicContact CG-CG 4.35Å; K314-E318 IonicContact NZ-OE1 3.71Å; K314-E318 PolarHBondContact NZ-OE1 3Å; K314-E318 IonicContact NZ-OE2 3.98Å; K314-E318 VanDerWaalsContact O-CG 3.29Å; K314-E318 WeakPolarHBondContact O-CG 3.25Å; K314-E318 PolarHBondContact O-N 2.9Å; K314-V405 HydrophobicContact CG-CG1 4.38Å; K314-L408 HydrophobicContact CB-CD1 4.18Å; K314-I412 HydrophobicContact CD-CD1 4.29Å
315	S	97.5	Very high	95.6	Very high	51 Å²	51	42.7 Å²	42.7	36%	0.357	21%	0.208	S	C	.	.	H	α-helix	trans	-61.7	-34.5	178.8	-173.8	0	0	0	0	113.3	T311 E312 L313 K319	T311-S315 PolarHBondContact O-N 3.17Å; E312-S315 PolarHBondContact O-N 3.29Å; L313-S315 VanDerWaalsContact C-N 3.31Å; L313-S315 PolarHBondContact O-N 3.34Å; S315-K319 WeakPolarHBondContact O-CG 3.42Å
316	V	96.8	Very high	95.5	Very high	16 Å²	16	41.7 Å²	41.7	10%	0.097	20%	0.199	C	C	.	.	H	α-helix	trans	-67.9	-47.4	173.9	168.5	0	0	0	0	110.9	E58 M59 F62 E312 L313 K314 E318 K319 Q320	E58-V316 HydrophobicContact CB-CG1 3.86Å; E58-V316 HydrophobicContact CB-CG2 4.34Å; M59-V316 HydrophobicContact CG-CG1 3.82Å; F62-V316 HydrophobicContact CD2-CG2 4.45Å; F62-V316 HydrophobicContact CE2-CB 4.22Å; F62-V316 HydrophobicContact CE2-CG2 3.83Å; E312-V316 PolarHBondContact O-N 2.91Å; L313-V316 PolarHBondContact O-N 2.8Å; L313-V316 VanDerWaalsContact O-N 3.14Å; K314-V316 VanDerWaalsContact C-N 3.29Å; K314-V316 PolarHBondContact O-N 3.06Å; V316-E318 PolarHBondContact O-N 3.03Å; V316-K319 WeakPolarHBondContact O-CB 3.49Å; V316-K319 PolarHBondContact O-N 2.87Å; V316-K319 VanDerWaalsContact O-N 3.12Å; V316-Q320 HydrophobicContact CG1-CG 4.45Å; V316-Q320 WeakPolarHBondContact O-CG 3.48Å; V316-Q320 PolarHBondContact O-N 2.84Å; V316-Q320 PolarHBondContact O-NE2 3.31Å
317	L	95.8	Very high	95.2	Very high	6 Å²	6	42.7 Å²	42.7	3%	0.031	21%	0.206	C	C	.	.	H	α-helix	trans	-67	-33.3	-177.8	-68.4	-174.8	0	0	0	113.5	M59 L313 K314 K319 Q320 F325 M379 Y404 L408	M59-L317 HydrophobicContact CE-CD2 3.8Å; M59-L317 HydrophobicContact SD-CD2 4.34Å; L313-L317 HydrophobicContact CD1-CD1 4.03Å; L313-L317 HydrophobicContact CD1-CD2 4.36Å; L313-L317 HydrophobicContact CD1-CG 3.86Å; L313-L317 HydrophobicContact CG-CD1 4.2Å; L313-L317 HydrophobicContact CG-CG 4.38Å; L313-L317 WeakPolarHBondContact O-CG 3.49Å; L313-L317 PolarHBondContact O-N 3.28Å; K314-L317 PolarHBondContact O-N 3.12Å; L317-K319 PolarHBondContact O-N 3.46Å; L317-Q320 HydrophobicContact CD2-CG 4.48Å; L317-Q320 PolarHBondContact O-N 3.22Å; L317-Q320 VanDerWaalsContact O-N 3.1Å; L317-F325 HydrophobicContact CD2-CE2 3.78Å; L317-F325 HydrophobicContact CD2-CZ 4.11Å; L317-M379 HydrophobicContact CD1-CE 4.18Å; L317-M379 HydrophobicContact CD1-SD 4.02Å; L317-M379 HydrophobicContact CD2-CE 4.12Å; L317-M379 HydrophobicContact CD2-SD 3.9Å; L317-M379 HydrophobicContact CG-SD 4.37Å; L317-Y404 HydrophobicContact CD1-CD1 3.47Å; L317-Y404 VanDerWaalsContact CD1-CD1 3.47Å; L317-Y404 HydrophobicContact CD1-CE1 3.54Å; L317-Y404 HydrophobicContact CD1-CG 4.33Å; L317-L408 HydrophobicContact CD1-CD1 3.72Å
318	E	95.3	Very high	95	Very high	65 Å²	65	42.1 Å²	42.1	30%	0.304	20%	0.203	S	C	.	.	H	α-helix	trans	-61.3	-25.7	173.4	-71.6	173.3	155.6	0	0	112.3	K314 V316 V405	K314-E318 WeakPolarHBondContact CE-OE1 3.37Å; K314-E318 HydrophobicContact CG-CG 4.35Å; K314-E318 IonicContact NZ-OE1 3.71Å; K314-E318 PolarHBondContact NZ-OE1 3Å; K314-E318 IonicContact NZ-OE2 3.98Å; K314-E318 VanDerWaalsContact O-CG 3.29Å; K314-E318 WeakPolarHBondContact O-CG 3.25Å; K314-E318 PolarHBondContact O-N 2.9Å; V316-E318 PolarHBondContact O-N 3.03Å; E318-V405 HydrophobicContact CG-CG1 4.2Å; E318-V405 HydrophobicContact CG-CG2 4.16Å
319	K	93.9	Very high	95	Very high	150 Å²	150	35.7 Å²	35.7	65%	0.652	18%	0.175	S	C	*	.	H	α-helix	trans	-90	-14.4	176.3	-60.5	174.6	-168.5	179.2	0	113.6	S315 V316 L317 E321	S315-K319 WeakPolarHBondContact O-CG 3.42Å; V316-K319 WeakPolarHBondContact O-CB 3.49Å; V316-K319 PolarHBondContact O-N 2.87Å; V316-K319 VanDerWaalsContact O-N 3.12Å; L317-K319 PolarHBondContact O-N 3.46Å; K319-E321 PolarHBondContact O-N 3.49Å
320	Q	91.5	Very high	95	Very high	21 Å²	21	32.7 Å²	32.7	10%	0.098	16%	0.162	C	C	.	.			trans	-81.2	74.9	178.7	-60.3	-43.8	-61.3	0	0	110	M59 V316 L317 Y323	M59-Q320 HydrophobicContact CG-CG 4.12Å; M59-Q320 HydrophobicContact SD-CG 3.83Å; V316-Q320 HydrophobicContact CG1-CG 4.45Å; V316-Q320 WeakPolarHBondContact O-CG 3.48Å; V316-Q320 PolarHBondContact O-N 2.84Å; V316-Q320 PolarHBondContact O-NE2 3.31Å; L317-Q320 HydrophobicContact CD2-CG 4.48Å; L317-Q320 PolarHBondContact O-N 3.22Å; L317-Q320 VanDerWaalsContact O-N 3.1Å; Q320-Y323 HydrophobicContact CB-CD2 3.87Å; Q320-Y323 HydrophobicContact CB-CG 4.42Å
321	E	87.7	Confident	94.9	Very high	125 Å²	125	33.5 Å²	33.5	58%	0.584	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	141.1	175.3	-65.1	-174.6	176.1	0	0	110.6	K319 Y323	K319-E321 PolarHBondContact O-N 3.49Å; E321-Y323 PolarHBondContact O-N 3.21Å; E321-Y323 VanDerWaalsContact O-N 3.14Å
322	S	87.9	Confident	94.9	Very high	3 Å²	3	30.3 Å²	30.3	2%	0.021	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.6	-8.3	176.3	-56.8	0	0	0	0	117.6	K388 H397 G399	S322-K388 WeakPolarHBondContact OG-CD 3.45Å; S322-H397 VanDerWaalsContact CA-O 3.26Å; S322-H397 WeakPolarHBondContact CA-O 3.49Å; S322-H397 WeakPolarHBondContact CB-O 3.49Å; S322-H397 PolarHBondContact OG-O 3.46Å; S322-G399 PolarHBondContact N-O 2.95Å
323	Y	93	Very high	94.9	Very high	16 Å²	16	27.2 Å²	27.2	6%	0.063	13%	0.132	C	C	.	.			trans	-75.6	138.4	170.8	-79.8	-86	0	0	0	111.4	F51 P56 Q320 E321 F325 T385 T386 C387	F51-Y323 HydrophobicContact CD2-CE1 4.28Å; F51-Y323 HydrophobicContact CE2-CD1 4.38Å; F51-Y323 HydrophobicContact CE2-CE1 4.1Å; P56-Y323 HydrophobicContact CG-CE2 3.77Å; P56-Y323 WeakPolarHBondContact CG-OH 3.15Å; Q320-Y323 HydrophobicContact CB-CD2 3.87Å; Q320-Y323 HydrophobicContact CB-CG 4.42Å; E321-Y323 PolarHBondContact O-N 3.21Å; E321-Y323 VanDerWaalsContact O-N 3.14Å; Y323-F325 HydrophobicContact CD1-CE1 4.33Å; Y323-F325 HydrophobicContact CD1-CZ 4.05Å; Y323-F325 HydrophobicContact CG-CZ 4.07Å; Y323-T385 HydrophobicContact CD1-CG2 4.07Å; Y323-T386 WeakPolarHBondContact CA-O 3.3Å; Y323-C387 HydrophobicContact CD1-CB 3.96Å; Y323-C387 HydrophobicContact CE1-CB 3.85Å
324	R	94.5	Very high	94.8	Very high	23 Å²	23	27.4 Å²	27.4	9%	0.087	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	132.1	166.8	-57.6	-66.9	179.7	-95	5.5	110.1	Y326 T385 T386 H397 E398 G399 Q400 D401	R324-Y326 HydrophobicContact CB-CD2 4.3Å; R324-Y326 HydrophobicContact CB-CE1 4.3Å; R324-Y326 HydrophobicContact CB-CE2 3.67Å; R324-Y326 HydrophobicContact CG-CE2 4.4Å; R324-T385 CarbonylContact O-C 3.55Å; R324-T385 VanDerWaalsContact O-CA 3.23Å; R324-T385 WeakPolarHBondContact O-CA 3.15Å; R324-T385 WeakPolarHBondContact O-CG2 3.42Å; R324-T386 WeakPolarHBondContact CB-OG1 3.47Å; R324-T386 PolarHBondContact N-O 3.25Å; R324-T386 PolarHBondContact O-N 3.25Å; R324-H397 HydrophobicContact CG-CB 3.86Å; R324-E398 PolarHBondContact NH2-O 2.93Å; R324-G399 PolarHBondContact NH1-O 2.91Å; R324-G399 PolarHBondContact NH2-O 2.81Å; R324-Q400 PolarHBondContact NH1-O 2.9Å; R324-Q400 PolarHBondContact NH2-O 3.02Å; R324-D401 WeakPolarHBondContact CA-OD2 3.33Å
