C4Q592_SCHMA Loading...

Methyl-CpG binding domain protein

AlphaFold DB , UniProt , Accession C4Q592, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene MBD, Length 314 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.1	Very low	39.1	Very low	247 Å²	247	158.8 Å²	158.8	100%	1.217	85%	0.852	S	S	*	*				0	142.3	0	-71	172.9	95.5	0	0	108.2
2	Q	36.7	Very low	39	Very low	176 Å²	176	159.3 Å²	159.3	82%	0.822	84%	0.844	S	S	*	*			trans	-64.8	146.1	-159.5	-74.6	139.7	-35.1	0	0	116.3
3	N	40.6	Very low	38.8	Very low	134 Å²	134	160.3 Å²	160.3	72%	0.717	84%	0.841	S	S	*	*				163.7	103.3	114.4	-84.3	-31	0	0	0	110.2
4	Q	42.5	Very low	38.8	Very low	172 Å²	172	158.4 Å²	158.4	80%	0.804	84%	0.839	S	S	*	*				79.3	100.5	93.7	-79.3	-167.8	41.2	0	0	114.4
5	S	38.9	Very low	38.8	Very low	131 Å²	131	160.7 Å²	160.7	92%	0.916	84%	0.84	S	S	*	*			trans	-75.7	132.8	164.7	-82.2	0	0	0	0	110.8
6	V	43.8	Very low	38.6	Very low	123 Å²	123	165.8 Å²	165.8	75%	0.745	84%	0.844	S	S	*	*			trans	-103	115.6	173.9	178.5	0	0	0	0	109
7	N	34.5	Very low	38.6	Very low	158 Å²	158	161.8 Å²	161.8	85%	0.845	84%	0.835	S	S	*	*			trans	-64.8	131.9	165.3	-95.5	-27.8	0	0	0	110.3
8	Q	40	Very low	38.6	Very low	187 Å²	187	158.9 Å²	158.9	87%	0.874	83%	0.831	S	S	*	*			trans	-116.8	117.4	161.6	-73.6	-170	30.1	0	0	110.1
9	S	40.3	Very low	38.6	Very low	114 Å²	114	160.3 Å²	160.3	80%	0.797	83%	0.826	S	S	*	*			trans	-79.2	133.8	-176.3	-50	0	0	0	0	111.9	N11	S9-N11 PolarHBondContact O-N 3.32Å
10	N	33.1	Very low	38.6	Very low	150 Å²	150	156.5 Å²	156.5	80%	0.802	82%	0.819	S	S	*	*			trans	-69.2	118.6	172.8	-112.4	-13.7	0	0	0	110.8
11	N	35.6	Very low	38.5	Very low	155 Å²	155	156.6 Å²	156.6	83%	0.829	82%	0.821	S	S	*	*			trans	-103.4	93.3	179.9	-130.7	-14.5	0	0	0	109.7	S9 Q13	S9-N11 PolarHBondContact O-N 3.32Å; N11-Q13 PolarHBondContact O-N 3.35Å
12	H	38	Very low	38.1	Very low	165 Å²	165	155.5 Å²	155.5	76%	0.764	81%	0.805	S	S	*	*			trans	-80.4	100.7	169.3	-77.4	-49.1	0	0	0	109.9	T14	H12-T14 PolarHBondContact O-N 2.94Å; H12-T14 VanDerWaalsContact O-N 3.12Å
13	Q	35.8	Very low	38	Very low	172 Å²	172	150.1 Å²	150.1	80%	0.804	80%	0.796	S	S	*	*			trans	-74.3	94.5	173.5	-120.4	176.4	31.1	0	0	110.5	N11 K15	N11-Q13 PolarHBondContact O-N 3.35Å; Q13-K15 PolarHBondContact O-N 3.25Å
14	T	39.3	Very low	37.9	Very low	133 Å²	133	153.9 Å²	153.9	82%	0.816	81%	0.806	S	S	*	*			trans	-67.5	106.9	161.7	25.5	0	0	0	0	110	H12 R16	H12-T14 PolarHBondContact O-N 2.94Å; H12-T14 VanDerWaalsContact O-N 3.12Å; T14-R16 PolarHBondContact O-N 3.48Å
15	K	39.3	Very low	37.5	Very low	194 Å²	194	154.5 Å²	154.5	84%	0.843	81%	0.809	S	S	*	*			trans	-71.7	93.4	170	-72.9	-172	178.3	-179.1	0	110.1	Q13 S17	Q13-K15 PolarHBondContact O-N 3.25Å; K15-S17 PolarHBondContact O-N 3.1Å
16	R	35.6	Very low	37.4	Very low	241 Å²	241	154 Å²	154	91%	0.909	80%	0.803	S	S	*	*			trans	-66.6	115	164.5	-116.6	177.8	-176	-114.3	2.4	108.7	T14 S18	T14-R16 PolarHBondContact O-N 3.48Å; R16-S18 PolarHBondContact O-N 3.41Å
17	S	38.7	Very low	36.9	Very low	99 Å²	99	157.3 Å²	157.3	69%	0.692	81%	0.81	S	S	*	*			trans	-79.8	106.6	164.1	-166.2	0	0	0	0	107.5	K15 Y19	K15-S17 PolarHBondContact O-N 3.1Å; S17-Y19 WeakPolarHBondContact OG-CE2 3.43Å
18	S	37.2	Very low	36.9	Very low	110 Å²	110	157.5 Å²	157.5	77%	0.769	81%	0.811	S	S	*	*			trans	-77.5	114	174.8	30	0	0	0	0	109.8	R16	R16-S18 PolarHBondContact O-N 3.41Å
19	Y	38.5	Very low	36.6	Very low	184 Å²	184	153.6 Å²	153.6	72%	0.722	81%	0.805	S	S	*	*			trans	-121.3	129.5	158.5	-75.9	-78.4	0	0	0	109	S17	S17-Y19 WeakPolarHBondContact OG-CE2 3.43Å
20	A	40.3	Very low	36.5	Very low	84 Å²	84	156.8 Å²	156.8	69%	0.694	81%	0.809	S	S	*	*			trans	-63.9	147	-173.9	0	0	0	0	0	112.3	Y22	A20-Y22 PolarHBondContact O-N 3.5Å
21	N	35.5	Very low	36.4	Very low	160 Å²	160	155.3 Å²	155.3	86%	0.856	81%	0.81	S	S	*	*			trans	-70.1	114.8	178	-154.5	7.3	0	0	0	109.2	G23	N21-G23 PolarHBondContact O-N 3.37Å
22	Y	35.1	Very low	36.2	Very low	224 Å²	224	151.4 Å²	151.4	88%	0.878	81%	0.806	S	S	*	*			trans	-88.6	96.3	166.2	-74.3	-75.9	0	0	0	108.6	A20	A20-Y22 PolarHBondContact O-N 3.5Å
23	G	36	Very low	35.8	Very low	62 Å²	62	153.3 Å²	153.3	64%	0.639	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-67.9	135.4	168.2	0	0	0	0	0	110.8	N21 Q25	N21-G23 PolarHBondContact O-N 3.37Å; G23-Q25 PolarHBondContact O-N 3.47Å
24	K	36.9	Very low	35.7	Very low	213 Å²	213	153.6 Å²	153.6	93%	0.926	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-59.7	119.7	169.8	-66.7	178.2	176.3	-179.9	0	109.4
25	Q	35.7	Very low	35.5	Very low	186 Å²	186	152.5 Å²	152.5	87%	0.869	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-97.8	139.7	158.1	-87.8	-163	-21.5	0	0	109.8	G23	G23-Q25 PolarHBondContact O-N 3.47Å
26	P	36.5	Very low	35.2	Very low	121 Å²	121	151.8 Å²	151.8	79%	0.786	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-77.9	155.6	176.8	32.4	-32	0	0	0	111.5	N28	P26-N28 PolarHBondContact O-N 3.02Å
27	Q	33.1	Very low	35.7	Very low	192 Å²	192	148.3 Å²	148.3	90%	0.897	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-51.5	129.7	-177	-65.5	-175.7	-32.7	0	0	113
28	N	35	Very low	35.9	Very low	161 Å²	161	152.1 Å²	152.1	86%	0.861	81%	0.812	S	S	*	*			trans	-146.1	127.2	146.6	-111.3	-8.9	0	0	0	110	P26	P26-N28 PolarHBondContact O-N 3.02Å
29	S	33.5	Very low	36.8	Very low	106 Å²	106	151.9 Å²	151.9	74%	0.741	80%	0.799	S	S	*	*			trans	-53	129.3	173.9	38.7	0	0	0	0	112.6
30	M	37.4	Very low	37.6	Very low	181 Å²	181	149.6 Å²	149.6	89%	0.892	80%	0.795	S	S	*	*			trans	-174.5	143.4	131.4	-78.5	-127.2	102.7	0	0	109
31	S	30.4	Very low	38.5	Very low	119 Å²	119	150.9 Å²	150.9	83%	0.832	79%	0.786	S	S	*	*			trans	-45.7	130.7	-175.9	49.4	0	0	0	0	116.1
32	G	33	Very low	39.8	Very low	72 Å²	72	146.6 Å²	146.6	74%	0.742	77%	0.766	S	S	*	*			trans	-174.4	109.9	166	0	0	0	0	0	111.4	Q34	G32-Q34 PolarHBondContact O-N 3.07Å
33	Q	29.9	Very low	40.9	Very low	206 Å²	206	144.6 Å²	144.6	96%	0.963	76%	0.756	S	S	*	*			trans	-63.5	122.6	176.7	-68.4	174	-0.2	0	0	110.2
34	Q	31.9	Very low	42.1	Very low	177 Å²	177	142.3 Å²	142.3	83%	0.827	73%	0.731	S	S	*	*			trans	-128.3	147.7	166.4	-92.2	-167.6	-0.8	0	0	110.5	G32	G32-Q34 PolarHBondContact O-N 3.07Å
35	P	36	Very low	43.3	Very low	111 Å²	111	137.8 Å²	137.8	72%	0.721	73%	0.726	S	S	*	*			trans	-76.5	134.1	-158.3	30.1	-33.7	0	0	0	112.7	H37	P35-H37 PolarHBondContact O-N 3.24Å
36	H	33.8	Very low	45.3	Very low	178 Å²	178	130.6 Å²	130.6	82%	0.824	70%	0.696	S	S	*	*			trans	-61.6	103.7	177	-68.5	-85	0	0	0	111.6	H38	H36-H38 PolarHBondContact O-N 3.03Å
37	H	45.1	Very low	47.4	Very low	168 Å²	168	125.6 Å²	125.6	78%	0.778	66%	0.662	S	S	*	*			trans	-64.4	115.4	157.5	-83.5	-90.9	0	0	0	108	P35 Q39	P35-H37 PolarHBondContact O-N 3.24Å; H37-Q39 PolarHBondContact O-N 2.86Å
38	H	43.4	Very low	49.6	Very low	180 Å²	180	117.9 Å²	117.9	83%	0.833	63%	0.629	S	S	*	*			trans	-64.3	95	175.8	-100.2	70.4	0	0	0	109.7	H36	H36-H38 PolarHBondContact O-N 3.03Å
39	Q	55.6	Low	51.7	Low	105 Å²	105	116.9 Å²	116.9	49%	0.491	63%	0.629	S	S	.	*			trans	-93.7	104.9	170.3	-138.2	173.1	15.3	0	0	106.7	H37 Q41 E54	H37-Q39 PolarHBondContact O-N 2.86Å; Q39-Q41 PolarHBondContact O-N 3.01Å; Q39-E54 PolarHBondContact NE2-OE2 3.38Å; Q39-E54 VanDerWaalsContact NE2-OE2 3.14Å
40	Q	54.9	Low	54.1	Low	136 Å²	136	113.5 Å²	113.5	64%	0.636	61%	0.611	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-82.2	100.3	-179.2	-140	169.5	38.1	0	0	108.5
41	Q	59.3	Low	56.5	Low	111 Å²	111	105.3 Å²	105.3	52%	0.519	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81	121.5	174.2	-77	-180	-11.1	0	0	109.5	Q39 E54	Q39-Q41 PolarHBondContact O-N 3.01Å; Q41-E54 HydrophobicContact CG-CG 4.07Å; Q41-E54 PolarHBondContact NE2-OE1 3.04Å; Q41-E54 VanDerWaalsContact NE2-OE1 3.07Å
42	V	63.1	Low	59.3	Low	70 Å²	70	102.4 Å²	102.4	42%	0.424	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	133.9	175.6	-174.6	0	0	0	0	108.2	P44 R53	V42-P44 WeakPolarHBondContact O-CD 3.43Å; V42-R53 PolarHBondContact N-O 2.88Å; V42-R53 WeakPolarHBondContact O-CB 3.21Å; V42-R53 PolarHBondContact O-N 2.98Å
43	W	58.6	Low	61.9	Low	181 Å²	181	100.4 Å²	100.4	69%	0.686	51%	0.511	S	S	*	.			trans	-81.6	110.8	174.6	-58.6	92.9	0	0	0	109	S45	W43-S45 PolarHBondContact O-N 3.19Å
44	P	61.6	Low	64.7	Low	15 Å²	15	91.8 Å²	91.8	10%	0.097	47%	0.471	C	S	.	.			trans	-68.3	108.4	175.2	26.5	-30.7	0	0	0	108.9	V42 S46 L47 W51 Y71	V42-P44 WeakPolarHBondContact O-CD 3.43Å; P44-S46 PolarHBondContact O-N 3.07Å; P44-L47 HydrophobicContact CB-CB 4.48Å; P44-L47 HydrophobicContact CB-CD1 4.21Å; P44-L47 HydrophobicContact CB-CG 4.23Å; P44-L47 HydrophobicContact CG-CB 4.13Å; P44-L47 HydrophobicContact CG-CD1 3.71Å; P44-L47 HydrophobicContact CG-CG 4.11Å; P44-L47 PolarHBondContact O-N 2.93Å; P44-W51 HydrophobicContact CG-CB 4.44Å; P44-Y71 HydrophobicContact CB-CE1 4.43Å; P44-Y71 HydrophobicContact CG-CD1 4.37Å; P44-Y71 HydrophobicContact CG-CE1 4.19Å
45	S	62.6	Low	67.5	Low	117 Å²	117	86.1 Å²	86.1	82%	0.818	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-12.1	179.8	57	0	0	0	0	113.8	W43	W43-S45 PolarHBondContact O-N 3.19Å
46	S	75.9	Confident	69.9	Low	35 Å²	35	82.6 Å²	82.6	25%	0.245	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-15.8	-178.7	60.6	0	0	0	0	114.8	P44 G103 F105	P44-S46 PolarHBondContact O-N 3.07Å; S46-G103 PolarHBondContact OG-O 3.4Å; S46-F105 WeakPolarHBondContact O-CE2 3.44Å
47	L	80.6	Confident	72.3	Confident	16 Å²	16	80.9 Å²	80.9	8%	0.084	42%	0.416	C	S	.	.	S	Bend	trans	-91	161.4	177.6	-67.9	-179.8	0	0	0	110.6	P44 W51 Y71 M85 L89 F98	P44-L47 HydrophobicContact CB-CB 4.48Å; P44-L47 HydrophobicContact CB-CD1 4.21Å; P44-L47 HydrophobicContact CB-CG 4.23Å; P44-L47 HydrophobicContact CG-CB 4.13Å; P44-L47 HydrophobicContact CG-CD1 3.71Å; P44-L47 HydrophobicContact CG-CG 4.11Å; P44-L47 PolarHBondContact O-N 2.93Å; L47-W51 HydrophobicContact CB-CB 3.78Å; L47-W51 HydrophobicContact CB-CG 3.96Å; L47-W51 HydrophobicContact CD1-CB 3.93Å; L47-W51 HydrophobicContact CD1-CD2 4.2Å; L47-W51 HydrophobicContact CD1-CE3 4.23Å; L47-W51 HydrophobicContact CD1-CG 4.11Å; L47-Y71 HydrophobicContact CD1-CD1 3.66Å; L47-Y71 HydrophobicContact CD1-CE1 3.91Å; L47-M85 HydrophobicContact CD1-CE 3.63Å; L47-M85 HydrophobicContact CD1-SD 4.27Å; L47-M85 HydrophobicContact CD2-SD 4.07Å; L47-L89 HydrophobicContact CD2-CD1 4.48Å; L47-F98 HydrophobicContact CD1-CZ 4.13Å; L47-F98 HydrophobicContact CD2-CD2 4.49Å; L47-F98 HydrophobicContact CD2-CE2 4.06Å; L47-F98 HydrophobicContact CD2-CZ 4.25Å; L47-F98 HydrophobicContact CG-CE2 4.18Å; L47-F98 HydrophobicContact CG-CZ 4.25Å
48	P	80.4	Confident	74.2	Confident	31 Å²	31	77.2 Å²	77.2	20%	0.201	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-52.4	154.3	173.7	-27.2	36.4	0	0	0	112.1	G50 W51 L89 Y93	P48-G50 PolarHBondContact O-N 3.33Å; P48-W51 VanDerWaalsContact O-CD1 3.22Å; P48-W51 PolarHBondContact O-N 2.87Å; P48-L89 HydrophobicContact CG-CD2 3.78Å; P48-Y93 HydrophobicContact CG-CD1 4.16Å; P48-Y93 HydrophobicContact CG-CE1 3.58Å; P48-Y93 HydrophobicContact CG-CE2 4.02Å; P48-Y93 VanDerWaalsContact CG-CZ 3.5Å
49	T	79.6	Confident	76	Confident	140 Å²	140	73 Å²	73	86%	0.859	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	132.4	179	50.6	0	0	0	0	111.3
50	G	83.4	Confident	77.2	Confident	35 Å²	35	74.2 Å²	74.2	36%	0.361	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.9	-4.7	178.1	0	0	0	0	0	115.3	P48	P48-G50 PolarHBondContact O-N 3.33Å
51	W	87.4	Confident	78.4	Confident	9 Å²	9	70.4 Å²	70.4	3%	0.034	39%	0.391	C	S	.	.			trans	-77.8	139.5	169	-75.3	83.3	0	0	0	111.5	P44 L47 P48 I72 V79 M85 I88 L89	P44-W51 HydrophobicContact CG-CB 4.44Å; L47-W51 HydrophobicContact CB-CB 3.78Å; L47-W51 HydrophobicContact CB-CG 3.96Å; L47-W51 HydrophobicContact CD1-CB 3.93Å; L47-W51 HydrophobicContact CD1-CD2 4.2Å; L47-W51 HydrophobicContact CD1-CE3 4.23Å; L47-W51 HydrophobicContact CD1-CG 4.11Å; P48-W51 VanDerWaalsContact O-CD1 3.22Å; P48-W51 PolarHBondContact O-N 2.87Å; W51-I72 WeakPolarHBondContact CA-O 3.49Å; W51-V79 HydrophobicContact CH2-CG2 3.95Å; W51-V79 HydrophobicContact CZ3-CB 4.44Å; W51-V79 HydrophobicContact CZ3-CG2 3.72Å; W51-M85 HydrophobicContact CE3-CE 4.02Å; W51-M85 HydrophobicContact CH2-CE 4.46Å; W51-M85 HydrophobicContact CH2-CG 4Å; W51-M85 HydrophobicContact CZ3-CE 3.79Å; W51-M85 HydrophobicContact CZ3-CG 4.24Å; W51-I88 HydrophobicContact CH2-CB 4.36Å; W51-I88 HydrophobicContact CH2-CD1 4.43Å; W51-I88 HydrophobicContact CH2-CG2 4.08Å; W51-I88 HydrophobicContact CZ2-CB 4.49Å; W51-I88 HydrophobicContact CZ2-CG2 3.9Å; W51-L89 HydrophobicContact CZ2-CD2 3.77Å; W51-L89 HydrophobicContact CZ2-CG 3.93Å
52	R	88.6	Confident	79.1	Confident	57 Å²	57	74.4 Å²	74.4	22%	0.215	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	143.9	174.1	61.2	-177.5	-177.3	-89.7	12.3	111.4	E54 Y71 I72 N76	R52-E54 IonicContact NE-OE1 3.93Å; R52-Y71 CarbonylContact O-C 3.52Å; R52-Y71 VanDerWaalsContact O-CA 3.29Å; R52-Y71 WeakPolarHBondContact O-CA 3.46Å; R52-I72 HydrophobicContact CG-CB 3.57Å; R52-I72 HydrophobicContact CG-CD1 4.12Å; R52-I72 HydrophobicContact CG-CG1 4.12Å; R52-I72 VanDerWaalsContact CZ-CB 3.47Å; R52-I72 PolarHBondContact N-O 3.08Å; R52-I72 PolarHBondContact O-N 2.8Å; R52-N76 PolarHBondContact NH1-OD1 2.88Å; R52-N76 PolarHBondContact NH2-OD1 2.89Å
53	R	88.9	Confident	79.8	Confident	31 Å²	31	71.7 Å²	71.7	12%	0.117	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	131.3	173.4	-180	-175.4	174.3	-87.1	-0.5	109.1	V42 E55 V69 Y71 R101	V42-R53 PolarHBondContact N-O 2.88Å; V42-R53 WeakPolarHBondContact O-CB 3.21Å; V42-R53 PolarHBondContact O-N 2.98Å; R53-E55 IonicContact CZ-OE2 3.48Å; R53-E55 IonicContact NH1-OE2 3.85Å; R53-E55 PolarHBondContact NH1-OE2 3.45Å; R53-E55 IonicContact NH2-OE2 2.78Å; R53-E55 PolarHBondContact NH2-OE2 3.25Å; R53-V69 HydrophobicContact CG-CG1 3.83Å; R53-Y71 HydrophobicContact CB-CD1 4.09Å; R53-Y71 HydrophobicContact CB-CE1 3.78Å; R53-Y71 HydrophobicContact CG-CD1 4.49Å; R53-Y71 HydrophobicContact CG-CE1 3.92Å; R53-R101 PolarHBondContact NE-O 3.01Å; R53-R101 PolarHBondContact NH2-O 3.07Å
54	E	89.1	Confident	80.6	Confident	24 Å²	24	64.7 Å²	64.7	11%	0.112	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	129.5	172	-72	-174.6	-177.3	0	0	109.7	Q39 Q41 R52 V69 Y70 I72	Q39-E54 PolarHBondContact NE2-OE2 3.38Å; Q39-E54 VanDerWaalsContact NE2-OE2 3.14Å; Q41-E54 HydrophobicContact CG-CG 4.07Å; Q41-E54 PolarHBondContact NE2-OE1 3.04Å; Q41-E54 VanDerWaalsContact NE2-OE1 3.07Å; R52-E54 IonicContact NE-OE1 3.93Å; E54-V69 WeakPolarHBondContact O-CA 3.5Å; E54-Y70 PolarHBondContact N-O 2.99Å; E54-Y70 PolarHBondContact O-N 3.09Å; E54-I72 HydrophobicContact CG-CD1 4.1Å; E54-I72 WeakPolarHBondContact OE1-CD1 3.36Å
55	E	88.8	Confident	81.3	Confident	59 Å²	59	65 Å²	65	28%	0.276	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	127.1	172.5	-177.6	163.9	-174.7	0	0	108.9	R53 S67 D68 V69	R53-E55 IonicContact CZ-OE2 3.48Å; R53-E55 IonicContact NH1-OE2 3.85Å; R53-E55 PolarHBondContact NH1-OE2 3.45Å; R53-E55 IonicContact NH2-OE2 2.78Å; R53-E55 PolarHBondContact NH2-OE2 3.25Å; E55-S67 WeakPolarHBondContact OE1-CB 3.19Å; E55-S67 PolarHBondContact OE1-OG 2.85Å; E55-D68 WeakPolarHBondContact CA-O 3.27Å; E55-V69 HydrophobicContact CG-CG2 4.25Å
56	C	86.6	Confident	82.3	Confident	37 Å²	37	65.9 Å²	65.9	25%	0.25	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	144.4	176.8	73.4	0	0	0	0	111.1	S67 D68 Y70	C56-S67 WeakPolarHBondContact O-CA 3.34Å; C56-D68 PolarHBondContact N-O 3.04Å; C56-D68 PolarHBondContact O-N 2.74Å; C56-Y70 WeakPolarHBondContact SG-CE2 3.03Å
57	M	85.6	Confident	82.7	Confident	141 Å²	141	65.5 Å²	65.5	70%	0.695	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	135.2	171.5	-68.3	-172.9	-71.2	0	0	109.5	P59	M57-P59 WeakPolarHBondContact O-CD 3.32Å
58	R	84.4	Confident	83	Confident	91 Å²	91	66.3 Å²	66.3	34%	0.343	38%	0.375	S	S	.	.			trans	-63.8	121.6	173.6	-64.9	-177.3	-172.7	-166.1	0.6	109.4	G63 T64 G65 K66 D68	R58-G63 WeakPolarHBondContact CD-O 3.43Å; R58-T64 WeakPolarHBondContact O-CA 3.4Å; R58-G65 PolarHBondContact O-N 3.13Å; R58-K66 PolarHBondContact N-O 3.22Å; R58-D68 WeakPolarHBondContact CG-OD2 2.8Å; R58-D68 IonicContact CZ-OD1 3.01Å; R58-D68 IonicContact CZ-OD2 3.22Å; R58-D68 IonicContact NE-OD1 3.65Å; R58-D68 PolarHBondContact NE-OD1 3.18Å; R58-D68 IonicContact NE-OD2 3.01Å; R58-D68 PolarHBondContact NE-OD2 3.38Å; R58-D68 IonicContact NH2-OD1 3.77Å; R58-D68 PolarHBondContact NH2-OD1 3.14Å; R58-D68 IonicContact NH2-OD2 2.66Å; R58-D68 PolarHBondContact NH2-OD2 3.39Å
59	P	80.4	Confident	83.5	Confident	91 Å²	91	65.1 Å²	65.1	59%	0.591	37%	0.367	S	S	*	.			trans	-76.1	-35.3	-174.9	28	-33.4	0	0	0	112.6	M57 T64	M57-P59 WeakPolarHBondContact O-CD 3.32Å; P59-T64 VanDerWaalsContact O-CG2 3.23Å; P59-T64 WeakPolarHBondContact O-CG2 3.29Å
60	N	80.7	Confident	84.1	Confident	131 Å²	131	61.8 Å²	61.8	70%	0.701	34%	0.339	S	S	*	.	S	Bend	trans	-141.8	154.7	-170.7	-65.9	-29.7	0	0	0	112.6	T64	N60-T64 WeakPolarHBondContact CA-OG1 3.45Å
61	G	80.1	Confident	84.5	Confident	57 Å²	57	60.1 Å²	60.1	59%	0.588	32%	0.322	S	S	*	.	S	Bend	trans	104.4	-176.1	174.8	0	0	0	0	0	115.5	G63 T64	G61-G63 PolarHBondContact O-N 3.42Å; G61-T64 PolarHBondContact N-OG1 3.35Å; G61-T64 WeakPolarHBondContact O-CB 3.4Å; G61-T64 PolarHBondContact O-N 3.33Å; G61-T64 PolarHBondContact O-OG1 3.31Å
62	L	74.5	Confident	84.7	Confident	195 Å²	195	60 Å²	60	100%	1.021	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-13	179.1	-69	171.4	0	0	0	114.2
63	G	77.6	Confident	84.7	Confident	12 Å²	12	57.2 Å²	57.2	12%	0.124	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	11.9	176.3	0	0	0	0	0	114.3	R58 G61 G65 K66	R58-G63 WeakPolarHBondContact CD-O 3.43Å; G61-G63 PolarHBondContact O-N 3.42Å; G63-G65 PolarHBondContact O-N 3.46Å; G63-K66 WeakPolarHBondContact O-CB 3.49Å; G63-K66 PolarHBondContact O-N 3.08Å; G63-K66 VanDerWaalsContact O-N 3.12Å
64	T	76.1	Confident	84.6	Confident	34 Å²	34	58.7 Å²	58.7	21%	0.209	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	135.1	179.1	-62	0	0	0	0	111.2	R58 P59 N60 G61 K66 N261	R58-T64 WeakPolarHBondContact O-CA 3.4Å; P59-T64 VanDerWaalsContact O-CG2 3.23Å; P59-T64 WeakPolarHBondContact O-CG2 3.29Å; N60-T64 WeakPolarHBondContact CA-OG1 3.45Å; G61-T64 PolarHBondContact N-OG1 3.35Å; G61-T64 WeakPolarHBondContact O-CB 3.4Å; G61-T64 PolarHBondContact O-N 3.33Å; G61-T64 PolarHBondContact O-OG1 3.31Å; T64-K66 VanDerWaalsContact C-N 3.27Å; T64-K66 PolarHBondContact O-N 3.06Å; T64-N261 WeakPolarHBondContact CG2-OD1 3.33Å
65	G	76	Confident	84.5	Confident	21 Å²	21	63.6 Å²	63.6	22%	0.216	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.6	-7.6	179.2	0	0	0	0	0	115.3	R58 G63	R58-G65 PolarHBondContact O-N 3.13Å; G63-G65 PolarHBondContact O-N 3.46Å
66	K	83.1	Confident	84.5	Confident	137 Å²	137	66.1 Å²	66.1	60%	0.596	36%	0.363	S	S	*	.			trans	-70.3	140.5	164.7	-64.2	-174.1	178.8	-178.8	0	109.6	R58 G63 T64	R58-K66 PolarHBondContact N-O 3.22Å; G63-K66 WeakPolarHBondContact O-CB 3.49Å; G63-K66 PolarHBondContact O-N 3.08Å; G63-K66 VanDerWaalsContact O-N 3.12Å; T64-K66 VanDerWaalsContact C-N 3.27Å; T64-K66 PolarHBondContact O-N 3.06Å