325	F	95.1	Very high	94.6	Very high	5 Å²	5	26.2 Å²	26.2	2%	0.022	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	76.8	-173.4	-57.1	-83.1	0	0	0	111	F51 M59 L317 Y323 S328 M379 F382 T385 D401 Y404	F51-F325 AromaticContact CE2-CE1 3.68Å; F51-F325 HydrophobicContact CE2-CE1 3.68Å; F51-F325 HydrophobicContact CE2-CZ 4.48Å; F51-F325 AromaticContact CZ-CE1 3.98Å; F51-F325 HydrophobicContact CZ-CE1 3.98Å; M59-F325 HydrophobicContact CE-CE1 3.83Å; M59-F325 HydrophobicContact CE-CZ 3.56Å; M59-F325 HydrophobicContact SD-CZ 4.01Å; L317-F325 HydrophobicContact CD2-CE2 3.78Å; L317-F325 HydrophobicContact CD2-CZ 4.11Å; Y323-F325 HydrophobicContact CD1-CE1 4.33Å; Y323-F325 HydrophobicContact CD1-CZ 4.05Å; Y323-F325 HydrophobicContact CG-CZ 4.07Å; F325-S328 VanDerWaalsContact CB-OG 3.26Å; F325-S328 WeakPolarHBondContact CB-OG 3.48Å; F325-S328 PolarHBondContact O-OG 3.03Å; F325-M379 HydrophobicContact CD1-CE 3.85Å; F325-M379 HydrophobicContact CD2-CE 4.08Å; F325-M379 HydrophobicContact CE1-CE 3.99Å; F325-M379 HydrophobicContact CE2-CE 4.24Å; F325-M379 HydrophobicContact CG-CE 3.89Å; F325-M379 HydrophobicContact CZ-CE 4.2Å; F325-F382 HydrophobicContact CD1-CD1 4.17Å; F325-F382 HydrophobicContact CD1-CE1 4.36Å; F325-F382 HydrophobicContact CE1-CD1 4.47Å; F325-T385 HydrophobicContact CD1-CG2 3.7Å; F325-T385 HydrophobicContact CE1-CG2 3.79Å; F325-D401 PolarHBondContact N-OD2 3.37Å; F325-Y404 HydrophobicContact CB-CD2 3.83Å; F325-Y404 HydrophobicContact CB-CE2 4.12Å; F325-Y404 HydrophobicContact CD2-CD2 4.49Å
326	Y	93.9	Very high	94.4	Very high	12 Å²	12	23.8 Å²	23.8	5%	0.047	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	137.8	-179.6	-57.5	-59.7	0	0	0	112.3	R225 R324 S328 H384 T386 H397	R225-Y326 HydrophobicContact CB-CE1 4.45Å; R225-Y326 HydrophobicContact CG-CD1 4.2Å; R225-Y326 HydrophobicContact CG-CE1 4.02Å; R324-Y326 HydrophobicContact CB-CD2 4.3Å; R324-Y326 HydrophobicContact CB-CE1 4.3Å; R324-Y326 HydrophobicContact CB-CE2 3.67Å; R324-Y326 HydrophobicContact CG-CE2 4.4Å; Y326-S328 PolarHBondContact O-N 3.16Å; Y326-H384 WeakPolarHBondContact CD2-O 3.44Å; Y326-H384 WeakPolarHBondContact O-CB 3.46Å; Y326-T386 HydrophobicContact CD2-CG2 4.35Å; Y326-T386 HydrophobicContact CE2-CG2 4.22Å; Y326-H397 PolarHBondContact OH-CE1 3.45Å; Y326-H397 VanDerWaalsContact OH-CE1 3.29Å; Y326-H397 PolarHBondContact OH-NE2 3.42Å
327	S	91	Very high	93.9	Very high	21 Å²	21	27.3 Å²	27.3	15%	0.147	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	22.2	179.1	-81	0	0	0	0	114.4	K221 Q226 Q239	K221-S327 VanDerWaalsContact CE-C 3.49Å; K221-S327 WeakPolarHBondContact CE-O 3.46Å; K221-S327 PolarHBondContact NZ-O 2.97Å; Q226-S327 PolarHBondContact O-OG 3.31Å; Q239-S327 PolarHBondContact NE2-OG 2.75Å
328	S	95.3	Very high	93.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.141	C	C	.	.			trans	-84	156	174.4	60.2	0	0	0	0	111.3	K221 M222 F325 Y326 D381 Y404	K221-S328 WeakPolarHBondContact CE-O 3.23Å; M222-S328 PolarHBondContact N-O 3.21Å; F325-S328 VanDerWaalsContact CB-OG 3.26Å; F325-S328 WeakPolarHBondContact CB-OG 3.48Å; F325-S328 PolarHBondContact O-OG 3.03Å; Y326-S328 PolarHBondContact O-N 3.16Å; S328-D381 WeakPolarHBondContact CA-O 3.22Å; S328-D381 WeakPolarHBondContact CB-O 3.34Å; S328-Y404 VanDerWaalsContact OG-CE2 3.24Å; S328-Y404 WeakPolarHBondContact OG-CE2 3.38Å
329	S	96.3	Very high	92	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	153.1	-176.9	-86.8	0	0	0	0	111.5	D219 L220 K221 M379 I380	D219-S329 WeakPolarHBondContact OD1-CB 3.11Å; D219-S329 PolarHBondContact OD1-OG 3.13Å; L220-S329 CarbonylContact O-C 3.56Å; L220-S329 WeakPolarHBondContact O-CA 3.48Å; K221-S329 WeakPolarHBondContact CE-OG 3.24Å; K221-S329 PolarHBondContact NZ-OG 2.86Å; S329-M379 CarbonylContact O-C 3.6Å; S329-M379 WeakPolarHBondContact O-CA 3.27Å; S329-I380 PolarHBondContact N-O 3.38Å; S329-I380 PolarHBondContact O-N 3.19Å
330	L	97.8	Very high	90.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	125.3	167.4	-172.2	75.4	0	0	0	108.6	L220 M222 L310 L313 V377 M379 L408 L411	L220-L330 HydrophobicContact CB-CB 4.41Å; L220-L330 PolarHBondContact N-O 3.15Å; L220-L330 PolarHBondContact O-N 3.23Å; M222-L330 HydrophobicContact CG-CB 3.8Å; M222-L330 HydrophobicContact SD-CB 3.93Å; M222-L330 HydrophobicContact SD-CD2 4.38Å; L310-L330 HydrophobicContact CD2-CD2 3.5Å; L313-L330 HydrophobicContact CD2-CD1 3.47Å; L313-L330 VanDerWaalsContact CD2-CD1 3.47Å; L330-V377 HydrophobicContact CD1-CG1 3.82Å; L330-V377 HydrophobicContact CD2-CG1 4.38Å; L330-V377 HydrophobicContact CG-CG1 4.21Å; L330-M379 HydrophobicContact CD1-CG 4.12Å; L330-L408 HydrophobicContact CD2-CD2 3.88Å; L330-L411 HydrophobicContact CD2-CD2 3.81Å
331	L	97.7	Very high	88.5	Confident	18 Å²	18	44.9 Å²	44.9	9%	0.094	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	124.5	-179.9	-159.1	67.5	0	0	0	109.3	L208 V217 L218 D219 I333 V377 R378 I380	L208-L331 HydrophobicContact CD1-CD2 3.93Å; V217-L331 HydrophobicContact CG1-CD1 3.42Å; V217-L331 VanDerWaalsContact CG1-CD1 3.42Å; V217-L331 HydrophobicContact CG1-CD2 4.31Å; V217-L331 HydrophobicContact CG1-CG 3.97Å; L218-L331 CarbonylContact O-C 3.52Å; L218-L331 WeakPolarHBondContact O-CA 3.18Å; D219-L331 HydrophobicContact CB-CD1 3.97Å; L331-I333 HydrophobicContact CD2-CD1 3.64Å; L331-I333 HydrophobicContact CD2-CG1 4.05Å; L331-I333 HydrophobicContact CG-CD1 4.08Å; L331-I333 HydrophobicContact CG-CG1 3.9Å; L331-V377 CarbonylContact O-C 3.48Å; L331-V377 VanDerWaalsContact O-CA 3.29Å; L331-V377 WeakPolarHBondContact O-CA 3.23Å; L331-R378 PolarHBondContact N-O 3.29Å; L331-R378 PolarHBondContact O-N 2.89Å; L331-I380 HydrophobicContact CB-CD1 4.38Å; L331-I380 HydrophobicContact CD1-CD1 4.39Å; L331-I380 HydrophobicContact CD2-CD1 4.46Å
332	I	98.2	Very high	86.4	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	126.9	171.2	-53.9	-179.9	0	0	0	107.8	L218 L220 F291 V306 V375 D376 V377	L218-I332 HydrophobicContact CB-CB 4.42Å; L218-I332 HydrophobicContact CD2-CD1 4.42Å; L218-I332 PolarHBondContact N-O 2.75Å; L218-I332 PolarHBondContact O-N 3.09Å; L220-I332 HydrophobicContact CD1-CD1 4.26Å; F291-I332 HydrophobicContact CE1-CB 4.12Å; F291-I332 HydrophobicContact CE1-CG2 3.75Å; F291-I332 HydrophobicContact CZ-CB 4.32Å; F291-I332 HydrophobicContact CZ-CG2 4.18Å; F291-I332 WeakPolarHBondContact CZ-O 3.24Å; V306-I332 HydrophobicContact CG1-CD1 4.16Å; V306-I332 HydrophobicContact CG2-CG2 4.2Å; I332-V375 HydrophobicContact CG2-CG1 4.27Å; I332-D376 WeakPolarHBondContact CA-O 3.21Å; I332-V377 HydrophobicContact CG1-CG2 4.38Å; I332-V377 HydrophobicContact CG2-CG2 4.43Å
333	I	97.4	Very high	84.2	Confident	1 Å²	1	49 Å²	49	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	139.1	-175.7	-44.4	176.5	0	0	0	110.3	L208 T209 Y212 P215 C216 V217 L331 V375 D376	L208-I333 HydrophobicContact CB-CD1 3.57Å; L208-I333 HydrophobicContact CD1-CD1 4.28Å; T209-I333 HydrophobicContact CG2-CD1 4.39Å; Y212-I333 HydrophobicContact CD2-CG2 3.6Å; Y212-I333 HydrophobicContact CE2-CB 3.99Å; Y212-I333 HydrophobicContact CE2-CG2 3.31Å; Y212-I333 HydrophobicContact CG-CG2 4.36Å; P215-I333 HydrophobicContact CB-CG2 4.29Å; C216-I333 VanDerWaalsContact O-CA 3.26Å; C216-I333 WeakPolarHBondContact O-CA 3.41Å; C216-I333 WeakPolarHBondContact O-CG2 3.32Å; V217-I333 HydrophobicContact CG1-CG1 4.39Å; V217-I333 HydrophobicContact CG2-CG2 4.2Å; L331-I333 HydrophobicContact CD2-CD1 3.64Å; L331-I333 HydrophobicContact CD2-CG1 4.05Å; L331-I333 HydrophobicContact CG-CD1 4.08Å; L331-I333 HydrophobicContact CG-CG1 3.9Å; I333-V375 CarbonylContact O-C 3.48Å; I333-V375 WeakPolarHBondContact O-CA 3.18Å; I333-D376 PolarHBondContact N-O 3.22Å; I333-D376 PolarHBondContact O-N 2.93Å