67	S	84.7	Confident	84.6	Confident	26 Å²	26	69.2 Å²	69.2	18%	0.182	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	130.2	173.7	74.6	0	0	0	0	112.1	E55 C56 R101	E55-S67 WeakPolarHBondContact OE1-CB 3.19Å; E55-S67 PolarHBondContact OE1-OG 2.85Å; C56-S67 WeakPolarHBondContact O-CA 3.34Å; S67-R101 PolarHBondContact O-NH2 3.24Å; S67-R101 VanDerWaalsContact O-NH2 3.13Å; S67-R101 PolarHBondContact OG-NH2 2.84Å
68	D	87.6	Confident	84.9	Confident	33 Å²	33	67.6 Å²	67.6	18%	0.176	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	141.2	169.1	-66.2	-51.8	0	0	0	109.4	E55 C56 R58 Y70	E55-D68 WeakPolarHBondContact CA-O 3.27Å; C56-D68 PolarHBondContact N-O 3.04Å; C56-D68 PolarHBondContact O-N 2.74Å; R58-D68 WeakPolarHBondContact CG-OD2 2.8Å; R58-D68 IonicContact CZ-OD1 3.01Å; R58-D68 IonicContact CZ-OD2 3.22Å; R58-D68 IonicContact NE-OD1 3.65Å; R58-D68 PolarHBondContact NE-OD1 3.18Å; R58-D68 IonicContact NE-OD2 3.01Å; R58-D68 PolarHBondContact NE-OD2 3.38Å; R58-D68 IonicContact NH2-OD1 3.77Å; R58-D68 PolarHBondContact NH2-OD1 3.14Å; R58-D68 IonicContact NH2-OD2 2.66Å; R58-D68 PolarHBondContact NH2-OD2 3.39Å; D68-Y70 HydrophobicContact CB-CE2 4.31Å
69	V	90.8	Very high	85.3	Confident	7 Å²	7	63.3 Å²	63.3	4%	0.042	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	126.2	180	-178.2	0	0	0	0	108.6	R53 E54 E55 Y71 W100	R53-V69 HydrophobicContact CG-CG1 3.83Å; E54-V69 WeakPolarHBondContact O-CA 3.5Å; E55-V69 HydrophobicContact CG-CG2 4.25Å; V69-Y71 HydrophobicContact CG1-CD2 4.47Å; V69-Y71 HydrophobicContact CG1-CE2 3.78Å; V69-W100 PolarHBondContact O-NE1 2.66Å; V69-W100 VanDerWaalsContact O-NE1 3.13Å
70	Y	92.4	Very high	85.7	Confident	70 Å²	70	66.6 Å²	66.6	28%	0.275	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	149.6	175.3	-55.4	-59.6	0	0	0	110.4	E54 C56 D68 I78 R80	E54-Y70 PolarHBondContact N-O 2.99Å; E54-Y70 PolarHBondContact O-N 3.09Å; C56-Y70 WeakPolarHBondContact SG-CE2 3.03Å; D68-Y70 HydrophobicContact CB-CE2 4.31Å; Y70-I78 HydrophobicContact CD1-CG2 4.47Å; Y70-I78 HydrophobicContact CG-CG2 4.35Å; Y70-R80 HydrophobicContact CD1-CB 4.25Å; Y70-R80 HydrophobicContact CD1-CG 3.81Å; Y70-R80 HydrophobicContact CE1-CB 4.3Å; Y70-R80 HydrophobicContact CE1-CG 3.86Å
71	Y	91.9	Very high	86.2	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	146.1	169.5	-69.3	-97.1	0	0	0	109.1	P44 L47 R52 R53 V69 V79 M85 F98 W100 G103	P44-Y71 HydrophobicContact CB-CE1 4.43Å; P44-Y71 HydrophobicContact CG-CD1 4.37Å; P44-Y71 HydrophobicContact CG-CE1 4.19Å; L47-Y71 HydrophobicContact CD1-CD1 3.66Å; L47-Y71 HydrophobicContact CD1-CE1 3.91Å; R52-Y71 CarbonylContact O-C 3.52Å; R52-Y71 VanDerWaalsContact O-CA 3.29Å; R52-Y71 WeakPolarHBondContact O-CA 3.46Å; R53-Y71 HydrophobicContact CB-CD1 4.09Å; R53-Y71 HydrophobicContact CB-CE1 3.78Å; R53-Y71 HydrophobicContact CG-CD1 4.49Å; R53-Y71 HydrophobicContact CG-CE1 3.92Å; V69-Y71 HydrophobicContact CG1-CD2 4.47Å; V69-Y71 HydrophobicContact CG1-CE2 3.78Å; Y71-V79 PolarHBondContact N-O 2.9Å; Y71-V79 WeakPolarHBondContact O-CB 3.02Å; Y71-V79 PolarHBondContact O-N 3.1Å; Y71-M85 VanDerWaalsContact CB-CE 3.48Å; Y71-M85 HydrophobicContact CD1-CE 3.64Å; Y71-M85 HydrophobicContact CD2-CE 3.72Å; Y71-M85 HydrophobicContact CE1-CE 4.31Å; Y71-M85 HydrophobicContact CE2-CE 4.38Å; Y71-M85 HydrophobicContact CG-CE 3.31Å; Y71-F98 HydrophobicContact CE1-CE1 4.27Å; Y71-F98 AromaticContact CE1-CZ 3.83Å; Y71-F98 HydrophobicContact CE1-CZ 3.83Å; Y71-F98 HydrophobicContact CE2-CE1 4.21Å; Y71-F98 AromaticContact CZ-CE1 3.83Å; Y71-F98 AromaticContact CZ-CZ 3.73Å; Y71-W100 HydrophobicContact CD2-CD2 4.22Å; Y71-W100 AromaticContact CD2-CE2 3.94Å; Y71-W100 HydrophobicContact CD2-CE3 4.07Å; Y71-W100 AromaticContact CD2-CH2 3.41Å; Y71-W100 HydrophobicContact CD2-CH2 3.41Å; Y71-W100 VanDerWaalsContact CD2-CH2 3.41Å; Y71-W100 AromaticContact CD2-CZ2 3.56Å; Y71-W100 HydrophobicContact CD2-CZ2 3.56Å; Y71-W100 AromaticContact CD2-CZ3 3.67Å; Y71-W100 HydrophobicContact CD2-CZ3 3.67Å; Y71-W100 AromaticContact CE2-CD2 3.82Å; Y71-W100 HydrophobicContact CE2-CD2 3.82Å; Y71-W100 AromaticContact CE2-CE2 3.85Å; Y71-W100 AromaticContact CE2-CE3 3.87Å; Y71-W100 HydrophobicContact CE2-CE3 3.87Å; Y71-W100 HydrophobicContact CE2-CG 4.44Å; Y71-W100 HydrophobicContact CE2-CH2 4.02Å; Y71-W100 AromaticContact CE2-CZ2 3.97Å; Y71-W100 HydrophobicContact CE2-CZ2 3.97Å; Y71-W100 AromaticContact CE2-CZ3 3.96Å; Y71-W100 HydrophobicContact CE2-CZ3 3.96Å; Y71-W100 WeakPolarHBondContact CE2-O 3.09Å; Y71-W100 HydrophobicContact CG-CH2 4.33Å; Y71-W100 PolarHBondContact OH-O 3.42Å; Y71-G103 WeakPolarHBondContact OH-CA 3.44Å; Y71-G103 PolarHBondContact OH-N 3.12Å
72	I	91.7	Very high	86.5	Confident	5 Å²	5	63.1 Å²	63.1	3%	0.026	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	124.8	178.5	-45.8	167.8	0	0	0	108.7	W51 R52 E54 Q77 I78	W51-I72 WeakPolarHBondContact CA-O 3.49Å; R52-I72 HydrophobicContact CG-CB 3.57Å; R52-I72 HydrophobicContact CG-CD1 4.12Å; R52-I72 HydrophobicContact CG-CG1 4.12Å; R52-I72 VanDerWaalsContact CZ-CB 3.47Å; R52-I72 PolarHBondContact N-O 3.08Å; R52-I72 PolarHBondContact O-N 2.8Å; E54-I72 HydrophobicContact CG-CD1 4.1Å; E54-I72 WeakPolarHBondContact OE1-CD1 3.36Å; I72-Q77 WeakPolarHBondContact CA-O 3.37Å; I72-Q77 WeakPolarHBondContact CG2-O 3.22Å; I72-I78 HydrophobicContact CG1-CG1 4.26Å
73	S	88.8	Confident	87.1	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.296	C	S	.	.			trans	-71	165	-176.6	79.3	0	0	0	0	111.7	Q75 N76 Q77	S73-Q75 PolarHBondContact O-N 3.18Å; S73-Q75 VanDerWaalsContact O-N 3.1Å; S73-Q75 PolarHBondContact OG-N 2.81Å; S73-Q75 PolarHBondContact OG-OE1 2.91Å; S73-N76 WeakPolarHBondContact O-CA 3.45Å; S73-N76 PolarHBondContact O-N 2.82Å; S73-Q77 PolarHBondContact N-O 3.26Å; S73-Q77 WeakPolarHBondContact OG-CB 3.43Å; S73-Q77 PolarHBondContact OG-N 2.9Å
74	P	86.6	Confident	87.8	Confident	62 Å²	62	62 Å²	62	40%	0.403	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-24.7	171.7	-23.3	32.5	0	0	0	113.4	N76	P74-N76 VanDerWaalsContact C-N 3.28Å; P74-N76 PolarHBondContact O-N 3.46Å
75	Q	87	Confident	88.4	Confident	127 Å²	127	60.4 Å²	60.4	59%	0.593	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	11.5	174.8	-52.5	85.3	5.1	0	0	113.7	S73 Q77	S73-Q75 PolarHBondContact O-N 3.18Å; S73-Q75 VanDerWaalsContact O-N 3.1Å; S73-Q75 PolarHBondContact OG-N 2.81Å; S73-Q75 PolarHBondContact OG-OE1 2.91Å; Q75-Q77 VanDerWaalsContact C-N 3.31Å; Q75-Q77 HydrophobicContact CB-CG 4.46Å; Q75-Q77 PolarHBondContact O-N 2.81Å
76	N	88.3	Confident	88.9	Confident	111 Å²	111	63.6 Å²	63.6	59%	0.594	30%	0.302	S	S	*	.			trans	62.4	28.3	-176.8	-67.3	-51.5	0	0	0	115.2	R52 S73 P74	R52-N76 PolarHBondContact NH1-OD1 2.88Å; R52-N76 PolarHBondContact NH2-OD1 2.89Å; S73-N76 WeakPolarHBondContact O-CA 3.45Å; S73-N76 PolarHBondContact O-N 2.82Å; P74-N76 VanDerWaalsContact C-N 3.28Å; P74-N76 PolarHBondContact O-N 3.46Å
77	Q	89.3	Confident	89.2	Confident	102 Å²	102	62.7 Å²	62.7	48%	0.477	31%	0.309	S	S	.	.			trans	-89.1	128.5	173.4	-62.1	178.9	-50.2	0	0	110.7	I72 S73 Q75	I72-Q77 WeakPolarHBondContact CA-O 3.37Å; I72-Q77 WeakPolarHBondContact CG2-O 3.22Å; S73-Q77 PolarHBondContact N-O 3.26Å; S73-Q77 WeakPolarHBondContact OG-CB 3.43Å; S73-Q77 PolarHBondContact OG-N 2.9Å; Q75-Q77 VanDerWaalsContact C-N 3.31Å; Q75-Q77 HydrophobicContact CB-CG 4.46Å; Q75-Q77 PolarHBondContact O-N 2.81Å
78	I	91.9	Very high	89.3	Confident	107 Å²	107	64.5 Å²	64.5	55%	0.549	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	123.5	178.6	-54.2	175.8	0	0	0	109.4	Y70 I72 R80	Y70-I78 HydrophobicContact CD1-CG2 4.47Å; Y70-I78 HydrophobicContact CG-CG2 4.35Å; I72-I78 HydrophobicContact CG1-CG1 4.26Å; I78-R80 HydrophobicContact CG2-CG 4.42Å
79	V	91.9	Very high	89.2	Confident	1 Å²	1	64 Å²	64	1%	0.006	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	123.6	-178.5	-169.9	0	0	0	0	109	W51 Y71 N81 E84 M85 I88 W100	W51-V79 HydrophobicContact CH2-CG2 3.95Å; W51-V79 HydrophobicContact CZ3-CB 4.44Å; W51-V79 HydrophobicContact CZ3-CG2 3.72Å; Y71-V79 PolarHBondContact N-O 2.9Å; Y71-V79 WeakPolarHBondContact O-CB 3.02Å; Y71-V79 PolarHBondContact O-N 3.1Å; V79-N81 WeakPolarHBondContact CG1-O 3.36Å; V79-E84 HydrophobicContact CG1-CB 3.61Å; V79-M85 HydrophobicContact CG1-CB 3.79Å; V79-M85 VanDerWaalsContact CG1-N 3.25Å; V79-I88 HydrophobicContact CG2-CD1 3.53Å; V79-W100 HydrophobicContact CB-CH2 4.42Å; V79-W100 HydrophobicContact CG1-CH2 3.88Å
80	R	89.8	Confident	88.9	Confident	161 Å²	161	65 Å²	65	61%	0.608	32%	0.324	S	S	*	.			trans	-107.8	-16	-170.3	-61.5	177.8	-71.9	-147.2	-3.9	113.6	Y70 I78 E84	Y70-R80 HydrophobicContact CD1-CB 4.25Å; Y70-R80 HydrophobicContact CD1-CG 3.81Å; Y70-R80 HydrophobicContact CE1-CB 4.3Å; Y70-R80 HydrophobicContact CE1-CG 3.86Å; I78-R80 HydrophobicContact CG2-CG 4.42Å; R80-E84 PolarHBondContact N-OE2 3.24Å; R80-E84 IonicContact NE-OE1 2.86Å; R80-E84 IonicContact NH2-OE1 4Å
81	N	89.9	Confident	88.3	Confident	59 Å²	59	69.5 Å²	69.5	32%	0.316	35%	0.353	S	S	.	.	S	Bend	trans	-143.1	165.2	177.2	64.7	54.3	0	0	0	111.2	V79 Q83 E84 M85 W100	V79-N81 WeakPolarHBondContact CG1-O 3.36Å; N81-Q83 VanDerWaalsContact C-N 3.27Å; N81-Q83 PolarHBondContact O-N 2.78Å; N81-Q83 WeakPolarHBondContact OD1-CB 3.41Å; N81-Q83 PolarHBondContact OD1-N 2.75Å; N81-Q83 VanDerWaalsContact OD1-N 3.12Å; N81-E84 PolarHBondContact O-N 3.42Å; N81-E84 WeakPolarHBondContact OD1-CB 3.5Å; N81-E84 WeakPolarHBondContact OD1-CG 3.38Å; N81-E84 PolarHBondContact OD1-N 2.98Å; N81-M85 PolarHBondContact O-N 2.78Å; N81-W100 WeakPolarHBondContact O-CH2 3.38Å; N81-W100 WeakPolarHBondContact O-CZ3 3.48Å