334	Y	96.4	Very high	81.9	Confident	3 Å²	3	53.5 Å²	53.5	1%	0.012	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	166	169	69.7	-90.3	0	0	0	110.8	C216 F291 L302 G336	C216-Y334 HydrophobicContact CB-CD1 3.78Å; C216-Y334 HydrophobicContact CB-CD2 4.11Å; C216-Y334 HydrophobicContact CB-CE1 3.33Å; C216-Y334 HydrophobicContact CB-CE2 3.7Å; C216-Y334 HydrophobicContact CB-CG 4.13Å; C216-Y334 PolarHBondContact N-O 3.05Å; C216-Y334 PolarHBondContact O-N 2.93Å; C216-Y334 VanDerWaalsContact O-N 3.12Å; C216-Y334 PolarHBondContact SG-OH 3.47Å; C216-Y334 VanDerWaalsContact SG-OH 3.38Å; F291-Y334 HydrophobicContact CD1-CE1 4.28Å; F291-Y334 HydrophobicContact CD2-CE1 4.36Å; F291-Y334 AromaticContact CE1-CD1 3.94Å; F291-Y334 HydrophobicContact CE1-CD1 3.94Å; F291-Y334 AromaticContact CE1-CE1 3.74Å; F291-Y334 HydrophobicContact CE1-CE1 3.74Å; F291-Y334 HydrophobicContact CE2-CD1 4.35Å; F291-Y334 AromaticContact CE2-CE1 3.79Å; F291-Y334 HydrophobicContact CE2-CE1 3.79Å; F291-Y334 AromaticContact CZ-CD1 3.65Å; F291-Y334 HydrophobicContact CZ-CD1 3.65Å; F291-Y334 AromaticContact CZ-CE1 3.47Å; F291-Y334 HydrophobicContact CZ-CE1 3.47Å; F291-Y334 VanDerWaalsContact CZ-CE1 3.47Å; F291-Y334 PolarHBondContact O-OH 3.2Å; L302-Y334 HydrophobicContact CD1-CD1 3.9Å; L302-Y334 HydrophobicContact CD1-CD2 3.48Å; L302-Y334 VanDerWaalsContact CD1-CD2 3.48Å; L302-Y334 HydrophobicContact CD1-CE1 4.08Å; L302-Y334 HydrophobicContact CD1-CE2 3.68Å; L302-Y334 HydrophobicContact CD1-CG 3.61Å; L302-Y334 HydrophobicContact CD2-CD2 4.38Å; L302-Y334 HydrophobicContact CD2-CG 4.4Å; Y334-G336 PolarHBondContact O-N 3.01Å
335	D	94.5	Very high	79.3	Confident	14 Å²	14	60.4 Å²	60.4	8%	0.075	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	118.8	174.6	-147	-29.6	0	0	0	110.8	Y212 E213 V214 K337	Y212-D335 HydrophobicContact CD1-CB 3.71Å; Y212-D335 HydrophobicContact CE1-CB 4.44Å; E213-D335 PolarHBondContact N-OD1 3.3Å; E213-D335 PolarHBondContact N-OD2 3.1Å; V214-D335 PolarHBondContact N-OD1 2.71Å; D335-K337 VanDerWaalsContact C-N 3.25Å; D335-K337 PolarHBondContact O-N 3.07Å; D335-K337 PolarHBondContact OD1-N 3.06Å
336	G	91.9	Very high	76.9	Confident	1 Å²	1	64.4 Å²	64.4	1%	0.01	34%	0.341	C	S	.	.	S	Bend	trans	-66.7	-29.5	174.2	0	0	0	0	0	112.3	V214 C216 Y334	V214-G336 WeakPolarHBondContact O-CA 3.47Å; V214-G336 PolarHBondContact O-N 3.42Å; C216-G336 VanDerWaalsContact SG-CA 3.58Å; Y334-G336 PolarHBondContact O-N 3.01Å
337	K	86.5	Confident	74.5	Confident	90 Å²	90	70.2 Å²	70.2	39%	0.391	37%	0.372	S	S	.	.	S	Bend	trans	-87.3	121.6	176.9	-164.6	-175	176.5	-167.1	0	110.1	E213 V214 D335 R339	E213-K337 HydrophobicContact CG-CD 4.3Å; E213-K337 WeakPolarHBondContact OE1-CD 3.47Å; E213-K337 IonicContact OE1-NZ 2.62Å; E213-K337 PolarHBondContact OE1-NZ 3.04Å; E213-K337 WeakPolarHBondContact OE2-CD 3.28Å; E213-K337 IonicContact OE2-NZ 2.81Å; E213-K337 PolarHBondContact OE2-NZ 2.9Å; V214-K337 HydrophobicContact CB-CB 4.42Å; V214-K337 HydrophobicContact CG2-CB 4.09Å; D335-K337 VanDerWaalsContact C-N 3.25Å; D335-K337 PolarHBondContact O-N 3.07Å; D335-K337 PolarHBondContact OD1-N 3.06Å; K337-R339 PolarHBondContact O-N 2.93Å
338	E	81.3	Confident	72.3	Confident	73 Å²	73	74.4 Å²	74.4	34%	0.341	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-74.4	124.9	177.7	-68.3	172.6	-126.4	0	0	109.3	N294 Y297 R299 Q340	N294-E338 PolarHBondContact ND2-OE1 3.4Å; Y297-E338 PolarHBondContact OH-OE1 3.29Å; Y297-E338 PolarHBondContact OH-OE2 3.4Å; R299-E338 WeakPolarHBondContact CD-OE1 3.47Å; R299-E338 IonicContact CZ-OE1 2.9Å; R299-E338 IonicContact NE-OE1 3.07Å; R299-E338 IonicContact NH1-OE1 3.02Å; R299-E338 PolarHBondContact NH1-OE1 3.04Å; E338-Q340 PolarHBondContact O-N 3.14Å
339	R	70.5	Confident	70	Confident	188 Å²	188	82.8 Å²	82.8	71%	0.709	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-73.7	122.3	170.1	-66.4	-177	-174.5	-169.5	1.8	106.6	K337 E341	K337-R339 PolarHBondContact O-N 2.93Å; R339-E341 PolarHBondContact O-N 3.01Å
340	Q	56.3	Low	67.5	Low	180 Å²	180	90.4 Å²	90.4	84%	0.841	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-63.1	122.3	169.2	-76.6	-177.2	-22.1	0	0	107.5	E338 V342	E338-Q340 PolarHBondContact O-N 3.14Å; Q340-V342 PolarHBondContact O-N 2.68Å
341	E	54.6	Low	65	Low	169 Å²	169	98 Å²	98	79%	0.79	52%	0.519	S	S	*	.			trans	-60.3	110.8	164	-68.6	-172.9	173	0	0	106.3	R339 A343	R339-E341 PolarHBondContact O-N 3.01Å; E341-A343 VanDerWaalsContact C-N 3.27Å; E341-A343 PolarHBondContact O-N 2.7Å
342	V	43.9	Very low	62.4	Low	126 Å²	126	106.2 Å²	106.2	76%	0.764	56%	0.557	S	S	*	*			trans	-67.5	101.3	165.3	-173.7	0	0	0	0	103.9	Q340 V344	Q340-V342 PolarHBondContact O-N 2.68Å; V342-V344 VanDerWaalsContact C-N 3.27Å; V342-V344 PolarHBondContact O-N 3.26Å
343	A	41.9	Very low	59.6	Low	88 Å²	88	113.1 Å²	113.1	73%	0.727	59%	0.594	S	S	*	*			trans	-56.3	101.9	165.5	0	0	0	0	0	105.7	E341 D345	E341-A343 VanDerWaalsContact C-N 3.27Å; E341-A343 PolarHBondContact O-N 2.7Å; A343-D345 VanDerWaalsContact C-N 3.3Å; A343-D345 PolarHBondContact O-N 3.42Å
344	V	44.6	Very low	57	Low	112 Å²	112	121.7 Å²	121.7	68%	0.679	64%	0.639	S	S	*	*			trans	-71.4	102.6	165.7	-165.5	0	0	0	0	103.3	V342 S346	V342-V344 VanDerWaalsContact C-N 3.27Å; V342-V344 PolarHBondContact O-N 3.26Å; V344-S346 WeakPolarHBondContact CG1-OG 3.47Å; V344-S346 PolarHBondContact O-N 3.12Å
345	D	40.7	Very low	54.7	Low	167 Å²	167	126.7 Å²	126.7	89%	0.893	67%	0.674	S	S	*	*			trans	-59.2	82.4	158	-93.7	-19.8	0	0	0	106.1	A343	A343-D345 VanDerWaalsContact C-N 3.3Å; A343-D345 PolarHBondContact O-N 3.42Å
346	S	45.4	Very low	52.2	Low	90 Å²	90	134.8 Å²	134.8	63%	0.629	71%	0.711	S	S	*	*			trans	-106.8	110.7	162.4	-64.7	0	0	0	0	105.4	V344	V344-S346 WeakPolarHBondContact CG1-OG 3.47Å; V344-S346 PolarHBondContact O-N 3.12Å
347	D	42.4	Very low	49.8	Very low	133 Å²	133	143.3 Å²	143.3	71%	0.711	75%	0.751	S	S	*	*			trans	-45	139	172.8	-103.1	-44	0	0	0	110.5	E349	D347-E349 PolarHBondContact O-N 2.86Å
348	P	44.2	Very low	47.2	Very low	109 Å²	109	144.9 Å²	144.9	71%	0.708	77%	0.773	S	S	*	*	G	3₁₀ helix	trans	-68.1	-3	-179.6	-15	29.1	0	0	0	114.4
349	E	47.7	Very low	45.3	Very low	177 Å²	177	146.6 Å²	146.6	83%	0.827	79%	0.793	S	S	*	*	G	3₁₀ helix	trans	-90.1	-5.5	-168.8	-62.6	-155.3	158.8	0	0	115.3	D347	D347-E349 PolarHBondContact O-N 2.86Å
350	D	42.8	Very low	43.4	Very low	159 Å²	159	145.6 Å²	145.6	85%	0.85	80%	0.802	S	S	*	*	G	3₁₀ helix	trans	-98.5	11.5	179.9	-83.3	-21.5	0	0	0	114.5
351	L	45.7	Very low	42.8	Very low	161 Å²	161	146 Å²	146	84%	0.843	80%	0.804	S	S	*	*			trans	-103.6	9.8	-173.1	-93.1	166.6	0	0	0	116.2
352	E	42.9	Very low	41.8	Very low	190 Å²	190	143.6 Å²	143.6	89%	0.888	81%	0.805	S	S	*	*	S	Bend	trans	-100.1	3.7	-176.2	-78.1	-161.5	167.7	0	0	116.9
353	D	39.8	Very low	41.5	Very low	144 Å²	144	142.4 Å²	142.4	77%	0.77	81%	0.809	S	S	*	*	S	Bend	trans	-130.7	42.7	-170.7	-159.1	25.3	0	0	0	116.9
354	L	42.7	Very low	40.8	Very low	182 Å²	182	140.7 Å²	140.7	95%	0.953	80%	0.8	S	S	*	*			trans	-149.2	62.6	162.2	-70.3	-178.9	0	0	0	112.3
355	S	47.8	Very low	40.6	Very low	107 Å²	107	140.5 Å²	140.5	75%	0.748	81%	0.81	S	S	*	*			trans	-113.9	86.3	155.5	65.9	0	0	0	0	109
356	E	43.3	Very low	40.2	Very low	185 Å²	185	142.7 Å²	142.7	86%	0.864	81%	0.807	S	S	*	*			trans	-171.1	122.7	150.6	-105.1	163.9	-146.6	0	0	110.8
357	E	39.8	Very low	39.7	Very low	180 Å²	180	142.9 Å²	142.9	84%	0.841	81%	0.814	S	S	*	*			trans	55.8	105.1	146.3	-57.9	-89.1	142.6	0	0	119
358	S	32.2	Very low	39.1	Very low	122 Å²	122	145.9 Å²	145.9	85%	0.853	82%	0.817	S	S	*	*				175.5	137	116.3	45.8	0	0	0	0	112.7
359	S	41.7	Very low	38.5	Very low	110 Å²	110	148.6 Å²	148.6	77%	0.769	82%	0.818	S	S	*	*			trans	-78.4	118	167.2	49.8	0	0	0	0	110.2
360	D	31.3	Very low	38	Very low	167 Å²	167	144.9 Å²	144.9	89%	0.893	81%	0.809	S	S	*	*			trans	-171.3	151.8	140.6	-107.1	-21.6	0	0	0	113.2
361	E	42.8	Very low	38	Very low	189 Å²	189	142.1 Å²	142.1	88%	0.883	80%	0.798	S	S	*	*			trans	-73	157.2	-179.5	-69	-144.6	145.5	0	0	114.3
362	S	33.9	Very low	38.3	Very low	117 Å²	117	138 Å²	138	82%	0.818	79%	0.787	S	S	*	*			trans	105.6	118.5	158.8	-162.6	0	0	0	0	117.2
363	A	37.6	Very low	39.1	Very low	102 Å²	102	130.7 Å²	130.7	84%	0.843	76%	0.757	S	S	*	*			trans	60.6	104.8	155.8	0	0	0	0	0	118.4
364	G	27.3	Very low	41.1	Very low	52 Å²	52	127 Å²	127	54%	0.536	74%	0.74	S	S	.	*			trans	-176.5	115.4	162	0	0	0	0	0	112	Y366	G364-Y366 VanDerWaalsContact O-CD2 3.22Å; G364-Y366 WeakPolarHBondContact O-CD2 3.28Å; G364-Y366 PolarHBondContact O-N 2.94Å; G364-Y366 VanDerWaalsContact O-N 3.08Å
365	A	40.1	Very low	43.5	Very low	108 Å²	108	118.8 Å²	118.8	89%	0.893	70%	0.697	S	S	*	*			trans	-61.3	104.6	171.4	0	0	0	0	0	110.1
366	Y	32.1	Very low	45.8	Very low	212 Å²	212	114.1 Å²	114.1	83%	0.831	66%	0.664	S	S	*	*			trans	-115.4	112.7	172.3	-71.6	-77.2	0	0	0	110.4	G364 Y368	G364-Y366 VanDerWaalsContact O-CD2 3.22Å; G364-Y366 WeakPolarHBondContact O-CD2 3.28Å; G364-Y366 PolarHBondContact O-N 2.94Å; G364-Y366 VanDerWaalsContact O-N 3.08Å; Y366-Y368 PolarHBondContact O-N 2.66Å
367	A	34.8	Very low	48.4	Very low	94 Å²	94	105.3 Å²	105.3	78%	0.777	62%	0.623	S	S	*	*			trans	24.7	91.1	153.8	0	0	0	0	0	116.9	K369	A367-K369 PolarHBondContact O-N 2.69Å
368	Y	31.2	Very low	51.2	Low	197 Å²	197	98 Å²	98	77%	0.773	59%	0.587	S	S	*	*			trans	-70	95.7	162.2	-164.5	-95.3	0	0	0	108.8	Y366 P370	Y366-Y368 PolarHBondContact O-N 2.66Å; Y368-P370 WeakPolarHBondContact O-CD 3.31Å
369	K	31.8	Very low	54.3	Low	165 Å²	165	92.1 Å²	92.1	72%	0.717	55%	0.547	S	S	*	.			trans	-56.3	121.1	158.8	-74.3	-175.8	175	-179.3	0	106.8	A367 T371	A367-K369 PolarHBondContact O-N 2.69Å; K369-T371 HydrophobicContact CB-CG2 4.1Å; K369-T371 PolarHBondContact O-N 3.27Å
370	P	35.9	Very low	56.9	Low	100 Å²	100	88.2 Å²	88.2	65%	0.649	52%	0.517	S	S	*	.			trans	-72	87	177.1	29.1	-31.3	0	0	0	108.2	Y368	Y368-P370 WeakPolarHBondContact O-CD 3.31Å
371	T	42.8	Very low	59.9	Low	100 Å²	100	82.2 Å²	82.2	61%	0.613	49%	0.485	S	S	*	.			trans	-95.1	132.3	176.1	54.3	0	0	0	0	110	K369	K369-T371 HydrophobicContact CB-CG2 4.1Å; K369-T371 PolarHBondContact O-N 3.27Å
372	A	53	Low	62.3	Low	75 Å²	75	73.2 Å²	73.2	62%	0.62	44%	0.443	S	S	*	.	S	Bend	trans	75.9	126	172.6	0	0	0	0	0	117.4	T374	A372-T374 PolarHBondContact O-N 3.02Å
373	S	59.8	Low	65.1	Low	37 Å²	37	68.3 Å²	68.3	26%	0.259	41%	0.409	S	S	.	.			trans	-49.6	111.2	157.5	47.8	0	0	0	0	109.2	E301 V375	E301-S373 PolarHBondContact O-OG 2.95Å; S373-V375 PolarHBondContact O-N 3.29Å
374	T	81.6	Confident	67.6	Low	67 Å²	67	64.6 Å²	64.6	41%	0.411	38%	0.375	S	S	.	.			trans	-74.8	98.3	-171.9	53.4	0	0	0	0	110.3	Y212 A372	Y212-T374 VanDerWaalsContact CE1-O 3.23Å; Y212-T374 WeakPolarHBondContact CE1-O 3.24Å; Y212-T374 PolarHBondContact OH-O 3.01Å; A372-T374 PolarHBondContact O-N 3.02Å
375	V	93.4	Very high	70.7	Confident	8 Å²	8	62.1 Å²	62.1	5%	0.048	35%	0.349	C	S	.	.			trans	-92.1	140.4	168.3	177.5	0	0	0	0	109.2	L302 V306 K309 I332 I333 S373 V377	L302-V375 HydrophobicContact CB-CG2 4.12Å; L302-V375 HydrophobicContact CD2-CG2 3.68Å; L302-V375 HydrophobicContact CG-CG2 4.46Å; V306-V375 HydrophobicContact CG2-CB 4.46Å; V306-V375 HydrophobicContact CG2-CG1 3.58Å; V306-V375 HydrophobicContact CG2-CG2 4.24Å; K309-V375 WeakPolarHBondContact CE-O 3.46Å; K309-V375 PolarHBondContact NZ-O 3.25Å; I332-V375 HydrophobicContact CG2-CG1 4.27Å; I333-V375 CarbonylContact O-C 3.48Å; I333-V375 WeakPolarHBondContact O-CA 3.18Å; S373-V375 PolarHBondContact O-N 3.29Å; V375-V377 HydrophobicContact CG1-CG2 4.22Å
376	D	95.8	Very high	73.1	Confident	9 Å²	9	57.1 Å²	57.1	5%	0.048	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	144.8	164.5	-155.1	19.4	0	0	0	112.9	R211 Y212 K309 I332 I333 R378	R211-D376 IonicContact CZ-OD2 2.68Å; R211-D376 IonicContact NH1-OD2 3.84Å; R211-D376 VanDerWaalsContact NH2-CG 3.33Å; R211-D376 IonicContact NH2-OD2 2.64Å; R211-D376 PolarHBondContact NH2-OD2 3.32Å; Y212-D376 WeakPolarHBondContact OH-CB 3.49Å; Y212-D376 PolarHBondContact OH-N 3.25Å; K309-D376 IonicContact NZ-OD1 3.6Å; K309-D376 PolarHBondContact NZ-OD1 3.17Å; I332-D376 WeakPolarHBondContact CA-O 3.21Å; I333-D376 PolarHBondContact N-O 3.22Å; I333-D376 PolarHBondContact O-N 2.93Å; D376-R378 IonicContact OD1-NE 2.71Å; D376-R378 PolarHBondContact OD1-NE 3.23Å; D376-R378 VanDerWaalsContact OD2-CG 3.31Å; D376-R378 WeakPolarHBondContact OD2-CG 3.34Å; D376-R378 IonicContact OD2-CZ 3.81Å; D376-R378 IonicContact OD2-NE 2.66Å; D376-R378 PolarHBondContact OD2-NE 3.45Å; D376-R378 IonicContact OD2-NH2 2.69Å; D376-R378 PolarHBondContact OD2-NH2 3.37Å
377	V	97.8	Very high	75.8	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	112.7	179.7	177.9	0	0	0	0	107.5	K309 L310 L330 L331 I332 V375	K309-V377 HydrophobicContact CB-CB 3.99Å; K309-V377 HydrophobicContact CB-CG2 3.83Å; K309-V377 HydrophobicContact CD-CB 4.19Å; K309-V377 HydrophobicContact CD-CG2 4.04Å; L310-V377 HydrophobicContact CD2-CG1 3.84Å; L330-V377 HydrophobicContact CD1-CG1 3.82Å; L330-V377 HydrophobicContact CD2-CG1 4.38Å; L330-V377 HydrophobicContact CG-CG1 4.21Å; L331-V377 CarbonylContact O-C 3.48Å; L331-V377 VanDerWaalsContact O-CA 3.29Å; L331-V377 WeakPolarHBondContact O-CA 3.23Å; I332-V377 HydrophobicContact CG1-CG2 4.38Å; I332-V377 HydrophobicContact CG2-CG2 4.43Å; V375-V377 HydrophobicContact CG1-CG2 4.22Å
378	R	97.7	Very high	78.2	Confident	26 Å²	26	46.6 Å²	46.6	10%	0.098	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	137.9	-174.6	-60.7	-72.6	-171.1	115.9	19.1	111.7	F62 T63 E206 L208 L331 D376	F62-R378 CarbonylContact O-C 3.57Å; F62-R378 VanDerWaalsContact O-CA 3.3Å; F62-R378 WeakPolarHBondContact O-CA 3.38Å; T63-R378 PolarHBondContact O-NH1 3.43Å; E206-R378 IonicContact OE1-NH2 3.57Å; E206-R378 PolarHBondContact OE1-NH2 3.21Å; E206-R378 VanDerWaalsContact OE1-NH2 3.07Å; E206-R378 IonicContact OE2-CZ 2.89Å; E206-R378 IonicContact OE2-NH1 3.7Å; E206-R378 PolarHBondContact OE2-NH1 3.04Å; E206-R378 IonicContact OE2-NH2 3.92Å; E206-R378 PolarHBondContact OE2-NH2 3.04Å; L208-R378 HydrophobicContact CD1-CB 3.69Å; L208-R378 HydrophobicContact CD1-CG 3.65Å; L208-R378 HydrophobicContact CD2-CG 3.81Å; L208-R378 HydrophobicContact CG-CG 4.38Å; L331-R378 PolarHBondContact N-O 3.29Å; L331-R378 PolarHBondContact O-N 2.89Å; D376-R378 IonicContact OD1-NE 2.71Å; D376-R378 PolarHBondContact OD1-NE 3.23Å; D376-R378 VanDerWaalsContact OD2-CG 3.31Å; D376-R378 WeakPolarHBondContact OD2-CG 3.34Å; D376-R378 IonicContact OD2-CZ 3.81Å; D376-R378 IonicContact OD2-NE 2.66Å; D376-R378 PolarHBondContact OD2-NE 3.45Å; D376-R378 IonicContact OD2-NH2 2.69Å; D376-R378 PolarHBondContact OD2-NH2 3.37Å
379	M	97.9	Very high	80.7	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	140	165	-60.3	178.3	65.4	0	0	109.7	M59 F62 T63 P64 L313 L317 F325 S329 L330 F382 Y404	M59-M379 HydrophobicContact CE-CE 4.1Å; M59-M379 HydrophobicContact CE-SD 3.8Å; F62-M379 PolarHBondContact O-N 3.49Å; T63-M379 HydrophobicContact CG2-CB 4.34Å; P64-M379 VanDerWaalsContact CD-O 3.26Å; P64-M379 WeakPolarHBondContact CD-O 3.26Å; L313-M379 HydrophobicContact CD1-CG 4.2Å; L313-M379 HydrophobicContact CD1-SD 3.63Å; L313-M379 HydrophobicContact CD2-CG 4.02Å; L313-M379 HydrophobicContact CD2-SD 4.34Å; L317-M379 HydrophobicContact CD1-CE 4.18Å; L317-M379 HydrophobicContact CD1-SD 4.02Å; L317-M379 HydrophobicContact CD2-CE 4.12Å; L317-M379 HydrophobicContact CD2-SD 3.9Å; L317-M379 HydrophobicContact CG-SD 4.37Å; F325-M379 HydrophobicContact CD1-CE 3.85Å; F325-M379 HydrophobicContact CD2-CE 4.08Å; F325-M379 HydrophobicContact CE1-CE 3.99Å; F325-M379 HydrophobicContact CE2-CE 4.24Å; F325-M379 HydrophobicContact CG-CE 3.89Å; F325-M379 HydrophobicContact CZ-CE 4.2Å; S329-M379 CarbonylContact O-C 3.6Å; S329-M379 WeakPolarHBondContact O-CA 3.27Å; L330-M379 HydrophobicContact CD1-CG 4.12Å; M379-F382 VanDerWaalsContact C-CZ 3.49Å; M379-F382 HydrophobicContact CB-CE1 3.88Å; M379-F382 HydrophobicContact CB-CZ 3.67Å; M379-F382 HydrophobicContact CE-CE1 4.27Å; M379-F382 VanDerWaalsContact O-CZ 3.31Å; M379-F382 WeakPolarHBondContact O-CZ 3.47Å; M379-Y404 HydrophobicContact CE-CE1 4.26Å; M379-Y404 HydrophobicContact CE-CE2 3.89Å