82	K	86.9	Confident	87.4	Confident	55 Å²	55	78.9 Å²	78.9	24%	0.239	39%	0.394	C	S	.	.	H	α-helix	trans	-62.1	-35.5	-178.5	-173	170.3	175.7	164.1	0	112.1	M85 Q86 I95 G96 F98 W100	K82-M85 WeakPolarHBondContact O-CB 3.5Å; K82-M85 PolarHBondContact O-N 3.4Å; K82-Q86 PolarHBondContact O-N 2.73Å; K82-Q86 VanDerWaalsContact O-N 3.07Å; K82-I95 WeakPolarHBondContact CE-O 3.22Å; K82-I95 HydrophobicContact CG-CD1 3.58Å; K82-I95 HydrophobicContact CG-CG1 4.38Å; K82-I95 PolarHBondContact NZ-O 3.05Å; K82-I95 WeakPolarHBondContact O-CD1 3.09Å; K82-G96 PolarHBondContact NZ-O 3.32Å; K82-F98 PolarHBondContact NZ-O 3.31Å; K82-W100 HydrophobicContact CB-CE3 4.02Å; K82-W100 HydrophobicContact CB-CZ3 4.41Å
83	Q	87.9	Confident	86.7	Confident	125 Å²	125	83.9 Å²	83.9	58%	0.584	41%	0.413	S	S	*	.	H	α-helix	trans	-68.1	-43.8	-178.9	-68.7	76.2	9.9	0	0	112.4	N81 M85 Q86 T87	N81-Q83 VanDerWaalsContact C-N 3.27Å; N81-Q83 PolarHBondContact O-N 2.78Å; N81-Q83 WeakPolarHBondContact OD1-CB 3.41Å; N81-Q83 PolarHBondContact OD1-N 2.75Å; N81-Q83 VanDerWaalsContact OD1-N 3.12Å; Q83-M85 PolarHBondContact O-N 3.13Å; Q83-Q86 VanDerWaalsContact O-CB 3.32Å; Q83-Q86 WeakPolarHBondContact O-CB 3.42Å; Q83-Q86 PolarHBondContact O-N 3.45Å; Q83-Q86 VanDerWaalsContact O-N 3.09Å; Q83-T87 PolarHBondContact O-N 2.8Å; Q83-T87 VanDerWaalsContact O-N 3.08Å; Q83-T87 PolarHBondContact O-OG1 2.9Å; Q83-T87 VanDerWaalsContact O-OG1 3.13Å
84	E	90.5	Very high	86.3	Confident	59 Å²	59	89.3 Å²	89.3	28%	0.276	44%	0.442	S	S	.	.	H	α-helix	trans	-59	-37.4	174	-75.2	174.7	171.6	0	0	110.5	V79 R80 N81 T87 I88	V79-E84 HydrophobicContact CG1-CB 3.61Å; R80-E84 PolarHBondContact N-OE2 3.24Å; R80-E84 IonicContact NE-OE1 2.86Å; R80-E84 IonicContact NH2-OE1 4Å; N81-E84 PolarHBondContact O-N 3.42Å; N81-E84 WeakPolarHBondContact OD1-CB 3.5Å; N81-E84 WeakPolarHBondContact OD1-CG 3.38Å; N81-E84 PolarHBondContact OD1-N 2.98Å; E84-T87 PolarHBondContact O-N 3.25Å; E84-I88 WeakPolarHBondContact O-CG1 3.37Å; E84-I88 PolarHBondContact O-N 3.05Å
85	M	88.8	Confident	86.1	Confident	0 Å²	0	86.4 Å²	86.4	0%	0	42%	0.423	C	S	.	.	H	α-helix	trans	-64.4	-43	174.5	-170.2	177.9	-90.5	0	0	111.6	L47 W51 Y71 V79 N81 K82 Q83 T87 I88 L89 I95 F98 W100	L47-M85 HydrophobicContact CD1-CE 3.63Å; L47-M85 HydrophobicContact CD1-SD 4.27Å; L47-M85 HydrophobicContact CD2-SD 4.07Å; W51-M85 HydrophobicContact CE3-CE 4.02Å; W51-M85 HydrophobicContact CH2-CE 4.46Å; W51-M85 HydrophobicContact CH2-CG 4Å; W51-M85 HydrophobicContact CZ3-CE 3.79Å; W51-M85 HydrophobicContact CZ3-CG 4.24Å; Y71-M85 VanDerWaalsContact CB-CE 3.48Å; Y71-M85 HydrophobicContact CD1-CE 3.64Å; Y71-M85 HydrophobicContact CD2-CE 3.72Å; Y71-M85 HydrophobicContact CE1-CE 4.31Å; Y71-M85 HydrophobicContact CE2-CE 4.38Å; Y71-M85 HydrophobicContact CG-CE 3.31Å; V79-M85 HydrophobicContact CG1-CB 3.79Å; V79-M85 VanDerWaalsContact CG1-N 3.25Å; N81-M85 PolarHBondContact O-N 2.78Å; K82-M85 WeakPolarHBondContact O-CB 3.5Å; K82-M85 PolarHBondContact O-N 3.4Å; Q83-M85 PolarHBondContact O-N 3.13Å; M85-T87 VanDerWaalsContact C-N 3.29Å; M85-T87 PolarHBondContact O-N 3.12Å; M85-I88 PolarHBondContact O-N 3.36Å; M85-L89 HydrophobicContact CG-CD1 3.76Å; M85-L89 HydrophobicContact CG-CG 4.38Å; M85-L89 PolarHBondContact O-N 3.48Å; M85-L89 HydrophobicContact SD-CD1 4.31Å; M85-I95 HydrophobicContact CB-CD1 4.47Å; M85-I95 HydrophobicContact SD-CG2 4.47Å; M85-F98 HydrophobicContact CE-CE1 4.33Å; M85-F98 HydrophobicContact SD-CD1 4.34Å; M85-F98 HydrophobicContact SD-CE1 4.09Å; M85-W100 HydrophobicContact CB-CZ3 4.07Å; M85-W100 HydrophobicContact CE-CH2 4.27Å; M85-W100 HydrophobicContact CE-CZ3 3.77Å; M85-W100 HydrophobicContact SD-CZ3 4.05Å
86	Q	87.7	Confident	85.8	Confident	88 Å²	88	82.7 Å²	82.7	41%	0.411	42%	0.419	S	S	.	.	H	α-helix	trans	-59.1	-43.5	178.4	-155.8	165.6	-14.4	0	0	111.4	K82 Q83 I88 L89 G90 I95	K82-Q86 PolarHBondContact O-N 2.73Å; K82-Q86 VanDerWaalsContact O-N 3.07Å; Q83-Q86 VanDerWaalsContact O-CB 3.32Å; Q83-Q86 WeakPolarHBondContact O-CB 3.42Å; Q83-Q86 PolarHBondContact O-N 3.45Å; Q83-Q86 VanDerWaalsContact O-N 3.09Å; Q86-I88 VanDerWaalsContact C-N 3.3Å; Q86-I88 PolarHBondContact O-N 3.28Å; Q86-L89 PolarHBondContact O-N 2.82Å; Q86-G90 WeakPolarHBondContact O-CA 3.11Å; Q86-G90 PolarHBondContact O-N 2.87Å; Q86-I95 HydrophobicContact CB-CD1 3.41Å; Q86-I95 VanDerWaalsContact CB-CD1 3.41Å; Q86-I95 HydrophobicContact CB-CG1 4.14Å; Q86-I95 HydrophobicContact CG-CD1 3.8Å; Q86-I95 HydrophobicContact CG-CG1 3.96Å
87	T	88.4	Confident	85.4	Confident	119 Å²	119	81.7 Å²	81.7	73%	0.73	41%	0.413	S	S	*	.	H	α-helix	trans	-62.6	-36.4	179.5	-52.3	0	0	0	0	112.3	Q83 E84 M85	Q83-T87 PolarHBondContact O-N 2.8Å; Q83-T87 VanDerWaalsContact O-N 3.08Å; Q83-T87 PolarHBondContact O-OG1 2.9Å; Q83-T87 VanDerWaalsContact O-OG1 3.13Å; E84-T87 PolarHBondContact O-N 3.25Å; M85-T87 VanDerWaalsContact C-N 3.29Å; M85-T87 PolarHBondContact O-N 3.12Å
88	I	87.1	Confident	85.2	Confident	63 Å²	63	77.1 Å²	77.1	32%	0.323	39%	0.391	S	S	.	.	H	α-helix	trans	-77.9	-40	-179.4	-64.7	166.8	0	0	0	111.7	W51 V79 E84 M85 Q86 G90	W51-I88 HydrophobicContact CH2-CB 4.36Å; W51-I88 HydrophobicContact CH2-CD1 4.43Å; W51-I88 HydrophobicContact CH2-CG2 4.08Å; W51-I88 HydrophobicContact CZ2-CB 4.49Å; W51-I88 HydrophobicContact CZ2-CG2 3.9Å; V79-I88 HydrophobicContact CG2-CD1 3.53Å; E84-I88 WeakPolarHBondContact O-CG1 3.37Å; E84-I88 PolarHBondContact O-N 3.05Å; M85-I88 PolarHBondContact O-N 3.36Å; Q86-I88 VanDerWaalsContact C-N 3.3Å; Q86-I88 PolarHBondContact O-N 3.28Å; I88-G90 VanDerWaalsContact C-N 3.35Å
89	L	85.9	Confident	84.9	Confident	24 Å²	24	75 Å²	75	13%	0.126	38%	0.381	C	S	.	.	H	α-helix	trans	-77.3	-23.8	179.2	-69.6	172.2	0	0	0	112.9	L47 P48 W51 M85 Q86 Y93 I95	L47-L89 HydrophobicContact CD2-CD1 4.48Å; P48-L89 HydrophobicContact CG-CD2 3.78Å; W51-L89 HydrophobicContact CZ2-CD2 3.77Å; W51-L89 HydrophobicContact CZ2-CG 3.93Å; M85-L89 HydrophobicContact CG-CD1 3.76Å; M85-L89 HydrophobicContact CG-CG 4.38Å; M85-L89 PolarHBondContact O-N 3.48Å; M85-L89 HydrophobicContact SD-CD1 4.31Å; Q86-L89 PolarHBondContact O-N 2.82Å; L89-Y93 HydrophobicContact CB-CD2 4.16Å; L89-Y93 HydrophobicContact CB-CG 4.35Å; L89-Y93 HydrophobicContact CD2-CD2 4.13Å; L89-Y93 HydrophobicContact CD2-CG 4.36Å; L89-I95 HydrophobicContact CD1-CG2 3.79Å
90	G	83.4	Confident	84.7	Confident	26 Å²	26	77.1 Å²	77.1	27%	0.268	39%	0.389	S	S	.	.			trans	67.3	-174.4	-174.3	0	0	0	0	0	113	Q86 I88 K92 Y93	Q86-G90 WeakPolarHBondContact O-CA 3.11Å; Q86-G90 PolarHBondContact O-N 2.87Å; I88-G90 VanDerWaalsContact C-N 3.35Å; G90-K92 PolarHBondContact O-N 2.74Å; G90-Y93 PolarHBondContact O-N 3.03Å
91	D	80.8	Confident	84.5	Confident	165 Å²	165	76.3 Å²	76.3	88%	0.882	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-6.4	-176.2	-62.6	-23.3	0	0	0	114.1	Y93	D91-Y93 VanDerWaalsContact C-N 3.29Å; D91-Y93 PolarHBondContact O-N 2.92Å
92	K	73.6	Confident	84	Confident	197 Å²	197	79.7 Å²	79.7	86%	0.857	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-20.6	179.2	-61.7	-163.8	179.8	-154.1	0	113.2	G90	G90-K92 PolarHBondContact O-N 2.74Å
93	Y	76.8	Confident	83.8	Confident	111 Å²	111	77.2 Å²	77.2	44%	0.435	39%	0.392	S	S	.	.	S	Bend	trans	-121.4	110.3	-179.1	-72.4	-88.8	0	0	0	110.2	P48 L89 G90 D91 I95	P48-Y93 HydrophobicContact CG-CD1 4.16Å; P48-Y93 HydrophobicContact CG-CE1 3.58Å; P48-Y93 HydrophobicContact CG-CE2 4.02Å; P48-Y93 VanDerWaalsContact CG-CZ 3.5Å; L89-Y93 HydrophobicContact CB-CD2 4.16Å; L89-Y93 HydrophobicContact CB-CG 4.35Å; L89-Y93 HydrophobicContact CD2-CD2 4.13Å; L89-Y93 HydrophobicContact CD2-CG 4.36Å; G90-Y93 PolarHBondContact O-N 3.03Å; D91-Y93 VanDerWaalsContact C-N 3.29Å; D91-Y93 PolarHBondContact O-N 2.92Å; Y93-I95 PolarHBondContact O-N 3.13Å; Y93-I95 VanDerWaalsContact O-N 3.08Å
94	D	80.1	Confident	83.5	Confident	114 Å²	114	77.3 Å²	77.3	61%	0.61	39%	0.39	S	S	*	.			trans	-74.7	100.4	173.3	-177.4	14.4	0	0	0	110.3	G96 F105	D94-G96 VanDerWaalsContact C-N 3.27Å; D94-G96 WeakPolarHBondContact OD1-CA 3.39Å; D94-G96 PolarHBondContact OD1-N 2.87Å; D94-F105 VanDerWaalsContact O-CE1 3.27Å; D94-F105 WeakPolarHBondContact O-CE1 3.23Å
95	I	83	Confident	83	Confident	1 Å²	1	78.1 Å²	78.1	1%	0.005	39%	0.393	C	S	.	.			trans	-83.3	1	173.3	63.9	167.1	0	0	0	112.8	K82 M85 Q86 L89 Y93 L97 F98	K82-I95 WeakPolarHBondContact CE-O 3.22Å; K82-I95 HydrophobicContact CG-CD1 3.58Å; K82-I95 HydrophobicContact CG-CG1 4.38Å; K82-I95 PolarHBondContact NZ-O 3.05Å; K82-I95 WeakPolarHBondContact O-CD1 3.09Å; M85-I95 HydrophobicContact CB-CD1 4.47Å; M85-I95 HydrophobicContact SD-CG2 4.47Å; Q86-I95 HydrophobicContact CB-CD1 3.41Å; Q86-I95 VanDerWaalsContact CB-CD1 3.41Å; Q86-I95 HydrophobicContact CB-CG1 4.14Å; Q86-I95 HydrophobicContact CG-CD1 3.8Å; Q86-I95 HydrophobicContact CG-CG1 3.96Å; L89-I95 HydrophobicContact CD1-CG2 3.79Å; Y93-I95 PolarHBondContact O-N 3.13Å; Y93-I95 VanDerWaalsContact O-N 3.08Å; I95-L97 PolarHBondContact O-N 2.67Å; I95-F98 HydrophobicContact CB-CB 4.23Å; I95-F98 WeakPolarHBondContact O-CB 3.36Å; I95-F98 PolarHBondContact O-N 3.38Å
96	G	79.6	Confident	82.2	Confident	48 Å²	48	80.9 Å²	80.9	50%	0.495	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-44.5	-176.5	0	0	0	0	0	112.8	K82 D94	K82-G96 PolarHBondContact NZ-O 3.32Å; D94-G96 VanDerWaalsContact C-N 3.27Å; D94-G96 WeakPolarHBondContact OD1-CA 3.39Å; D94-G96 PolarHBondContact OD1-N 2.87Å
97	L	80.7	Confident	81	Confident	91 Å²	91	82.7 Å²	82.7	48%	0.476	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-0.6	179	-60.2	176	0	0	0	114.5	I95 D99 F105 A106	I95-L97 PolarHBondContact O-N 2.67Å; L97-D99 PolarHBondContact O-N 2.74Å; L97-F105 HydrophobicContact CB-CD1 4.23Å; L97-A106 PolarHBondContact O-N 2.77Å