380	I	96.1	Very high	83.2	Confident	27 Å²	27	37.5 Å²	37.5	14%	0.138	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	172	177.5	65.8	174.1	0	0	0	110.3	P64 S329 L331	P64-I380 HydrophobicContact CG-CG2 3.94Å; S329-I380 PolarHBondContact N-O 3.38Å; S329-I380 PolarHBondContact O-N 3.19Å; L331-I380 HydrophobicContact CB-CD1 4.38Å; L331-I380 HydrophobicContact CD1-CD1 4.39Å; L331-I380 HydrophobicContact CD2-CD1 4.46Å
381	D	93.9	Very high	84.8	Confident	41 Å²	41	36.8 Å²	36.8	22%	0.219	22%	0.221	C	C	.	.			trans	62.6	74.7	177.9	-65.4	-16.6	0	0	0	114.1	K221 S328	K221-D381 IonicContact NZ-OD2 3.25Å; S328-D381 WeakPolarHBondContact CA-O 3.22Å; S328-D381 WeakPolarHBondContact CB-O 3.34Å
382	F	94.6	Very high	86.2	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.221	C	C	.	.			trans	-96.4	12.5	-176	-54.1	-68.3	0	0	0	114.5	E48 F51 Y52 T63 F325 M379 H384 T385	E48-F382 HydrophobicContact CG-CB 4.13Å; E48-F382 PolarHBondContact OE1-N 3.37Å; F51-F382 HydrophobicContact CB-CB 3.95Å; F51-F382 HydrophobicContact CD1-CB 3.47Å; F51-F382 VanDerWaalsContact CD1-CB 3.47Å; F51-F382 AromaticContact CD1-CD1 3.76Å; F51-F382 HydrophobicContact CD1-CD1 3.76Å; F51-F382 AromaticContact CD1-CD2 3.31Å; F51-F382 HydrophobicContact CD1-CD2 3.31Å; F51-F382 HydrophobicContact CD1-CE1 4.33Å; F51-F382 AromaticContact CD1-CE2 3.93Å; F51-F382 HydrophobicContact CD1-CE2 3.93Å; F51-F382 AromaticContact CD1-CG 3.2Å; F51-F382 HydrophobicContact CD1-CG 3.2Å; F51-F382 HydrophobicContact CD1-CZ 4.4Å; F51-F382 HydrophobicContact CD2-CB 4.46Å; F51-F382 HydrophobicContact CE1-CB 4.09Å; F51-F382 AromaticContact CE1-CD1 3.43Å; F51-F382 HydrophobicContact CE1-CD1 3.43Å; F51-F382 VanDerWaalsContact CE1-CD1 3.43Å; F51-F382 AromaticContact CE1-CD2 3.34Å; F51-F382 HydrophobicContact CE1-CD2 3.34Å; F51-F382 AromaticContact CE1-CE1 3.56Å; F51-F382 HydrophobicContact CE1-CE1 3.56Å; F51-F382 AromaticContact CE1-CE2 3.47Å; F51-F382 HydrophobicContact CE1-CE2 3.47Å; F51-F382 VanDerWaalsContact CE1-CE2 3.47Å; F51-F382 AromaticContact CE1-CG 3.31Å; F51-F382 HydrophobicContact CE1-CG 3.31Å; F51-F382 AromaticContact CE1-CZ 3.58Å; F51-F382 HydrophobicContact CE1-CZ 3.58Å; F51-F382 HydrophobicContact CE2-CD1 4.3Å; F51-F382 HydrophobicContact CG-CB 3.68Å; F51-F382 HydrophobicContact CG-CD1 4.3Å; F51-F382 HydrophobicContact CG-CD2 4.36Å; F51-F382 AromaticContact CG-CG 3.87Å; F51-F382 HydrophobicContact CG-CG 3.87Å; F51-F382 AromaticContact CZ-CD1 3.72Å; F51-F382 HydrophobicContact CZ-CD1 3.72Å; F51-F382 HydrophobicContact CZ-CD2 4.41Å; F51-F382 AromaticContact CZ-CE1 3.76Å; F51-F382 HydrophobicContact CZ-CE1 3.76Å; F51-F382 HydrophobicContact CZ-CE2 4.43Å; F51-F382 HydrophobicContact CZ-CG 4.06Å; F51-F382 HydrophobicContact CZ-CZ 4.13Å; Y52-F382 HydrophobicContact CE1-CD2 4.42Å; Y52-F382 HydrophobicContact CE1-CE2 4.19Å; Y52-F382 AromaticContact CE2-CD2 3.78Å; Y52-F382 HydrophobicContact CE2-CD2 3.78Å; Y52-F382 HydrophobicContact CE2-CE2 4.28Å; Y52-F382 AromaticContact CZ-CD2 3.71Å; Y52-F382 AromaticContact CZ-CE2 3.71Å; Y52-F382 WeakPolarHBondContact OH-CE2 3.44Å; T63-F382 HydrophobicContact CG2-CE1 4.48Å; T63-F382 HydrophobicContact CG2-CE2 4.09Å; T63-F382 HydrophobicContact CG2-CZ 3.6Å; F325-F382 HydrophobicContact CD1-CD1 4.17Å; F325-F382 HydrophobicContact CD1-CE1 4.36Å; F325-F382 HydrophobicContact CE1-CD1 4.47Å; M379-F382 VanDerWaalsContact C-CZ 3.49Å; M379-F382 HydrophobicContact CB-CE1 3.88Å; M379-F382 HydrophobicContact CB-CZ 3.67Å; M379-F382 HydrophobicContact CE-CE1 4.27Å; M379-F382 VanDerWaalsContact O-CZ 3.31Å; M379-F382 WeakPolarHBondContact O-CZ 3.47Å; F382-H384 PolarHBondContact O-N 3.49Å; F382-T385 WeakPolarHBondContact CA-OG1 3.42Å; F382-T385 WeakPolarHBondContact CB-OG1 3.45Å; F382-T385 WeakPolarHBondContact O-CB 3.43Å; F382-T385 PolarHBondContact O-N 2.9Å; F382-T385 PolarHBondContact O-OG1 3.13Å; F382-T385 VanDerWaalsContact O-OG1 3.04Å
383	A	91.4	Very high	87.4	Confident	15 Å²	15	36 Å²	36	12%	0.124	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-19.8	-175.7	0	0	0	0	0	115.1	I45 R47 E48	I45-A383 HydrophobicContact CD1-CB 3.72Å; I45-A383 HydrophobicContact CG2-CB 4.04Å; R47-A383 VanDerWaalsContact CD-O 3.3Å; R47-A383 WeakPolarHBondContact CD-O 3.35Å; R47-A383 WeakPolarHBondContact CG-O 3.41Å; E48-A383 HydrophobicContact CB-CB 4.47Å
384	H	91.3	Very high	88.1	Confident	24 Å²	24	39.2 Å²	39.2	11%	0.111	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.6	26.1	177.2	-52.7	-54.9	0	0	0	112.1	E105 K235 Y326 F382	E105-H384 IonicContact OE1-CE1 2.74Å; E105-H384 PolarHBondContact OE1-CE1 3.45Å; E105-H384 IonicContact OE1-NE2 3.19Å; E105-H384 PolarHBondContact OE1-NE2 3.24Å; K235-H384 PolarHBondContact NZ-CE1 3.25Å; K235-H384 PolarHBondContact NZ-NE2 3.32Å; Y326-H384 WeakPolarHBondContact CD2-O 3.44Å; Y326-H384 WeakPolarHBondContact O-CB 3.46Å; F382-H384 PolarHBondContact O-N 3.49Å
385	T	91.8	Very high	88.1	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	135.3	172.3	-53.4	0	0	0	0	109.5	R47 F51 Y323 R324 F325 F382	R47-T385 WeakPolarHBondContact CD-O 3.29Å; F51-T385 HydrophobicContact CD2-CG2 3.78Å; F51-T385 HydrophobicContact CE2-CG2 4.1Å; Y323-T385 HydrophobicContact CD1-CG2 4.07Å; R324-T385 CarbonylContact O-C 3.55Å; R324-T385 VanDerWaalsContact O-CA 3.23Å; R324-T385 WeakPolarHBondContact O-CA 3.15Å; R324-T385 WeakPolarHBondContact O-CG2 3.42Å; F325-T385 HydrophobicContact CD1-CG2 3.7Å; F325-T385 HydrophobicContact CE1-CG2 3.79Å; F382-T385 WeakPolarHBondContact CA-OG1 3.42Å; F382-T385 WeakPolarHBondContact CB-OG1 3.45Å; F382-T385 WeakPolarHBondContact O-CB 3.43Å; F382-T385 PolarHBondContact O-N 2.9Å; F382-T385 PolarHBondContact O-OG1 3.13Å; F382-T385 VanDerWaalsContact O-OG1 3.04Å
386	T	90.8	Very high	87.6	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.012	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	149.7	172.8	65.5	0	0	0	0	110.3	Y323 R324 Y326 D393	Y323-T386 WeakPolarHBondContact CA-O 3.3Å; R324-T386 WeakPolarHBondContact CB-OG1 3.47Å; R324-T386 PolarHBondContact N-O 3.25Å; R324-T386 PolarHBondContact O-N 3.25Å; Y326-T386 HydrophobicContact CD2-CG2 4.35Å; Y326-T386 HydrophobicContact CE2-CG2 4.22Å; T386-D393 VanDerWaalsContact CA-OD2 3.27Å; T386-D393 WeakPolarHBondContact CA-OD2 3.47Å; T386-D393 WeakPolarHBondContact CB-OD2 3.42Å
387	C	88.7	Confident	87.2	Confident	3 Å²	3	43.9 Å²	43.9	2%	0.02	25%	0.247	C	C	.	.			trans	-154.2	143.9	178.8	-172.1	0	0	0	0	109.6	Y323 Y389 Y390 D393	Y323-C387 HydrophobicContact CD1-CB 3.96Å; Y323-C387 HydrophobicContact CE1-CB 3.85Å; C387-Y389 PolarHBondContact O-N 2.88Å; C387-Y389 VanDerWaalsContact SG-CD2 3.55Å; C387-Y390 HydrophobicContact CB-CD1 4.13Å; C387-Y390 HydrophobicContact CB-CD2 3.77Å; C387-Y390 HydrophobicContact CB-CE1 4.08Å; C387-Y390 HydrophobicContact CB-CE2 3.72Å; C387-Y390 HydrophobicContact CB-CG 3.98Å; C387-Y390 WeakPolarHBondContact O-CB 3.29Å; C387-Y390 PolarHBondContact O-N 3.28Å; C387-D393 PolarHBondContact N-OD2 3.3Å; C387-D393 VanDerWaalsContact N-OD2 3.11Å