98	F	85.5	Confident	79	Confident	6 Å²	6	80.4 Å²	80.4	3%	0.026	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	124.1	-179.6	-172.1	-109.6	0	0	0	111.6	L47 Y71 K82 M85 I95 W100 F105	L47-F98 HydrophobicContact CD1-CZ 4.13Å; L47-F98 HydrophobicContact CD2-CD2 4.49Å; L47-F98 HydrophobicContact CD2-CE2 4.06Å; L47-F98 HydrophobicContact CD2-CZ 4.25Å; L47-F98 HydrophobicContact CG-CE2 4.18Å; L47-F98 HydrophobicContact CG-CZ 4.25Å; Y71-F98 HydrophobicContact CE1-CE1 4.27Å; Y71-F98 AromaticContact CE1-CZ 3.83Å; Y71-F98 HydrophobicContact CE1-CZ 3.83Å; Y71-F98 HydrophobicContact CE2-CE1 4.21Å; Y71-F98 AromaticContact CZ-CE1 3.83Å; Y71-F98 AromaticContact CZ-CZ 3.73Å; K82-F98 PolarHBondContact NZ-O 3.31Å; M85-F98 HydrophobicContact CE-CE1 4.33Å; M85-F98 HydrophobicContact SD-CD1 4.34Å; M85-F98 HydrophobicContact SD-CE1 4.09Å; I95-F98 HydrophobicContact CB-CB 4.23Å; I95-F98 WeakPolarHBondContact O-CB 3.36Å; I95-F98 PolarHBondContact O-N 3.38Å; F98-W100 HydrophobicContact CD1-CE3 4.46Å; F98-W100 HydrophobicContact CE1-CE3 4.2Å; F98-F105 HydrophobicContact CB-CD1 3.85Å; F98-F105 HydrophobicContact CB-CE1 3.66Å; F98-F105 HydrophobicContact CB-CZ 4.4Å; F98-F105 HydrophobicContact CD2-CD1 4.22Å; F98-F105 HydrophobicContact CD2-CD2 4.46Å; F98-F105 HydrophobicContact CD2-CE1 4.11Å; F98-F105 HydrophobicContact CD2-CE2 4.32Å; F98-F105 HydrophobicContact CD2-CG 4.38Å; F98-F105 HydrophobicContact CD2-CZ 4.14Å; F98-F105 HydrophobicContact CG-CE1 4.33Å
99	D	85.4	Confident	76.8	Confident	61 Å²	61	83.5 Å²	83.5	33%	0.326	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	111.9	169.2	-173.6	-39.8	0	0	0	109.7	L97 R101 M102 G103 K104	L97-D99 PolarHBondContact O-N 2.74Å; D99-R101 VanDerWaalsContact C-N 3.34Å; D99-R101 PolarHBondContact O-N 2.86Å; D99-R101 PolarHBondContact OD1-N 3.38Å; D99-M102 HydrophobicContact CB-CB 4.06Å; D99-M102 HydrophobicContact CB-CG 4.45Å; D99-M102 PolarHBondContact OD1-N 3.36Å; D99-G103 PolarHBondContact O-N 3.04Å; D99-K104 WeakPolarHBondContact CB-O 3.08Å; D99-K104 PolarHBondContact N-O 3.39Å
100	W	86.9	Confident	74.7	Confident	47 Å²	47	89 Å²	89	18%	0.178	47%	0.468	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-39.4	-177.3	-173.8	-98.6	0	0	0	113.4	V69 Y71 V79 N81 K82 M85 F98	V69-W100 PolarHBondContact O-NE1 2.66Å; V69-W100 VanDerWaalsContact O-NE1 3.13Å; Y71-W100 HydrophobicContact CD2-CD2 4.22Å; Y71-W100 AromaticContact CD2-CE2 3.94Å; Y71-W100 HydrophobicContact CD2-CE3 4.07Å; Y71-W100 AromaticContact CD2-CH2 3.41Å; Y71-W100 HydrophobicContact CD2-CH2 3.41Å; Y71-W100 VanDerWaalsContact CD2-CH2 3.41Å; Y71-W100 AromaticContact CD2-CZ2 3.56Å; Y71-W100 HydrophobicContact CD2-CZ2 3.56Å; Y71-W100 AromaticContact CD2-CZ3 3.67Å; Y71-W100 HydrophobicContact CD2-CZ3 3.67Å; Y71-W100 AromaticContact CE2-CD2 3.82Å; Y71-W100 HydrophobicContact CE2-CD2 3.82Å; Y71-W100 AromaticContact CE2-CE2 3.85Å; Y71-W100 AromaticContact CE2-CE3 3.87Å; Y71-W100 HydrophobicContact CE2-CE3 3.87Å; Y71-W100 HydrophobicContact CE2-CG 4.44Å; Y71-W100 HydrophobicContact CE2-CH2 4.02Å; Y71-W100 AromaticContact CE2-CZ2 3.97Å; Y71-W100 HydrophobicContact CE2-CZ2 3.97Å; Y71-W100 AromaticContact CE2-CZ3 3.96Å; Y71-W100 HydrophobicContact CE2-CZ3 3.96Å; Y71-W100 WeakPolarHBondContact CE2-O 3.09Å; Y71-W100 HydrophobicContact CG-CH2 4.33Å; Y71-W100 PolarHBondContact OH-O 3.42Å; V79-W100 HydrophobicContact CB-CH2 4.42Å; V79-W100 HydrophobicContact CG1-CH2 3.88Å; N81-W100 WeakPolarHBondContact O-CH2 3.38Å; N81-W100 WeakPolarHBondContact O-CZ3 3.48Å; K82-W100 HydrophobicContact CB-CE3 4.02Å; K82-W100 HydrophobicContact CB-CZ3 4.41Å; M85-W100 HydrophobicContact CB-CZ3 4.07Å; M85-W100 HydrophobicContact CE-CH2 4.27Å; M85-W100 HydrophobicContact CE-CZ3 3.77Å; M85-W100 HydrophobicContact SD-CZ3 4.05Å; F98-W100 HydrophobicContact CD1-CE3 4.46Å; F98-W100 HydrophobicContact CE1-CE3 4.2Å
101	R	85.4	Confident	72.5	Confident	144 Å²	144	94.8 Å²	94.8	54%	0.543	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-42.2	-176.6	-65.4	-171.4	83.8	84.2	5.1	110.3	R53 S67 D99	R53-R101 PolarHBondContact NE-O 3.01Å; R53-R101 PolarHBondContact NH2-O 3.07Å; S67-R101 PolarHBondContact O-NH2 3.24Å; S67-R101 VanDerWaalsContact O-NH2 3.13Å; S67-R101 PolarHBondContact OG-NH2 2.84Å; D99-R101 VanDerWaalsContact C-N 3.34Å; D99-R101 PolarHBondContact O-N 2.86Å; D99-R101 PolarHBondContact OD1-N 3.38Å
102	M	79.9	Confident	70.6	Confident	130 Å²	130	93.1 Å²	93.1	64%	0.64	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-22.1	-176.8	-62	-174.2	67.6	0	0	113.8	D99 K104	D99-M102 HydrophobicContact CB-CB 4.06Å; D99-M102 HydrophobicContact CB-CG 4.45Å; D99-M102 PolarHBondContact OD1-N 3.36Å; M102-K104 VanDerWaalsContact C-N 3.34Å
103	G	82.3	Confident	68.7	Low	3 Å²	3	90.9 Å²	90.9	3%	0.031	48%	0.48	C	S	.	.	T	Hydrogen-bonded Turn	trans	69	30.9	-178.3	0	0	0	0	0	114.1	S46 Y71 D99	S46-G103 PolarHBondContact OG-O 3.4Å; Y71-G103 WeakPolarHBondContact OH-CA 3.44Å; Y71-G103 PolarHBondContact OH-N 3.12Å; D99-G103 PolarHBondContact O-N 3.04Å
104	K	82.3	Confident	66.7	Low	127 Å²	127	93.2 Å²	93.2	55%	0.552	50%	0.5	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139	152.9	-179.1	-62.9	-176.7	-179.3	-178.6	0	109.9	D99 M102	D99-K104 WeakPolarHBondContact CB-O 3.08Å; D99-K104 PolarHBondContact N-O 3.39Å; M102-K104 VanDerWaalsContact C-N 3.34Å
105	F	80	Confident	64.5	Low	76 Å²	76	95.9 Å²	95.9	33%	0.333	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	130.6	166.8	-69.1	-78.1	0	0	0	109.8	S46 D94 L97 F98 V107	S46-F105 WeakPolarHBondContact O-CE2 3.44Å; D94-F105 VanDerWaalsContact O-CE1 3.27Å; D94-F105 WeakPolarHBondContact O-CE1 3.23Å; L97-F105 HydrophobicContact CB-CD1 4.23Å; F98-F105 HydrophobicContact CB-CD1 3.85Å; F98-F105 HydrophobicContact CB-CE1 3.66Å; F98-F105 HydrophobicContact CB-CZ 4.4Å; F98-F105 HydrophobicContact CD2-CD1 4.22Å; F98-F105 HydrophobicContact CD2-CD2 4.46Å; F98-F105 HydrophobicContact CD2-CE1 4.11Å; F98-F105 HydrophobicContact CD2-CE2 4.32Å; F98-F105 HydrophobicContact CD2-CG 4.38Å; F98-F105 HydrophobicContact CD2-CZ 4.14Å; F98-F105 HydrophobicContact CG-CE1 4.33Å; F105-V107 PolarHBondContact O-N 3.38Å
106	A	70.8	Confident	62.3	Low	58 Å²	58	100.2 Å²	100.2	48%	0.479	55%	0.55	S	S	.	.			trans	-62.2	122.4	168.2	0	0	0	0	0	108.1	L97 S108	L97-A106 PolarHBondContact O-N 2.77Å; A106-S108 PolarHBondContact O-N 3.1Å; A106-S108 VanDerWaalsContact O-N 3.1Å
107	V	62.5	Low	60.3	Low	126 Å²	126	106 Å²	106	76%	0.764	57%	0.57	S	S	*	*			trans	-64.8	112.9	173.1	-176.2	0	0	0	0	106.9	F105 N109	F105-V107 PolarHBondContact O-N 3.38Å; V107-N109 VanDerWaalsContact C-N 3.29Å; V107-N109 PolarHBondContact O-N 3.21Å
108	S	47.2	Very low	58.1	Low	71 Å²	71	111.3 Å²	111.3	50%	0.497	59%	0.589	S	S	.	*			trans	-69.5	90	171.9	-173.8	0	0	0	0	108.4	A106 N110	A106-S108 PolarHBondContact O-N 3.1Å; A106-S108 VanDerWaalsContact O-N 3.1Å; S108-N110 PolarHBondContact O-N 2.78Å
109	N	41.7	Very low	56.3	Low	127 Å²	127	116.5 Å²	116.5	68%	0.679	63%	0.626	S	S	*	*			trans	-78.1	50.8	166.4	-111.3	22.1	0	0	0	109.9	V107	V107-N109 VanDerWaalsContact C-N 3.29Å; V107-N109 PolarHBondContact O-N 3.21Å
110	N	40.2	Very low	54.2	Low	141 Å²	141	123 Å²	123	75%	0.754	65%	0.651	S	S	*	*			trans	-102.2	56.9	171.3	-78.5	-11	0	0	0	109.6	S108	S108-N110 PolarHBondContact O-N 2.78Å
111	N	37.2	Very low	51.6	Low	146 Å²	146	130.4 Å²	130.4	78%	0.781	68%	0.679	S	S	*	*	S	Bend	trans	-167.6	37.8	157.3	-134.8	-2.8	0	0	0	115.9
112	I	40.7	Very low	49.7	Very low	130 Å²	130	131.4 Å²	131.4	67%	0.667	69%	0.694	S	S	*	*	S	Bend	trans	-145.2	121.8	166.2	-65.1	93.8	0	0	0	107.1
113	N	35	Very low	47.8	Very low	150 Å²	150	132 Å²	132	80%	0.802	70%	0.696	S	S	*	*			trans	102.3	48.2	177.2	-51.2	-19.9	0	0	0	117.2
114	N	33.9	Very low	45.3	Very low	160 Å²	160	140.3 Å²	140.3	86%	0.856	73%	0.733	S	S	*	*			trans	-90.7	139.8	139.1	-80.3	-38.8	0	0	0	107.8
115	N	35	Very low	43.2	Very low	171 Å²	171	139.3 Å²	139.3	91%	0.914	74%	0.74	S	S	*	*			trans	76.8	84.5	176.9	-82.6	-16.3	0	0	0	118.8
116	A	35.6	Very low	41.2	Very low	91 Å²	91	141.4 Å²	141.4	75%	0.752	76%	0.759	S	S	*	*			trans	-159.8	114.7	137.2	0	0	0	0	0	109.8
117	N	37.4	Very low	39.5	Very low	171 Å²	171	142.5 Å²	142.5	91%	0.914	77%	0.768	S	S	*	*			trans	118.1	68.2	163.9	-57.5	-11.2	0	0	0	114.9
118	K	36	Very low	38.3	Very low	202 Å²	202	143.6 Å²	143.6	88%	0.878	77%	0.77	S	S	*	*			trans	-124	103.9	157.7	-165.9	176.2	-171	176.4	0	108.4
119	S	47.5	Very low	37.9	Very low	115 Å²	115	145.8 Å²	145.8	80%	0.804	78%	0.78	S	S	*	*			trans	173.8	125.7	164.4	-88.4	0	0	0	0	106.5
120	K	40.9	Very low	37.6	Very low	196 Å²	196	144.7 Å²	144.7	85%	0.852	78%	0.782	S	S	*	*			cis	-155.4	122.6	10.1	-82.4	166.7	170.5	177.6	0	104.8
121	R	33.2	Very low	37.7	Very low	204 Å²	204	143.4 Å²	143.4	77%	0.77	79%	0.785	S	S	*	*				26.9	111.2	97.4	-162.4	174.8	-172.6	-176	0.8	117.5	E123	R121-E123 IonicContact CZ-OE1 3.94Å; R121-E123 IonicContact NE-OE1 2.67Å; R121-E123 PolarHBondContact NE-OE1 3.44Å; R121-E123 IonicContact NH2-OE1 2.65Å; R121-E123 PolarHBondContact NH2-OE1 3.16Å
122	L	45.3	Very low	37.6	Very low	164 Å²	164	140.9 Å²	140.9	86%	0.859	78%	0.784	S	S	*	*			trans	-177.8	97.9	134.3	-133	78.8	0	0	0	107.4
123	E	39.2	Very low	37.5	Very low	144 Å²	144	140 Å²	140	67%	0.673	79%	0.79	S	S	*	*				55.5	106.6	95.6	-69.9	-169.4	-154.8	0	0	116	R121	R121-E123 IonicContact CZ-OE1 3.94Å; R121-E123 IonicContact NE-OE1 2.67Å; R121-E123 PolarHBondContact NE-OE1 3.44Å; R121-E123 IonicContact NH2-OE1 2.65Å; R121-E123 PolarHBondContact NH2-OE1 3.16Å
124	E	29.5	Very low	37.6	Very low	176 Å²	176	138.1 Å²	138.1	82%	0.822	79%	0.788	S	S	*	*			trans	-58.7	148.2	157.6	-91.9	-103.7	154.9	0	0	110.9
125	P	39.3	Very low	37.7	Very low	106 Å²	106	136.7 Å²	136.7	69%	0.688	79%	0.787	S	S	*	*				-154	143	96.8	35.9	-15.6	0	0	0	117.6
126	T	37.2	Very low	38	Very low	121 Å²	121	135 Å²	135	74%	0.742	78%	0.784	S	S	*	*			trans	62.8	133.5	134.3	63.5	0	0	0	0	123.1
127	A	36	Very low	38.2	Very low	80 Å²	80	135.2 Å²	135.2	66%	0.661	79%	0.785	S	S	*	*			trans	98.1	118.8	134.7	0	0	0	0	0	119.1
128	D	36.7	Very low	38	Very low	149 Å²	149	136.9 Å²	136.9	80%	0.797	79%	0.785	S	S	*	*			trans	100.8	114.1	134.1	-62.8	-9.4	0	0	0	121.1
129	T	38.5	Very low	38.2	Very low	118 Å²	118	133.3 Å²	133.3	72%	0.724	78%	0.779	S	S	*	*			trans	92.6	93	130	-53.3	0	0	0	0	118.9
130	S	36	Very low	37.7	Very low	103 Å²	103	133.1 Å²	133.1	72%	0.72	78%	0.775	S	S	*	*			trans	23.6	118.8	131	61.3	0	0	0	0	120.7
131	S	41.1	Very low	37.5	Very low	114 Å²	114	134.3 Å²	134.3	80%	0.797	78%	0.775	S	S	*	*			trans	177.2	103.8	130.5	53.6	0	0	0	0	108
132	A	35.7	Very low	37.7	Very low	94 Å²	94	130.7 Å²	130.7	78%	0.777	78%	0.775	S	S	*	*				71.2	129.1	92.1	0	0	0	0	0	114.8
133	S	39.1	Very low	37.3	Very low	112 Å²	112	128.7 Å²	128.7	78%	0.783	77%	0.765	S	S	*	*			trans	85.8	103.1	159.6	75.5	0	0	0	0	119.2
134	S	37.1	Very low	37.3	Very low	110 Å²	110	129.1 Å²	129.1	77%	0.769	77%	0.772	S	S	*	*				-177.7	114.8	119.5	-79.7	0	0	0	0	110.9
135	P	34.9	Very low	38.1	Very low	129 Å²	129	128.3 Å²	128.3	84%	0.838	77%	0.768	S	S	*	*			trans	-93	121	174.2	33.7	-25	0	0	0	109.5
136	T	42.2	Very low	38	Very low	136 Å²	136	128.6 Å²	128.6	83%	0.834	77%	0.771	S	S	*	*			trans	-124.3	115.1	170	45.1	0	0	0	0	111.5
137	A	39.3	Very low	38	Very low	95 Å²	95	128.1 Å²	128.1	79%	0.785	77%	0.773	S	S	*	*			trans	48.4	98.2	152	0	0	0	0	0	118.8	V139	A137-V139 PolarHBondContact O-N 3.18Å
138	K	32.8	Very low	38.3	Very low	207 Å²	207	130.8 Å²	130.8	90%	0.9	78%	0.775	S	S	*	*			trans	-64.5	111.3	161.4	-63.2	172.7	179.8	176.4	0	110.1
139	V	40.1	Very low	38.5	Very low	126 Å²	126	129.8 Å²	129.8	76%	0.764	78%	0.777	S	S	*	*			trans	-102.3	111.2	154.5	179.5	0	0	0	0	106.4	A137 R141	A137-V139 PolarHBondContact O-N 3.18Å; V139-R141 PolarHBondContact O-N 3.2Å
140	P	37.1	Very low	38.7	Very low	112 Å²	112	131 Å²	131	73%	0.727	78%	0.776	S	S	*	*			trans	-68.1	107.4	172.3	-15	29.6	0	0	0	108.5	V142	P140-V142 PolarHBondContact O-N 3.17Å
141	R	36.3	Very low	39.1	Very low	221 Å²	221	136.1 Å²	136.1	83%	0.834	78%	0.78	S	S	*	*			trans	-58.6	121.6	161.2	-80.3	-175.6	171.6	95.7	-0.9	107.1	V139 D143	V139-R141 PolarHBondContact O-N 3.2Å; R141-D143 PolarHBondContact O-N 3.38Å
142	V	39.3	Very low	38.9	Very low	128 Å²	128	142.6 Å²	142.6	78%	0.776	79%	0.786	S	S	*	*			trans	-73.6	80.8	172.6	-173.6	0	0	0	0	106.9	P140 N144	P140-V142 PolarHBondContact O-N 3.17Å; V142-N144 PolarHBondContact O-N 3.1Å; V142-N144 VanDerWaalsContact O-N 3.12Å
143	D	35	Very low	39.1	Very low	121 Å²	121	141.7 Å²	141.7	65%	0.647	77%	0.774	S	S	*	*			trans	-71	106.1	168.6	-81.9	-28.6	0	0	0	107.7	R141 Q145	R141-D143 PolarHBondContact O-N 3.38Å; D143-Q145 HydrophobicContact CB-CG 4.47Å; D143-Q145 PolarHBondContact O-N 3.24Å
144	N	40.1	Very low	39.4	Very low	153 Å²	153	142 Å²	142	82%	0.818	77%	0.773	S	S	*	*			trans	-70.7	60.5	-179.7	-134.1	60.3	0	0	0	110.3	V142 C146	V142-N144 PolarHBondContact O-N 3.1Å; V142-N144 VanDerWaalsContact O-N 3.12Å; N144-C146 PolarHBondContact O-N 3.15Å
145	Q	45.8	Very low	39.8	Very low	160 Å²	160	143.8 Å²	143.8	75%	0.748	77%	0.767	S	S	*	*			trans	-86.6	92	168.7	-58.9	-166.9	56.5	0	0	106.7	D143 S147	D143-Q145 HydrophobicContact CB-CG 4.47Å; D143-Q145 PolarHBondContact O-N 3.24Å; Q145-S147 PolarHBondContact O-N 3.33Å
146	C	36.8	Very low	40	Very low	112 Å²	112	141.9 Å²	141.9	76%	0.757	76%	0.755	S	S	*	*			trans	-66.2	83.6	171.3	-161.1	0	0	0	0	108.3	N144 L148	N144-C146 PolarHBondContact O-N 3.15Å; C146-L148 VanDerWaalsContact C-N 3.28Å; C146-L148 PolarHBondContact O-N 2.91Å
147	S	37.5	Very low	40.2	Very low	110 Å²	110	141.3 Å²	141.3	77%	0.769	75%	0.746	S	S	*	*			trans	-76.3	82.1	172.5	60	0	0	0	0	108.4	Q145	Q145-S147 PolarHBondContact O-N 3.33Å
148	L	44	Very low	40.6	Very low	136 Å²	136	140 Å²	140	71%	0.712	73%	0.727	S	S	*	*			trans	-59.7	145.2	157.4	-64.7	177.2	0	0	0	107.8	C146 M150	C146-L148 VanDerWaalsContact C-N 3.28Å; C146-L148 PolarHBondContact O-N 2.91Å; L148-M150 VanDerWaalsContact C-N 3.26Å; L148-M150 PolarHBondContact O-N 3.25Å
149	P	40.4	Very low	41.7	Very low	128 Å²	128	136.4 Å²	136.4	83%	0.831	72%	0.718	S	S	*	*			trans	-65.1	88.9	-178.1	26.6	-33	0	0	0	109.6	R151	P149-R151 PolarHBondContact O-N 3.37Å
150	M	41.8	Very low	42.2	Very low	145 Å²	145	136.3 Å²	136.3	71%	0.714	71%	0.713	S	S	*	*			trans	-71.1	109.5	175	-150.6	153	65.7	0	0	105.8	L148 R152	L148-M150 VanDerWaalsContact C-N 3.26Å; L148-M150 PolarHBondContact O-N 3.25Å; M150-R152 PolarHBondContact O-N 3.47Å
151	R	45.1	Very low	43.2	Very low	210 Å²	210	137.8 Å²	137.8	79%	0.792	71%	0.714	S	S	*	*			trans	-42.6	130.5	172.9	-83.8	-173	179	145.9	-0.9	108.4	P149 C153	P149-R151 PolarHBondContact O-N 3.37Å; R151-C153 VanDerWaalsContact C-N 3.26Å; R151-C153 PolarHBondContact O-N 3.43Å
152	R	36.6	Very low	44.3	Very low	249 Å²	249	134.3 Å²	134.3	94%	0.94	71%	0.705	S	S	*	*			trans	-56.6	87.1	174.8	-71.2	-178.5	179	174.8	-0.5	109.7	M150	M150-R152 PolarHBondContact O-N 3.47Å
153	C	39.9	Very low	45.4	Very low	76 Å²	76	131.8 Å²	131.8	51%	0.514	69%	0.691	S	S	.	*			trans	-69.2	135.7	155.1	-71.1	0	0	0	0	106.7	R151 F155	R151-C153 VanDerWaalsContact C-N 3.26Å; R151-C153 PolarHBondContact O-N 3.43Å; C153-F155 PolarHBondContact O-N 3.41Å
154	P	45.1	Very low	46.9	Very low	117 Å²	117	132.4 Å²	132.4	76%	0.76	70%	0.699	S	S	*	*	S	Bend	trans	-67.7	0.8	177.9	29.4	-34.1	0	0	0	112.8
155	F	45.1	Very low	48	Very low	148 Å²	148	128 Å²	128	65%	0.649	67%	0.674	S	S	*	*	S	Bend	trans	-110.3	119.5	169.8	-43.3	-72.5	0	0	0	106.8	C153 I157	C153-F155 PolarHBondContact O-N 3.41Å; F155-I157 PolarHBondContact O-N 2.87Å
156	P	40	Very low	49.1	Very low	89 Å²	89	125 Å²	125	58%	0.578	67%	0.667	S	S	*	*			trans	-57.5	121.1	165.3	25.9	-30.5	0	0	0	106.3	T158	P156-T158 HydrophobicContact CB-CG2 3.81Å; P156-T158 PolarHBondContact O-N 2.97Å
157	I	47	Very low	50.4	Low	125 Å²	125	124.5 Å²	124.5	64%	0.641	65%	0.649	S	S	*	*			trans	-71.6	62.8	160	-53	173.7	0	0	0	105.4	F155	F155-I157 PolarHBondContact O-N 2.87Å
158	T	47.8	Very low	51.7	Low	66 Å²	66	121 Å²	121	41%	0.405	63%	0.625	S	S	.	*			trans	-83.8	139.3	159.7	57.6	0	0	0	0	105.8	P156 D160	P156-T158 HydrophobicContact CB-CG2 3.81Å; P156-T158 PolarHBondContact O-N 2.97Å; T158-D160 WeakPolarHBondContact CB-OD2 3.43Å; T158-D160 PolarHBondContact O-N 2.99Å; T158-D160 PolarHBondContact OG1-OD2 3.04Å; T158-D160 VanDerWaalsContact OG1-OD2 3.08Å
159	N	54.7	Low	52.9	Low	133 Å²	133	121.6 Å²	121.6	71%	0.711	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	26.2	178.5	-67.7	-49.4	0	0	0	113.1
160	D	51.8	Low	54.3	Low	123 Å²	123	121.4 Å²	121.4	66%	0.658	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	-17.3	-165.7	-55.5	-26.1	0	0	0	112.5	T158 K162	T158-D160 WeakPolarHBondContact CB-OD2 3.43Å; T158-D160 PolarHBondContact O-N 2.99Å; T158-D160 PolarHBondContact OG1-OD2 3.04Å; T158-D160 VanDerWaalsContact OG1-OD2 3.08Å; D160-K162 PolarHBondContact O-N 2.98Å
161	I	57	Low	55.7	Low	143 Å²	143	122.5 Å²	122.5	73%	0.733	63%	0.626	S	S	*	*			trans	-80	79.1	170.6	-52.6	176.1	0	0	0	108.1	P163	I161-P163 WeakPolarHBondContact O-CD 3.4Å
162	K	60.3	Low	56.9	Low	149 Å²	149	115.2 Å²	115.2	65%	0.648	61%	0.607	S	S	*	*			trans	-74.9	118.2	169.9	-66.4	-177.9	-177.7	178	0	108.2	D160 V164 T184	D160-K162 PolarHBondContact O-N 2.98Å; K162-V164 PolarHBondContact O-N 2.89Å; K162-T184 HydrophobicContact CG-CG2 4.28Å
163	P	61.6	Low	58.4	Low	75 Å²	75	113.1 Å²	113.1	49%	0.487	60%	0.604	S	S	.	*			trans	-61.4	132.1	175.5	26.5	-33.5	0	0	0	109	I161 I165 P185	I161-P163 WeakPolarHBondContact O-CD 3.4Å; P163-I165 PolarHBondContact O-N 3.36Å; P163-P185 HydrophobicContact CG-CG 3.83Å
164	V	65.7	Low	59.6	Low	134 Å²	134	116.9 Å²	116.9	81%	0.812	61%	0.608	S	S	*	*			trans	-68.7	105.3	172	177.9	0	0	0	0	107.7	K162 V166	K162-V164 PolarHBondContact O-N 2.89Å; V164-V166 HydrophobicContact CG1-CG2 4.31Å; V164-V166 PolarHBondContact O-N 3.14Å
165	I	64.4	Low	60.5	Low	59 Å²	59	117.1 Å²	117.1	30%	0.303	61%	0.607	S	S	.	*			trans	-80.6	100	-179.8	-44.6	173.7	0	0	0	108.7	P163 R167 E183 P185	P163-I165 PolarHBondContact O-N 3.36Å; I165-R167 HydrophobicContact CB-CG 4.48Å; I165-R167 HydrophobicContact CG2-CG 3.57Å; I165-R167 PolarHBondContact O-N 2.77Å; I165-E183 WeakPolarHBondContact CD1-O 3.49Å; I165-P185 HydrophobicContact CD1-CG 4.34Å; I165-P185 HydrophobicContact CG1-CG 4.46Å
166	V	68.1	Low	61.4	Low	98 Å²	98	114.9 Å²	114.9	59%	0.594	60%	0.602	S	S	*	*			trans	-82.6	94	168.6	-176.4	0	0	0	0	108.1	V164 S168	V164-V166 HydrophobicContact CG1-CG2 4.31Å; V164-V166 PolarHBondContact O-N 3.14Å; V166-S168 VanDerWaalsContact C-N 3.33Å; V166-S168 VanDerWaalsContact CG1-O 3.3Å; V166-S168 WeakPolarHBondContact CG1-O 3.44Å
167	R	64.7	Low	62.3	Low	101 Å²	101	112.2 Å²	112.2	38%	0.381	58%	0.584	S	S	.	*			trans	-79.8	-16.9	178.8	-58.3	-175	167.8	157.1	5.5	113.5	I165 V177 N179 N181	I165-R167 HydrophobicContact CB-CG 4.48Å; I165-R167 HydrophobicContact CG2-CG 3.57Å; I165-R167 PolarHBondContact O-N 2.77Å; R167-V177 HydrophobicContact CB-CG1 3.5Å; R167-V177 VanDerWaalsContact CB-CG1 3.5Å; R167-V177 WeakPolarHBondContact O-CG1 3.32Å; R167-N179 VanDerWaalsContact CB-OD1 3.25Å; R167-N179 WeakPolarHBondContact CB-OD1 3.19Å; R167-N179 WeakPolarHBondContact CG-OD1 3.47Å; R167-N181 PolarHBondContact NH1-O 2.63Å; R167-N181 PolarHBondContact NH2-O 3.14Å