388	K	85.2	Confident	86.6	Confident	82 Å²	82	51.9 Å²	51.9	36%	0.357	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-22.4	179.7	69.5	176.5	169.1	-154.9	0	114.5	S322 Y390 V396	S322-K388 WeakPolarHBondContact OG-CD 3.45Å; K388-Y390 VanDerWaalsContact C-N 3.33Å; K388-V396 HydrophobicContact CB-CG1 3.64Å
389	Y	82.8	Confident	86.2	Confident	167 Å²	167	52.2 Å²	52.2	66%	0.655	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-8	179.2	-54	-64.8	0	0	0	112.7	C387 G391	C387-Y389 PolarHBondContact O-N 2.88Å; C387-Y389 VanDerWaalsContact SG-CD2 3.55Å; Y389-G391 PolarHBondContact O-N 2.96Å
390	Y	84.1	Confident	85.9	Confident	5 Å²	5	55.6 Å²	55.6	2%	0.02	31%	0.312	C	S	.	.			trans	-83.9	103	173.6	-59.3	-13.7	0	0	0	107.9	Q50 F51 T54 C387 K388 E392 D393	Q50-Y390 HydrophobicContact CG-CD1 4.16Å; Q50-Y390 HydrophobicContact CG-CE1 3.94Å; F51-Y390 WeakPolarHBondContact CA-OH 3.38Å; T54-Y390 WeakPolarHBondContact OG1-CE1 3.21Å; T54-Y390 PolarHBondContact OG1-OH 3.31Å; C387-Y390 HydrophobicContact CB-CD1 4.13Å; C387-Y390 HydrophobicContact CB-CD2 3.77Å; C387-Y390 HydrophobicContact CB-CE1 4.08Å; C387-Y390 HydrophobicContact CB-CE2 3.72Å; C387-Y390 HydrophobicContact CB-CG 3.98Å; C387-Y390 WeakPolarHBondContact O-CB 3.29Å; C387-Y390 PolarHBondContact O-N 3.28Å; K388-Y390 VanDerWaalsContact C-N 3.33Å; Y390-E392 PolarHBondContact O-N 2.91Å; Y390-D393 PolarHBondContact O-N 3.06Å; Y390-D393 VanDerWaalsContact O-N 3.13Å
391	G	69.6	Low	85.8	Confident	85 Å²	85	55.1 Å²	55.1	88%	0.876	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-4.1	-176.1	0	0	0	0	0	115.6	Y389	Y389-G391 PolarHBondContact O-N 2.96Å
392	E	73.8	Confident	85.9	Confident	134 Å²	134	57.8 Å²	57.8	63%	0.626	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-11.2	179.3	-60.3	-179.3	175.6	0	0	113.5	Y390 S394	Y390-E392 PolarHBondContact O-N 2.91Å; E392-S394 PolarHBondContact O-N 3.26Å
393	D	77.9	Confident	85.9	Confident	24 Å²	24	58.1 Å²	58.1	13%	0.128	33%	0.33	C	S	.	.			trans	-80.6	120.3	-175.8	-74.3	-25	0	0	0	111.5	R47 T386 C387 Y390 V395	R47-D393 IonicContact CZ-OD1 3.25Å; R47-D393 IonicContact NH1-OD1 3.93Å; R47-D393 PolarHBondContact NH1-OD1 3.37Å; R47-D393 IonicContact NH2-OD1 3.81Å; R47-D393 PolarHBondContact NH2-OD1 2.81Å; T386-D393 VanDerWaalsContact CA-OD2 3.27Å; T386-D393 WeakPolarHBondContact CA-OD2 3.47Å; T386-D393 WeakPolarHBondContact CB-OD2 3.42Å; C387-D393 PolarHBondContact N-OD2 3.3Å; C387-D393 VanDerWaalsContact N-OD2 3.11Å; Y390-D393 PolarHBondContact O-N 3.06Å; Y390-D393 VanDerWaalsContact O-N 3.13Å; D393-V395 PolarHBondContact O-N 3.14Å
394	S	74.3	Confident	86.1	Confident	105 Å²	105	57.4 Å²	57.4	73%	0.734	32%	0.324	S	S	*	.	S	Bend	trans	-71.2	-20.3	177.9	57.9	0	0	0	0	113.5	E392	E392-S394 PolarHBondContact O-N 3.26Å
395	V	81.8	Confident	86.4	Confident	59 Å²	59	56.8 Å²	56.8	36%	0.358	32%	0.322	S	S	.	.	S	Bend	trans	-120.4	120.2	-179.9	-177.6	0	0	0	0	108.8	D229 D393	D229-V395 HydrophobicContact CB-CB 4.16Å; D229-V395 HydrophobicContact CB-CG2 3.94Å; D393-V395 PolarHBondContact O-N 3.14Å
396	V	83.4	Confident	86.7	Confident	92 Å²	92	61.1 Å²	61.1	56%	0.558	34%	0.342	S	S	*	.			trans	-96.2	124.2	174.2	-178.7	0	0	0	0	108.7	K388	K388-V396 HydrophobicContact CB-CG1 3.64Å
397	H	86.1	Confident	87.1	Confident	31 Å²	31	61 Å²	61	14%	0.144	34%	0.341	C	S	.	.			trans	-98.8	140.8	177.4	-64.9	-89.1	0	0	0	111	D229 S322 R324 Y326	D229-H397 IonicContact OD1-NE2 3.03Å; D229-H397 IonicContact OD2-CD2 3.36Å; D229-H397 IonicContact OD2-CE1 2.68Å; D229-H397 IonicContact OD2-NE2 3.38Å; D229-H397 PolarHBondContact OD2-NE2 2.74Å; S322-H397 VanDerWaalsContact CA-O 3.26Å; S322-H397 WeakPolarHBondContact CA-O 3.49Å; S322-H397 WeakPolarHBondContact CB-O 3.49Å; S322-H397 PolarHBondContact OG-O 3.46Å; R324-H397 HydrophobicContact CG-CB 3.86Å; Y326-H397 PolarHBondContact OH-CE1 3.45Å; Y326-H397 VanDerWaalsContact OH-CE1 3.29Å; Y326-H397 PolarHBondContact OH-NE2 3.42Å
398	E	86.3	Confident	87.5	Confident	167 Å²	167	60.9 Å²	60.9	78%	0.78	34%	0.34	S	S	*	.			trans	-113.1	151.8	173.6	-65.8	-170.9	165.7	0	0	111.1	R324	R324-E398 PolarHBondContact NH2-O 2.93Å
399	G	88.3	Confident	88.1	Confident	34 Å²	34	60 Å²	60	35%	0.351	34%	0.337	S	S	.	.	S	Bend	trans	71.2	-170.6	-176.4	0	0	0	0	0	113.9	S322 R324	S322-G399 PolarHBondContact N-O 2.95Å; R324-G399 PolarHBondContact NH1-O 2.91Å; R324-G399 PolarHBondContact NH2-O 2.81Å
400	Q	91.9	Very high	88.9	Confident	71 Å²	71	53.9 Å²	53.9	33%	0.332	32%	0.316	S	S	.	.			trans	-76.5	158.8	-174.7	68.1	-174.9	8.1	0	0	113.9	R324 T402	R324-Q400 PolarHBondContact NH1-O 2.9Å; R324-Q400 PolarHBondContact NH2-O 3.02Å; Q400-T402 VanDerWaalsContact C-N 3.33Å; Q400-T402 HydrophobicContact CG-CG2 4.05Å; Q400-T402 PolarHBondContact O-N 3.45Å
401	D	94.8	Very high	89.6	Confident	16 Å²	16	53.7 Å²	53.7	9%	0.086	32%	0.315	C	S	.	.			trans	-72.8	85.5	169.4	-168.5	-24.7	0	0	0	110.6	R324 F325 G403 Y404 V405	R324-D401 WeakPolarHBondContact CA-OD2 3.33Å; F325-D401 PolarHBondContact N-OD2 3.37Å; D401-G403 PolarHBondContact O-N 3.37Å; D401-G403 PolarHBondContact OD1-N 2.96Å; D401-Y404 PolarHBondContact O-N 3.09Å; D401-Y404 PolarHBondContact OD1-N 3.2Å; D401-V405 WeakPolarHBondContact O-CB 3.28Å; D401-V405 VanDerWaalsContact O-CG2 3.28Å; D401-V405 WeakPolarHBondContact O-CG2 3.43Å; D401-V405 PolarHBondContact O-N 3.47Å
402	T	94.4	Very high	90.9	Very high	97 Å²	97	49.8 Å²	49.8	60%	0.595	27%	0.274	S	S	*	.	H	α-helix	trans	-60.2	-31.8	-177.5	55.8	0	0	0	0	112.9	Q400 F406	Q400-T402 VanDerWaalsContact C-N 3.33Å; Q400-T402 HydrophobicContact CG-CG2 4.05Å; Q400-T402 PolarHBondContact O-N 3.45Å; T402-F406 WeakPolarHBondContact O-CB 3.42Å; T402-F406 PolarHBondContact O-N 3.36Å
403	G	95.3	Very high	92.1	Very high	7 Å²	7	46.7 Å²	46.7	7%	0.072	26%	0.262	C	S	.	.	H	α-helix	trans	-69.6	-45.7	179.2	0	0	0	0	0	111.9	D401 G407	D401-G403 PolarHBondContact O-N 3.37Å; D401-G403 PolarHBondContact OD1-N 2.96Å; G403-G407 PolarHBondContact O-N 3.33Å; G403-G407 VanDerWaalsContact O-N 3.14Å
404	Y	96.7	Very high	93.1	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-67.9	-45.5	177	-158.7	-69.5	0	0	0	111.5	M222 L317 F325 S328 M379 D401 F406 G407 L408	M222-Y404 HydrophobicContact CB-CD1 4.39Å; M222-Y404 HydrophobicContact CB-CD2 3.54Å; M222-Y404 HydrophobicContact CB-CE1 4.13Å; M222-Y404 HydrophobicContact CB-CE2 3.25Å; M222-Y404 HydrophobicContact CB-CG 4.12Å; M222-Y404 HydrophobicContact CE-CD1 4.45Å; M222-Y404 HydrophobicContact CE-CE1 4.11Å; M222-Y404 HydrophobicContact CG-CD2 4.41Å; M222-Y404 HydrophobicContact CG-CE1 4.07Å; M222-Y404 HydrophobicContact CG-CE2 3.71Å; M222-Y404 VanDerWaalsContact CG-CZ 3.5Å; M222-Y404 WeakPolarHBondContact CG-OH 3.08Å; L317-Y404 HydrophobicContact CD1-CD1 3.47Å; L317-Y404 VanDerWaalsContact CD1-CD1 3.47Å; L317-Y404 HydrophobicContact CD1-CE1 3.54Å; L317-Y404 HydrophobicContact CD1-CG 4.33Å; F325-Y404 HydrophobicContact CB-CD2 3.83Å; F325-Y404 HydrophobicContact CB-CE2 4.12Å; F325-Y404 HydrophobicContact CD2-CD2 4.49Å; S328-Y404 VanDerWaalsContact OG-CE2 3.24Å; S328-Y404 WeakPolarHBondContact OG-CE2 3.38Å; M379-Y404 HydrophobicContact CE-CE1 4.26Å; M379-Y404 HydrophobicContact CE-CE2 3.89Å; D401-Y404 PolarHBondContact O-N 3.09Å; D401-Y404 PolarHBondContact OD1-N 3.2Å; Y404-F406 VanDerWaalsContact C-N 3.33Å; Y404-F406 PolarHBondContact O-N 3.18Å; Y404-G407 PolarHBondContact O-N 2.74Å; Y404-G407 VanDerWaalsContact O-N 3.13Å; Y404-L408 HydrophobicContact CD1-CD1 3.79Å; Y404-L408 HydrophobicContact CD1-CG 3.88Å; Y404-L408 HydrophobicContact CE1-CD1 3.74Å; Y404-L408 HydrophobicContact CE1-CD2 4.2Å; Y404-L408 HydrophobicContact CE1-CG 3.77Å; Y404-L408 PolarHBondContact O-N 3.12Å
405	V	97.3	Very high	94.2	Very high	11 Å²	11	41 Å²	41	7%	0.067	22%	0.223	C	C	.	.	H	α-helix	trans	-61.2	-41	178.2	172.3	0	0	0	0	111.3	K314 E318 D401 G407 L408 Q409	K314-V405 HydrophobicContact CG-CG1 4.38Å; E318-V405 HydrophobicContact CG-CG1 4.2Å; E318-V405 HydrophobicContact CG-CG2 4.16Å; D401-V405 WeakPolarHBondContact O-CB 3.28Å; D401-V405 VanDerWaalsContact O-CG2 3.28Å; D401-V405 WeakPolarHBondContact O-CG2 3.43Å; D401-V405 PolarHBondContact O-N 3.47Å; V405-G407 PolarHBondContact O-N 2.95Å; V405-L408 PolarHBondContact O-N 2.93Å; V405-Q409 WeakPolarHBondContact O-CB 3.38Å; V405-Q409 PolarHBondContact O-N 3.25Å
406	F	97.9	Very high	94.9	Very high	92 Å²	92	41.7 Å²	41.7	40%	0.404	22%	0.221	S	C	.	.	H	α-helix	trans	-60.4	-43.6	173.3	176.5	-105.4	0	0	0	112.1	T224 V250 T402 Y404 Q409 N410	T224-F406 HydrophobicContact CG2-CD1 3.78Å; T224-F406 HydrophobicContact CG2-CE1 4.12Å; V250-F406 WeakPolarHBondContact O-CE1 3.41Å; T402-F406 WeakPolarHBondContact O-CB 3.42Å; T402-F406 PolarHBondContact O-N 3.36Å; Y404-F406 VanDerWaalsContact C-N 3.33Å; Y404-F406 PolarHBondContact O-N 3.18Å; F406-Q409 PolarHBondContact O-N 2.78Å; F406-N410 WeakPolarHBondContact CD2-ND2 3.32Å; F406-N410 VanDerWaalsContact CE1-ND2 3.34Å; F406-N410 WeakPolarHBondContact CE1-ND2 3.47Å; F406-N410 WeakPolarHBondContact CE2-ND2 3.42Å; F406-N410 WeakPolarHBondContact CZ-ND2 3.34Å; F406-N410 PolarHBondContact O-N 3.45Å; F406-N410 VanDerWaalsContact O-N 3.1Å; F406-N410 PolarHBondContact O-ND2 3.32Å
407	G	97.9	Very high	95.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61.7	-42.9	175.3	0	0	0	0	0	113.1	G252 G403 Y404 V405 L411	G252-G407 WeakPolarHBondContact O-CA 3.49Å; G403-G407 PolarHBondContact O-N 3.33Å; G403-G407 VanDerWaalsContact O-N 3.14Å; Y404-G407 PolarHBondContact O-N 2.74Å; Y404-G407 VanDerWaalsContact O-N 3.13Å; V405-G407 PolarHBondContact O-N 2.95Å; G407-L411 WeakPolarHBondContact O-CB 3.39Å; G407-L411 PolarHBondContact O-N 3.41Å
408	L	97.9	Very high	95.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.5	-44.3	175.9	-80.2	177.3	0	0	0	112.3	M222 L310 L313 K314 L317 L330 Y404 V405 L411 I412	M222-L408 HydrophobicContact CE-CB 4.47Å; M222-L408 HydrophobicContact CE-CD2 3.77Å; M222-L408 HydrophobicContact CE-CG 3.83Å; L310-L408 HydrophobicContact CD2-CD2 4.05Å; L313-L408 HydrophobicContact CD2-CD1 4.29Å; L313-L408 HydrophobicContact CD2-CD2 4.18Å; L313-L408 HydrophobicContact CG-CD1 4.11Å; K314-L408 HydrophobicContact CB-CD1 4.18Å; L317-L408 HydrophobicContact CD1-CD1 3.72Å; L330-L408 HydrophobicContact CD2-CD2 3.88Å; Y404-L408 HydrophobicContact CD1-CD1 3.79Å; Y404-L408 HydrophobicContact CD1-CG 3.88Å; Y404-L408 HydrophobicContact CE1-CD1 3.74Å; Y404-L408 HydrophobicContact CE1-CD2 4.2Å; Y404-L408 HydrophobicContact CE1-CG 3.77Å; Y404-L408 PolarHBondContact O-N 3.12Å; V405-L408 PolarHBondContact O-N 2.93Å; L408-L411 PolarHBondContact O-N 3.1Å; L408-I412 WeakPolarHBondContact O-CD1 3.45Å; L408-I412 VanDerWaalsContact O-CG1 3.25Å; L408-I412 WeakPolarHBondContact O-CG1 3.49Å; L408-I412 PolarHBondContact O-N 2.77Å
409	Q	98.4	Very high	96.3	Very high	64 Å²	64	34 Å²	34	30%	0.299	18%	0.177	S	C	.	.	H	α-helix	trans	-61.2	-50.1	180	-175.7	58.1	57.4	0	0	111	V405 F406 L411 I412 D413	V405-Q409 WeakPolarHBondContact O-CB 3.38Å; V405-Q409 PolarHBondContact O-N 3.25Å; F406-Q409 PolarHBondContact O-N 2.78Å; Q409-L411 VanDerWaalsContact C-N 3.3Å; Q409-L411 PolarHBondContact O-N 3.29Å; Q409-I412 PolarHBondContact O-N 2.68Å; Q409-D413 PolarHBondContact NE2-OD1 2.8Å; Q409-D413 PolarHBondContact NE2-OD2 3.24Å; Q409-D413 VanDerWaalsContact O-CG 3.24Å; Q409-D413 PolarHBondContact O-N 3.23Å
410	N	98.5	Very high	96.4	Very high	38 Å²	38	36.3 Å²	36.3	20%	0.203	18%	0.181	C	C	.	.	H	α-helix	trans	-60.5	-39.4	176.6	-75.2	-72.3	0	0	0	112.4	I251 F406 D413 I414	I251-N410 HydrophobicContact CB-CB 4.16Å; I251-N410 WeakPolarHBondContact O-CB 3.44Å; I251-N410 PolarHBondContact O-ND2 2.91Å; F406-N410 WeakPolarHBondContact CD2-ND2 3.32Å; F406-N410 VanDerWaalsContact CE1-ND2 3.34Å; F406-N410 WeakPolarHBondContact CE1-ND2 3.47Å; F406-N410 WeakPolarHBondContact CE2-ND2 3.42Å; F406-N410 WeakPolarHBondContact CZ-ND2 3.34Å; F406-N410 PolarHBondContact O-N 3.45Å; F406-N410 VanDerWaalsContact O-N 3.1Å; F406-N410 PolarHBondContact O-ND2 3.32Å; N410-D413 PolarHBondContact O-N 2.94Å; N410-I414 WeakPolarHBondContact O-CB 3.42Å; N410-I414 WeakPolarHBondContact O-CD1 3.27Å; N410-I414 VanDerWaalsContact O-CG1 3.23Å; N410-I414 WeakPolarHBondContact O-CG1 3.42Å; N410-I414 PolarHBondContact O-N 3.33Å
411	L	98.6	Very high	96.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.1	-44.8	176.3	179.1	62.5	0	0	0	111.6	L220 F284 L288 L310 L330 G407 L408 Q409 D413 I415	L220-L411 HydrophobicContact CD1-CD1 3.81Å; L220-L411 HydrophobicContact CD1-CD2 3.53Å; L220-L411 HydrophobicContact CD1-CG 4.34Å; F284-L411 HydrophobicContact CE1-CD1 4.28Å; F284-L411 HydrophobicContact CZ-CD1 4.13Å; L288-L411 HydrophobicContact CD1-CD1 3.83Å; L288-L411 HydrophobicContact CD2-CD1 4.3Å; L310-L411 HydrophobicContact CD1-CD2 4.14Å; L310-L411 HydrophobicContact CD1-CG 4.18Å; L310-L411 HydrophobicContact CD2-CD2 4.09Å; L330-L411 HydrophobicContact CD2-CD2 3.81Å; G407-L411 WeakPolarHBondContact O-CB 3.39Å; G407-L411 PolarHBondContact O-N 3.41Å; L408-L411 PolarHBondContact O-N 3.1Å; Q409-L411 VanDerWaalsContact C-N 3.3Å; Q409-L411 PolarHBondContact O-N 3.29Å; L411-D413 VanDerWaalsContact C-N 3.34Å; L411-I415 HydrophobicContact CD1-CD1 3.78Å; L411-I415 HydrophobicContact CD1-CG1 4.21Å; L411-I415 HydrophobicContact CG-CD1 3.87Å; L411-I415 WeakPolarHBondContact O-CB 3.44Å; L411-I415 VanDerWaalsContact O-CG1 3.24Å; L411-I415 WeakPolarHBondContact O-CG1 3.23Å; L411-I415 PolarHBondContact O-N 3.1Å
412	I	98.5	Very high	94.9	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.015	20%	0.195	C	C	.	.	H	α-helix	trans	-60.1	-46.3	176.7	-70.3	162.8	0	0	0	110.4	I307 L310 K314 L408 Q409 I415 K416	I307-I412 HydrophobicContact CG2-CG2 4.43Å; L310-I412 HydrophobicContact CB-CD1 3.92Å; L310-I412 HydrophobicContact CB-CG1 3.59Å; L310-I412 HydrophobicContact CD1-CG1 4.04Å; L310-I412 HydrophobicContact CG-CG1 4.45Å; K314-I412 HydrophobicContact CD-CD1 4.29Å; L408-I412 WeakPolarHBondContact O-CD1 3.45Å; L408-I412 VanDerWaalsContact O-CG1 3.25Å; L408-I412 WeakPolarHBondContact O-CG1 3.49Å; L408-I412 PolarHBondContact O-N 2.77Å; Q409-I412 PolarHBondContact O-N 2.68Å; I412-I415 PolarHBondContact O-N 3.03Å; I412-K416 HydrophobicContact CG2-CD 4.08Å; I412-K416 WeakPolarHBondContact O-CG 3.48Å; I412-K416 PolarHBondContact O-N 3.44Å
413	D	98.3	Very high	93.2	Very high	69 Å²	69	38.4 Å²	38.4	37%	0.369	20%	0.196	S	C	.	.	H	α-helix	trans	-66	-42.4	-176.8	-64.2	-27.3	0	0	0	111.5	Q409 N410 L411 K416 E417	Q409-D413 PolarHBondContact NE2-OD1 2.8Å; Q409-D413 PolarHBondContact NE2-OD2 3.24Å; Q409-D413 VanDerWaalsContact O-CG 3.24Å; Q409-D413 PolarHBondContact O-N 3.23Å; N410-D413 PolarHBondContact O-N 2.94Å; L411-D413 VanDerWaalsContact C-N 3.34Å; D413-K416 PolarHBondContact O-N 2.74Å; D413-E417 WeakPolarHBondContact O-CB 3.42Å; D413-E417 PolarHBondContact O-N 3.06Å