168	S	65.7	Low	62.8	Low	38 Å²	38	113.8 Å²	113.8	27%	0.266	59%	0.586	S	S	.	*	S	Bend	trans	-143.8	135.4	179.4	58.6	0	0	0	0	110.6	V166	V166-S168 VanDerWaalsContact C-N 3.33Å; V166-S168 VanDerWaalsContact CG1-O 3.3Å; V166-S168 WeakPolarHBondContact CG1-O 3.44Å
169	H	68.2	Low	63.2	Low	147 Å²	147	114.8 Å²	114.8	68%	0.681	59%	0.589	S	S	*	*			trans	-70.8	155.4	166.9	-80	-72.6	0	0	0	110.6	E171 C172	H169-E171 PolarHBondContact O-N 2.8Å; H169-E171 VanDerWaalsContact O-N 3.09Å; H169-C172 WeakPolarHBondContact O-CB 3.33Å; H169-C172 PolarHBondContact O-N 2.91Å
170	P	69.5	Low	63.5	Low	125 Å²	125	113.6 Å²	113.6	81%	0.812	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.1	-28.7	178.9	18.4	-30.3	0	0	0	113.6	C172	P170-C172 VanDerWaalsContact C-N 3.27Å; P170-C172 PolarHBondContact O-N 3.09Å
171	E	71.6	Confident	63.7	Low	167 Å²	167	113.4 Å²	113.4	78%	0.78	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-1.4	177.1	-53.4	-58.2	143.3	0	0	114.4	H169 K173	H169-E171 PolarHBondContact O-N 2.8Å; H169-E171 VanDerWaalsContact O-N 3.09Å; E171-K173 PolarHBondContact O-N 3.49Å
172	C	69.2	Low	63.8	Low	58 Å²	58	115.1 Å²	115.1	39%	0.392	59%	0.591	S	S	.	*			trans	-79.5	106.3	-171	-163.2	0	0	0	0	111.6	H169 P170 R174	H169-C172 WeakPolarHBondContact O-CB 3.33Å; H169-C172 PolarHBondContact O-N 2.91Å; P170-C172 VanDerWaalsContact C-N 3.27Å; P170-C172 PolarHBondContact O-N 3.09Å; C172-R174 PolarHBondContact O-N 2.84Å; C172-R174 VanDerWaalsContact O-N 3.1Å
173	K	69.2	Low	64	Low	204 Å²	204	113.1 Å²	113.1	89%	0.887	58%	0.584	S	S	*	*			trans	-72.5	7.2	176.6	-59.2	-175.6	-179.5	-178.3	0	114.8	E171 T175	E171-K173 PolarHBondContact O-N 3.49Å; K173-T175 PolarHBondContact O-N 3.01Å
174	R	64.7	Low	64.4	Low	155 Å²	155	112.3 Å²	112.3	59%	0.585	58%	0.577	S	S	*	*			trans	-84.7	106.9	-179.2	-101.5	178.8	74.8	177.8	-0.1	110.2	C172 D176 V177	C172-R174 PolarHBondContact O-N 2.84Å; C172-R174 VanDerWaalsContact O-N 3.1Å; R174-D176 WeakPolarHBondContact CB-OD1 3.42Å; R174-D176 WeakPolarHBondContact CG-OD1 3.18Å; R174-D176 IonicContact CZ-OD1 3.74Å; R174-D176 IonicContact CZ-OD2 3.52Å; R174-D176 VanDerWaalsContact CZ-OD2 3.22Å; R174-D176 VanDerWaalsContact NE-CG 3.34Å; R174-D176 IonicContact NE-OD1 3.32Å; R174-D176 PolarHBondContact NE-OD1 3.22Å; R174-D176 IonicContact NE-OD2 3.49Å; R174-D176 PolarHBondContact NE-OD2 2.94Å; R174-D176 IonicContact NH2-OD1 2.78Å; R174-D176 IonicContact NH2-OD2 2.57Å; R174-D176 PolarHBondContact NH2-OD2 3.22Å; R174-D176 PolarHBondContact O-N 3Å; R174-V177 HydrophobicContact CB-CG2 4.18Å
175	T	64.3	Low	64.7	Low	123 Å²	123	109.9 Å²	109.9	76%	0.755	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	-11.4	177.5	51.6	0	0	0	0	113.5	K173 V177	K173-T175 PolarHBondContact O-N 3.01Å; T175-V177 VanDerWaalsContact C-N 3.33Å
176	D	63.6	Low	65.3	Low	101 Å²	101	111.6 Å²	111.6	54%	0.54	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.1	-12.9	179.6	66	-59.2	0	0	0	113.4	R174 K178	R174-D176 WeakPolarHBondContact CB-OD1 3.42Å; R174-D176 WeakPolarHBondContact CG-OD1 3.18Å; R174-D176 IonicContact CZ-OD1 3.74Å; R174-D176 IonicContact CZ-OD2 3.52Å; R174-D176 VanDerWaalsContact CZ-OD2 3.22Å; R174-D176 VanDerWaalsContact NE-CG 3.34Å; R174-D176 IonicContact NE-OD1 3.32Å; R174-D176 PolarHBondContact NE-OD1 3.22Å; R174-D176 IonicContact NE-OD2 3.49Å; R174-D176 PolarHBondContact NE-OD2 2.94Å; R174-D176 IonicContact NH2-OD1 2.78Å; R174-D176 IonicContact NH2-OD2 2.57Å; R174-D176 PolarHBondContact NH2-OD2 3.22Å; R174-D176 PolarHBondContact O-N 3Å; D176-K178 PolarHBondContact O-N 3.14Å
177	V	58.9	Low	66.1	Low	32 Å²	32	111.9 Å²	111.9	19%	0.194	57%	0.566	C	S	.	*			trans	-99.7	55	179.9	-165.5	0	0	0	0	110.2	R167 R174 T175	R167-V177 HydrophobicContact CB-CG1 3.5Å; R167-V177 VanDerWaalsContact CB-CG1 3.5Å; R167-V177 WeakPolarHBondContact O-CG1 3.32Å; R174-V177 HydrophobicContact CB-CG2 4.18Å; T175-V177 VanDerWaalsContact C-N 3.33Å
178	K	58	Low	67.2	Low	158 Å²	158	110 Å²	110	69%	0.687	56%	0.563	S	S	*	*			trans	-72	132.3	166.8	-65.7	-175.5	-178.7	-178.2	0	108.3	D176 T180	D176-K178 PolarHBondContact O-N 3.14Å; K178-T180 WeakPolarHBondContact CB-OG1 3.12Å; K178-T180 PolarHBondContact O-N 3.2Å
179	N	57	Low	68.4	Low	88 Å²	88	110.2 Å²	110.2	47%	0.471	56%	0.559	S	S	.	*			trans	-70.2	44.1	175.9	-73.3	-32.1	0	0	0	112.4	R167	R167-N179 VanDerWaalsContact CB-OD1 3.25Å; R167-N179 WeakPolarHBondContact CB-OD1 3.19Å; R167-N179 WeakPolarHBondContact CG-OD1 3.47Å
180	T	59.2	Low	69.4	Low	107 Å²	107	106.3 Å²	106.3	66%	0.656	54%	0.538	S	S	*	.			trans	-80.3	-26.4	-170.5	-57.8	0	0	0	0	112.8	K178	K178-T180 WeakPolarHBondContact CB-OG1 3.12Å; K178-T180 PolarHBondContact O-N 3.2Å
181	N	56.6	Low	70.3	Confident	119 Å²	119	100.6 Å²	100.6	64%	0.636	50%	0.501	S	S	*	.			trans	-101.9	102.8	176.1	-81.2	-36.1	0	0	0	110.9	R167 E183	R167-N181 PolarHBondContact NH1-O 2.63Å; R167-N181 PolarHBondContact NH2-O 3.14Å; N181-E183 PolarHBondContact O-N 3Å; N181-E183 VanDerWaalsContact O-N 3.14Å
182	Q	60.2	Low	71.1	Confident	180 Å²	180	96.6 Å²	96.6	84%	0.841	48%	0.481	S	S	*	.			trans	-76.8	19.1	177.6	-61.7	-176.4	6.4	0	0	113.9	T184	Q182-T184 PolarHBondContact O-N 3.41Å
183	E	64.5	Low	72	Confident	106 Å²	106	101.6 Å²	101.6	50%	0.495	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-60.6	125	177.2	-167.5	177.1	176.7	0	0	109.6	I165 N181 H268	I165-E183 WeakPolarHBondContact CD1-O 3.49Å; N181-E183 PolarHBondContact O-N 3Å; N181-E183 VanDerWaalsContact O-N 3.14Å; E183-H268 IonicContact OE1-CE1 3.61Å; E183-H268 IonicContact OE1-NE2 3.28Å; E183-H268 PolarHBondContact OE1-NE2 2.87Å
184	T	68.5	Low	72.7	Confident	58 Å²	58	95.3 Å²	95.3	36%	0.356	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-62.4	134.1	177.8	45.3	0	0	0	0	109.1	K162 Q182 H186	K162-T184 HydrophobicContact CG-CG2 4.28Å; Q182-T184 PolarHBondContact O-N 3.41Å; T184-H186 PolarHBondContact O-CD2 3.14Å; T184-H186 PolarHBondContact O-N 2.94Å
185	P	72.9	Confident	73.7	Confident	84 Å²	84	89.9 Å²	89.9	55%	0.545	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-66	127.6	-178.9	29.4	-32	0	0	0	109	P163 I165	P163-P185 HydrophobicContact CG-CG 3.83Å; I165-P185 HydrophobicContact CD1-CG 4.34Å; I165-P185 HydrophobicContact CG1-CG 4.46Å
186	H	77.5	Confident	74.6	Confident	94 Å²	94	91.3 Å²	91.3	44%	0.435	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-91.1	128.7	174.5	-71.6	-90.1	0	0	0	109.7	T184 L188 H268	T184-H186 PolarHBondContact O-CD2 3.14Å; T184-H186 PolarHBondContact O-N 2.94Å; H186-L188 PolarHBondContact O-N 2.96Å; H186-H268 HydrophobicContact CB-CB 4.5Å; H186-H268 AromaticContact CD2-CD2 3.61Å; H186-H268 AromaticContact CG-CD2 3.8Å
187	Q	84.9	Confident	75.7	Confident	105 Å²	105	92.6 Å²	92.6	49%	0.491	46%	0.461	S	S	.	.			trans	-76.4	113.3	173	-170.7	-175.1	-18.3	0	0	109	W190	Q187-W190 HydrophobicContact CG-CB 4.13Å
188	L	87.2	Confident	76.9	Confident	61 Å²	61	95.5 Å²	95.5	32%	0.319	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	146.8	172.1	-60.9	179.6	0	0	0	111	H186 W190 H268	H186-L188 PolarHBondContact O-N 2.96Å; L188-W190 PolarHBondContact O-N 3.1Å; L188-H268 HydrophobicContact CD2-CB 3.78Å
189	F	90.7	Very high	78.2	Confident	42 Å²	42	91 Å²	91	18%	0.184	47%	0.471	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	26.1	173.6	-35.1	-69.6	0	0	0	115.8	E191 K192 V222 Y225 P262 I266 M272	F189-E191 WeakPolarHBondContact CA-OE2 3.25Å; F189-E191 PolarHBondContact O-N 3.25Å; F189-K192 HydrophobicContact CB-CD 4.16Å; F189-K192 HydrophobicContact CB-CG 4.35Å; F189-K192 WeakPolarHBondContact O-CB 3.44Å; F189-K192 PolarHBondContact O-N 2.57Å; F189-K192 VanDerWaalsContact O-N 3.13Å; F189-V222 HydrophobicContact CD1-CG1 4.06Å; F189-V222 HydrophobicContact CE1-CG1 3.84Å; F189-V222 HydrophobicContact CE1-CG2 4.39Å; F189-Y225 WeakPolarHBondContact CA-OH 3.4Å; F189-Y225 HydrophobicContact CD1-CE2 4.1Å; F189-P262 HydrophobicContact CE1-CB 4.3Å; F189-P262 HydrophobicContact CZ-CB 3.9Å; F189-P262 HydrophobicContact CZ-CG 4.48Å; F189-I266 HydrophobicContact CE1-CD1 3.4Å; F189-I266 VanDerWaalsContact CE1-CD1 3.4Å; F189-I266 HydrophobicContact CZ-CD1 3.7Å; F189-M272 HydrophobicContact CE1-SD 4.43Å
190	W	88.7	Confident	79.8	Confident	65 Å²	65	91.5 Å²	91.5	25%	0.246	47%	0.473	C	S	.	.	G	3₁₀ helix	trans	-60.6	-27	178.4	64.3	-90.9	0	0	0	111.9	Q187 L188 K192 R193 L194 H232 H236	Q187-W190 HydrophobicContact CG-CB 4.13Å; L188-W190 PolarHBondContact O-N 3.1Å; W190-K192 PolarHBondContact O-N 2.81Å; W190-R193 VanDerWaalsContact O-CB 3.24Å; W190-R193 WeakPolarHBondContact O-CB 3.37Å; W190-R193 PolarHBondContact O-N 3.22Å; W190-L194 HydrophobicContact CE3-CD1 4.3Å; W190-L194 HydrophobicContact CZ3-CD1 3.83Å; W190-H232 HydrophobicContact CH2-CB 4.12Å; W190-H236 HydrophobicContact CH2-CB 4.23Å; W190-H236 HydrophobicContact CZ2-CB 3.61Å; W190-H236 AromaticContact CZ2-CG 3.72Å
191	E	89.1	Confident	81.3	Confident	6 Å²	6	88.4 Å²	88.4	3%	0.028	45%	0.452	C	S	.	.	G	3₁₀ helix	trans	-60.5	-29.8	178.1	-56.6	90.5	151.2	0	0	112.1	F189 R193 L194 Y225 Q229 H232 S233	F189-E191 WeakPolarHBondContact CA-OE2 3.25Å; F189-E191 PolarHBondContact O-N 3.25Å; E191-R193 VanDerWaalsContact C-N 3.25Å; E191-R193 PolarHBondContact O-N 3.12Å; E191-L194 PolarHBondContact O-N 3.29Å; E191-Y225 HydrophobicContact CB-CE1 4.04Å; E191-Y225 PolarHBondContact OE2-OH 2.78Å; E191-Q229 HydrophobicContact CB-CB 3.97Å; E191-Q229 HydrophobicContact CB-CG 4.35Å; E191-Q229 WeakPolarHBondContact O-CG 3.37Å; E191-H232 HydrophobicContact CG-CB 4.15Å; E191-S233 WeakPolarHBondContact OE1-CA 3.44Å; E191-S233 WeakPolarHBondContact OE1-CB 3.28Å; E191-S233 PolarHBondContact OE1-OG 2.98Å