414	I	98.1	Very high	90.6	Very high	10 Å²	10	49.1 Å²	49.1	5%	0.051	24%	0.244	C	C	.	.	H	α-helix	trans	-63.7	-42.5	175.1	-69.5	165.6	0	0	0	111.5	I251 F284 K285 L288 N410 K416 E417 I418	I251-I414 HydrophobicContact CD1-CD1 4.05Å; F284-I414 HydrophobicContact CD1-CD1 4.04Å; F284-I414 HydrophobicContact CE1-CD1 4.05Å; K285-I414 HydrophobicContact CB-CG2 4.43Å; K285-I414 HydrophobicContact CG-CG2 3.77Å; L288-I414 HydrophobicContact CD1-CB 4.47Å; L288-I414 HydrophobicContact CD1-CG2 3.62Å; N410-I414 WeakPolarHBondContact O-CB 3.42Å; N410-I414 WeakPolarHBondContact O-CD1 3.27Å; N410-I414 VanDerWaalsContact O-CG1 3.23Å; N410-I414 WeakPolarHBondContact O-CG1 3.42Å; N410-I414 PolarHBondContact O-N 3.33Å; I414-K416 VanDerWaalsContact C-N 3.31Å; I414-K416 PolarHBondContact O-N 2.93Å; I414-E417 WeakPolarHBondContact O-CB 3.39Å; I414-E417 PolarHBondContact O-N 3.47Å; I414-I418 HydrophobicContact CG2-CD1 3.9Å; I414-I418 HydrophobicContact CG2-CG1 4.49Å; I414-I418 VanDerWaalsContact O-CG1 3.32Å; I414-I418 WeakPolarHBondContact O-CG1 3.36Å; I414-I418 PolarHBondContact O-N 2.94Å
415	I	97.7	Very high	90.3	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.6	-37.8	179	-70.4	171.9	0	0	0	110.7	L288 F292 F303 V306 I307 L310 L411 I412 R419	L288-I415 HydrophobicContact CD1-CG1 4.19Å; F292-I415 HydrophobicContact CE2-CG1 4.47Å; F303-I415 HydrophobicContact CD1-CG2 3.53Å; F303-I415 WeakPolarHBondContact CD1-O 3.3Å; F303-I415 HydrophobicContact CE1-CG2 3.98Å; F303-I415 WeakPolarHBondContact CE1-O 3.18Å; V306-I415 HydrophobicContact CG1-CD1 3.93Å; I307-I415 HydrophobicContact CD1-CG2 4.04Å; I307-I415 HydrophobicContact CG1-CG2 3.71Å; L310-I415 HydrophobicContact CD1-CD1 3.71Å; L411-I415 HydrophobicContact CD1-CD1 3.78Å; L411-I415 HydrophobicContact CD1-CG1 4.21Å; L411-I415 HydrophobicContact CG-CD1 3.87Å; L411-I415 WeakPolarHBondContact O-CB 3.44Å; L411-I415 VanDerWaalsContact O-CG1 3.24Å; L411-I415 WeakPolarHBondContact O-CG1 3.23Å; L411-I415 PolarHBondContact O-N 3.1Å; I412-I415 PolarHBondContact O-N 3.03Å; I415-R419 PolarHBondContact O-N 3Å
416	K	97.4	Very high	89.9	Confident	73 Å²	73	53.7 Å²	53.7	32%	0.317	27%	0.266	S	S	.	.	H	α-helix	trans	-63.9	-45.1	173.1	-75.3	172.8	177.8	176.3	0	111.9	I307 I412 D413 I414 I418 R419 D420	I307-K416 HydrophobicContact CD1-CG 3.72Å; I307-K416 HydrophobicContact CG1-CG 4.3Å; I412-K416 HydrophobicContact CG2-CD 4.08Å; I412-K416 WeakPolarHBondContact O-CG 3.48Å; I412-K416 PolarHBondContact O-N 3.44Å; D413-K416 PolarHBondContact O-N 2.74Å; I414-K416 VanDerWaalsContact C-N 3.31Å; I414-K416 PolarHBondContact O-N 2.93Å; K416-I418 VanDerWaalsContact C-N 3.34Å; K416-I418 PolarHBondContact O-N 2.9Å; K416-R419 WeakPolarHBondContact O-CB 3.17Å; K416-R419 PolarHBondContact O-N 2.96Å; K416-R419 VanDerWaalsContact O-N 3.16Å; K416-D420 WeakPolarHBondContact O-CB 3.14Å; K416-D420 PolarHBondContact O-N 2.86Å
417	E	96.1	Very high	89.5	Confident	66 Å²	66	51.6 Å²	51.6	31%	0.308	26%	0.259	S	S	.	.	H	α-helix	trans	-56.3	-48.9	176.2	-173.4	-178.2	175.3	0	0	110.9	K285 D413 I414 R419 D420 E421	K285-E417 WeakPolarHBondContact CE-OE2 3.45Å; K285-E417 IonicContact NZ-OE1 2.75Å; K285-E417 PolarHBondContact NZ-OE1 3.19Å; K285-E417 IonicContact NZ-OE2 3.16Å; K285-E417 PolarHBondContact NZ-OE2 3.11Å; D413-E417 WeakPolarHBondContact O-CB 3.42Å; D413-E417 PolarHBondContact O-N 3.06Å; I414-E417 WeakPolarHBondContact O-CB 3.39Å; I414-E417 PolarHBondContact O-N 3.47Å; E417-R419 VanDerWaalsContact C-N 3.31Å; E417-R419 PolarHBondContact O-N 3.46Å; E417-D420 PolarHBondContact O-N 3.29Å; E417-D420 VanDerWaalsContact O-N 3.15Å; E417-E421 HydrophobicContact CG-CG 4.23Å; E417-E421 WeakPolarHBondContact O-CB 3.46Å; E417-E421 WeakPolarHBondContact O-CG 3.38Å; E417-E421 PolarHBondContact O-N 2.73Å
418	I	94.3	Very high	89	Confident	7 Å²	7	54.6 Å²	54.6	4%	0.036	27%	0.274	C	S	.	.	H	α-helix	trans	-60.6	-40.2	177.6	-66.5	165.8	0	0	0	111.8	L288 Y289 L298 F303 I414 K416 D420 S422	L288-I418 HydrophobicContact CB-CD1 3.67Å; L288-I418 HydrophobicContact CD1-CD1 4.41Å; Y289-I418 HydrophobicContact CD2-CG2 3.98Å; L298-I418 HydrophobicContact CD2-CG2 4.47Å; F303-I418 HydrophobicContact CE1-CB 4.05Å; F303-I418 HydrophobicContact CE1-CG2 3.73Å; F303-I418 HydrophobicContact CZ-CG2 3.71Å; I414-I418 HydrophobicContact CG2-CD1 3.9Å; I414-I418 HydrophobicContact CG2-CG1 4.49Å; I414-I418 VanDerWaalsContact O-CG1 3.32Å; I414-I418 WeakPolarHBondContact O-CG1 3.36Å; I414-I418 PolarHBondContact O-N 2.94Å; K416-I418 VanDerWaalsContact C-N 3.34Å; K416-I418 PolarHBondContact O-N 2.9Å; I418-D420 VanDerWaalsContact C-N 3.33Å; I418-S422 WeakPolarHBondContact O-CB 3.26Å; I418-S422 PolarHBondContact O-N 3Å; I418-S422 PolarHBondContact O-OG 3.14Å
419	R	93.4	Very high	88.4	Confident	56 Å²	56	58.1 Å²	58.1	21%	0.211	29%	0.291	C	S	.	.	H	α-helix	trans	-61.7	-43.7	176.9	-177.1	-163.4	62.9	-171.1	-4.2	111.2	R300 F303 E304 I415 K416 E417 S422 S423	R300-R419 PolarHBondContact NH1-O 2.74Å; F303-R419 HydrophobicContact CB-CB 4.29Å; F303-R419 HydrophobicContact CB-CG 4.04Å; F303-R419 HydrophobicContact CD1-CB 3.65Å; F303-R419 HydrophobicContact CD1-CG 4.3Å; F303-R419 HydrophobicContact CE1-CB 4.2Å; F303-R419 HydrophobicContact CG-CB 4.06Å; F303-R419 HydrophobicContact CG-CG 4.2Å; E304-R419 WeakPolarHBondContact OE1-CD 3.38Å; E304-R419 IonicContact OE1-CZ 2.85Å; E304-R419 IonicContact OE1-NE 3.12Å; E304-R419 IonicContact OE1-NH1 3.41Å; E304-R419 PolarHBondContact OE1-NH1 3.18Å; E304-R419 IonicContact OE2-NH1 2.65Å; I415-R419 PolarHBondContact O-N 3Å; K416-R419 WeakPolarHBondContact O-CB 3.17Å; K416-R419 PolarHBondContact O-N 2.96Å; K416-R419 VanDerWaalsContact O-N 3.16Å; E417-R419 VanDerWaalsContact C-N 3.31Å; E417-R419 PolarHBondContact O-N 3.46Å; R419-S422 PolarHBondContact O-OG 2.91Å; R419-S423 PolarHBondContact O-OG 3.4Å
420	D	90.5	Very high	87.7	Confident	82 Å²	82	57.7 Å²	57.7	44%	0.439	29%	0.29	S	S	.	.	H	α-helix	trans	-78.8	-46.3	-172.4	-62.2	-13	0	0	0	111.2	K416 E417 I418 S422 S423	K416-D420 WeakPolarHBondContact O-CB 3.14Å; K416-D420 PolarHBondContact O-N 2.86Å; E417-D420 PolarHBondContact O-N 3.29Å; E417-D420 VanDerWaalsContact O-N 3.15Å; I418-D420 VanDerWaalsContact C-N 3.33Å; D420-S422 PolarHBondContact O-N 3.34Å; D420-S422 VanDerWaalsContact O-N 3.12Å; D420-S423 WeakPolarHBondContact O-CB 3.32Å; D420-S423 PolarHBondContact O-N 3.13Å
421	E	86.6	Confident	87	Confident	119 Å²	119	59.1 Å²	59.1	56%	0.556	30%	0.297	S	S	*	.	H	α-helix	trans	-57.4	-29.4	177.9	-76.8	-177.5	163.6	0	0	113.6	E417	E417-E421 HydrophobicContact CG-CG 4.23Å; E417-E421 WeakPolarHBondContact O-CB 3.46Å; E417-E421 WeakPolarHBondContact O-CG 3.38Å; E417-E421 PolarHBondContact O-N 2.73Å
422	S	69.1	Low	86.1	Confident	22 Å²	22	63.6 Å²	63.6	15%	0.154	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-7.9	-176.5	60.4	0	0	0	0	112.1	L298 R300 I418 R419 D420 E424	L298-S422 VanDerWaalsContact CD2-OG 3.28Å; L298-S422 WeakPolarHBondContact CD2-OG 3.37Å; R300-S422 PolarHBondContact NH1-O 3.23Å; R300-S422 PolarHBondContact NH1-OG 2.92Å; R300-S422 VanDerWaalsContact NH2-C 3.27Å; R300-S422 PolarHBondContact NH2-O 2.76Å; R300-S422 PolarHBondContact NH2-OG 3.27Å; I418-S422 WeakPolarHBondContact O-CB 3.26Å; I418-S422 PolarHBondContact O-N 3Å; I418-S422 PolarHBondContact O-OG 3.14Å; R419-S422 PolarHBondContact O-OG 2.91Å; D420-S422 PolarHBondContact O-N 3.34Å; D420-S422 VanDerWaalsContact O-N 3.12Å; S422-E424 VanDerWaalsContact C-N 3.33Å
423	S	58.9	Low	85	Confident	87 Å²	87	68.7 Å²	68.7	61%	0.608	35%	0.345	S	S	*	.			trans	-84.8	-9.5	178.7	-59.3	0	0	0	0	113.4	R300 R419 D420	R300-S423 PolarHBondContact NH1-OG 2.94Å; R419-S423 PolarHBondContact O-OG 3.4Å; D420-S423 WeakPolarHBondContact O-CB 3.32Å; D420-S423 PolarHBondContact O-N 3.13Å
424	E	39.9	Very low	83.8	Confident	233 Å²	233	68.6 Å²	68.6	100%	1.089	34%	0.343	S	S	*	.			trans	-87.7	0	166	-61.5	-175.3	165.8	0	0	110.8	S422	S422-E424 VanDerWaalsContact C-N 3.33Å

Retrieved 424 of 424 residues in 95.3 ms (Link to these results)

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