192	K	88.9	Confident	82.9	Confident	82 Å²	82	87.7 Å²	87.7	36%	0.357	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-64.5	-29.7	175.5	-68.8	-172.4	169.7	-174.5	0	112.6	F189 W190 L194 A195 P223 Y225	F189-K192 HydrophobicContact CB-CD 4.16Å; F189-K192 HydrophobicContact CB-CG 4.35Å; F189-K192 WeakPolarHBondContact O-CB 3.44Å; F189-K192 PolarHBondContact O-N 2.57Å; F189-K192 VanDerWaalsContact O-N 3.13Å; W190-K192 PolarHBondContact O-N 2.81Å; K192-L194 PolarHBondContact O-N 3.26Å; K192-A195 WeakPolarHBondContact O-CB 3.08Å; K192-A195 PolarHBondContact O-N 3.49Å; K192-A195 VanDerWaalsContact O-N 3.13Å; K192-P223 WeakPolarHBondContact CE-O 3.43Å; K192-P223 PolarHBondContact NZ-O 2.91Å; K192-Y225 HydrophobicContact CD-CE2 4.29Å; K192-Y225 VanDerWaalsContact CE-CE2 3.48Å; K192-Y225 HydrophobicContact CG-CE2 4.03Å
193	R	88.2	Confident	84.5	Confident	164 Å²	164	86.3 Å²	86.3	62%	0.619	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-64.4	-26.5	177.4	-169.9	-174.6	-70.8	143.7	-6.3	111.8	W190 E191 H197	W190-R193 VanDerWaalsContact O-CB 3.24Å; W190-R193 WeakPolarHBondContact O-CB 3.37Å; W190-R193 PolarHBondContact O-N 3.22Å; E191-R193 VanDerWaalsContact C-N 3.25Å; E191-R193 PolarHBondContact O-N 3.12Å; R193-H197 PolarHBondContact O-ND1 2.85Å
194	L	83.8	Confident	85.8	Confident	71 Å²	71	85.2 Å²	85.2	37%	0.372	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-94.1	6.8	179.1	-58.6	180	0	0	0	112.9	W190 E191 K192 D196 H197	W190-L194 HydrophobicContact CE3-CD1 4.3Å; W190-L194 HydrophobicContact CZ3-CD1 3.83Å; E191-L194 PolarHBondContact O-N 3.29Å; K192-L194 PolarHBondContact O-N 3.26Å; L194-D196 VanDerWaalsContact C-N 3.29Å; L194-D196 PolarHBondContact O-N 3.17Å; L194-H197 PolarHBondContact O-N 3.01Å
195	A	84.6	Confident	86.8	Confident	41 Å²	41	85 Å²	85	34%	0.339	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-40.4	-173.6	0	0	0	0	0	113.7	K192 H197	K192-A195 WeakPolarHBondContact O-CB 3.08Å; K192-A195 PolarHBondContact O-N 3.49Å; K192-A195 VanDerWaalsContact O-N 3.13Å; A195-H197 VanDerWaalsContact C-N 3.33Å
196	D	84.4	Confident	87.7	Confident	154 Å²	154	87.8 Å²	87.8	82%	0.824	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	11.8	-175.1	-52.5	-40.5	0	0	0	112.6	L194	L194-D196 VanDerWaalsContact C-N 3.29Å; L194-D196 PolarHBondContact O-N 3.17Å
197	H	85.1	Confident	88.1	Confident	128 Å²	128	87.3 Å²	87.3	59%	0.593	48%	0.475	S	S	*	.			trans	-111.5	132.6	-177.7	-62.1	80	0	0	0	110.1	R193 L194 A195	R193-H197 PolarHBondContact O-ND1 2.85Å; L194-H197 PolarHBondContact O-N 3.01Å; A195-H197 VanDerWaalsContact C-N 3.33Å
198	V	85.5	Confident	88.1	Confident	92 Å²	92	88 Å²	88	56%	0.558	48%	0.477	S	S	*	.			trans	-125.6	142.7	175.9	-173.6	0	0	0	0	108.4
199	A	85.4	Confident	88	Confident	63 Å²	63	94.1 Å²	94.1	52%	0.521	50%	0.501	S	S	.	.			trans	-68.8	137.4	172.8	0	0	0	0	0	109.5	F208	A199-F208 HydrophobicContact CB-CB 4.35Å; A199-F208 HydrophobicContact CB-CD2 3.7Å; A199-F208 HydrophobicContact CB-CE2 4.5Å; A199-F208 HydrophobicContact CB-CG 4.39Å; A199-F208 WeakPolarHBondContact O-CD2 3.47Å; A199-F208 PolarHBondContact O-N 2.91Å
200	I	90.5	Very high	87.4	Confident	100 Å²	100	96.8 Å²	96.8	51%	0.513	52%	0.522	S	S	.	.	B	Isolated β-bridge	trans	-120.8	137.9	177.3	-62.6	172	0	0	0	108	G205 E206	I200-G205 VanDerWaalsContact CG2-C 3.45Å; I200-G205 WeakPolarHBondContact CG2-O 3.22Å; I200-E206 WeakPolarHBondContact CA-O 3.35Å
201	D	90.6	Very high	87.2	Confident	41 Å²	41	99.1 Å²	99.1	22%	0.219	54%	0.538	C	S	.	.			trans	-70.2	122.2	171.5	176.8	1.7	0	0	0	109.5	D203 T204 G205 E206 F208	D201-D203 PolarHBondContact O-N 3.13Å; D201-D203 PolarHBondContact OD1-N 3.18Å; D201-T204 VanDerWaalsContact CB-OG1 3.24Å; D201-T204 WeakPolarHBondContact CB-OG1 3.43Å; D201-T204 WeakPolarHBondContact OD2-CG2 3.49Å; D201-T204 PolarHBondContact OD2-OG1 2.99Å; D201-G205 VanDerWaalsContact O-CA 3.27Å; D201-G205 WeakPolarHBondContact O-CA 3.36Å; D201-G205 PolarHBondContact O-N 3.08Å; D201-E206 PolarHBondContact N-O 3.2Å; D201-F208 HydrophobicContact CB-CE2 3.94Å; D201-F208 HydrophobicContact CB-CZ 4Å
202	P	90.2	Very high	87	Confident	104 Å²	104	103.8 Å²	103.8	68%	0.675	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	-26.2	-178.7	27.7	-36.7	0	0	0	114
203	D	92.7	Very high	86.8	Confident	151 Å²	151	101.6 Å²	101.6	81%	0.807	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-38.3	-174.5	-63.8	-37.1	0	0	0	111.8	D201	D201-D203 PolarHBondContact O-N 3.13Å; D201-D203 PolarHBondContact OD1-N 3.18Å
204	T	92	Very high	86.7	Confident	84 Å²	84	97.8 Å²	97.8	52%	0.515	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.1	-21	-177	61.4	0	0	0	0	113.4	D201 E206	D201-T204 VanDerWaalsContact CB-OG1 3.24Å; D201-T204 WeakPolarHBondContact CB-OG1 3.43Å; D201-T204 WeakPolarHBondContact OD2-CG2 3.49Å; D201-T204 PolarHBondContact OD2-OG1 2.99Å; T204-E206 PolarHBondContact O-N 3.24Å; T204-E206 PolarHBondContact OG1-N 3.17Å
205	G	90	Very high	86.7	Confident	54 Å²	54	104.1 Å²	104.1	56%	0.557	59%	0.585	S	S	*	*			trans	71	5.1	-172.1	0	0	0	0	0	113.7	I200 D201	I200-G205 VanDerWaalsContact CG2-C 3.45Å; I200-G205 WeakPolarHBondContact CG2-O 3.22Å; D201-G205 VanDerWaalsContact O-CA 3.27Å; D201-G205 WeakPolarHBondContact O-CA 3.36Å; D201-G205 PolarHBondContact O-N 3.08Å
206	E	90.7	Very high	86.8	Confident	142 Å²	142	104.5 Å²	104.5	66%	0.664	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-80.8	141.2	-179.3	-64.9	-170.1	166.6	0	0	111.4	I200 D201 T204	I200-E206 WeakPolarHBondContact CA-O 3.35Å; D201-E206 PolarHBondContact N-O 3.2Å; T204-E206 PolarHBondContact O-N 3.24Å; T204-E206 PolarHBondContact OG1-N 3.17Å
207	S	87.4	Confident	87	Confident	83 Å²	83	98.7 Å²	98.7	58%	0.58	56%	0.562	S	S	*	*	B	Isolated β-bridge	trans	-73.1	132.5	174.5	60.6	0	0	0	0	110.4	K209	S207-K209 PolarHBondContact O-N 3.05Å
208	F	84.6	Confident	87.3	Confident	120 Å²	120	98 Å²	98	53%	0.526	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-63	134.8	172.2	-75.4	-83.7	0	0	0	110.6	A199 D201	A199-F208 HydrophobicContact CB-CB 4.35Å; A199-F208 HydrophobicContact CB-CD2 3.7Å; A199-F208 HydrophobicContact CB-CE2 4.5Å; A199-F208 HydrophobicContact CB-CG 4.39Å; A199-F208 WeakPolarHBondContact O-CD2 3.47Å; A199-F208 PolarHBondContact O-N 2.91Å; D201-F208 HydrophobicContact CB-CE2 3.94Å; D201-F208 HydrophobicContact CB-CZ 4Å
209	K	84	Confident	87.6	Confident	190 Å²	190	95.4 Å²	95.4	83%	0.826	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-61.1	127.6	175.8	-174.4	175.1	-179.7	172.7	0	109.7	S207 I211	S207-K209 PolarHBondContact O-N 3.05Å; K209-I211 PolarHBondContact O-N 3.12Å
210	P	80	Confident	88	Confident	97 Å²	97	92.4 Å²	92.4	63%	0.63	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-62.2	140.3	179.8	24.8	-33.6	0	0	0	110.7	S212	P210-S212 PolarHBondContact O-N 3.26Å
211	I	83.9	Confident	87.9	Confident	114 Å²	114	88.8 Å²	88.8	59%	0.585	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-66.7	120.8	175.7	-61.3	172.1	0	0	0	108.2	K209 V231	K209-I211 PolarHBondContact O-N 3.12Å; I211-V231 HydrophobicContact CB-CG1 4.36Å; I211-V231 HydrophobicContact CB-CG2 4.38Å; I211-V231 HydrophobicContact CD1-CG1 4.33Å; I211-V231 HydrophobicContact CG2-CG1 4.45Å; I211-V231 HydrophobicContact CG2-CG2 4.26Å
212	S	84.1	Confident	87.7	Confident	105 Å²	105	87 Å²	87	73%	0.734	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-80.3	128.8	174.1	59.2	0	0	0	0	110.1	P210	P210-S212 PolarHBondContact O-N 3.26Å
213	L	85.4	Confident	87.5	Confident	35 Å²	35	85.3 Å²	85.3	18%	0.183	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-70.9	144.1	170.8	-77.2	167	0	0	0	111.4	I217 L230 V231	L213-I217 HydrophobicContact CD1-CG2 4.16Å; L213-I217 HydrophobicContact CD2-CB 4.48Å; L213-I217 HydrophobicContact CD2-CD1 4.37Å; L213-I217 HydrophobicContact CD2-CG2 4.1Å; L213-L230 HydrophobicContact CD1-CB 3.41Å; L213-L230 VanDerWaalsContact CD1-CB 3.41Å; L213-L230 HydrophobicContact CD1-CD1 3.96Å; L213-L230 HydrophobicContact CD1-CG 4.35Å; L213-V231 HydrophobicContact CD1-CG2 4.05Å; L213-V231 HydrophobicContact CD2-CG2 3.64Å; L213-V231 HydrophobicContact CG-CG2 3.55Å
214	P	85.6	Confident	87.1	Confident	84 Å²	84	80.7 Å²	80.7	55%	0.545	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-51.7	142.8	166	-24.7	32.2	0	0	0	111.4	G216 I217	P214-G216 PolarHBondContact O-N 2.91Å; P214-I217 HydrophobicContact CG-CD1 4.19Å; P214-I217 PolarHBondContact O-N 3.32Å
215	K	83.9	Confident	87	Confident	205 Å²	205	77.6 Å²	77.6	89%	0.891	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-24.4	-176.7	-64	-177.4	179.3	-178.4	0	114.5
216	G	85.9	Confident	86.9	Confident	49 Å²	49	80.7 Å²	80.7	51%	0.505	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-18.4	177.8	0	0	0	0	0	114.5	P214	P214-G216 PolarHBondContact O-N 2.91Å
217	I	90.1	Very high	86.8	Confident	32 Å²	32	77.2 Å²	77.2	16%	0.164	44%	0.443	C	S	.	.			trans	-93.4	113.7	179.5	-64.7	171.6	0	0	0	108.6	L213 P214 L234 I273 F276	L213-I217 HydrophobicContact CD1-CG2 4.16Å; L213-I217 HydrophobicContact CD2-CB 4.48Å; L213-I217 HydrophobicContact CD2-CD1 4.37Å; L213-I217 HydrophobicContact CD2-CG2 4.1Å; P214-I217 HydrophobicContact CG-CD1 4.19Å; P214-I217 PolarHBondContact O-N 3.32Å; I217-L234 HydrophobicContact CD1-CD2 4.46Å; I217-I273 HydrophobicContact CG2-CB 4.08Å; I217-I273 HydrophobicContact CG2-CD1 4.08Å; I217-I273 HydrophobicContact CG2-CG2 3.62Å; I217-F276 HydrophobicContact CG1-CD2 4.1Å; I217-F276 HydrophobicContact CG1-CE2 4.29Å; I217-F276 HydrophobicContact CG1-CG 4.42Å
218	Q	91.1	Very high	86.8	Confident	112 Å²	112	75 Å²	75	52%	0.523	43%	0.43	S	S	.	.			trans	-119.4	156.4	-175.8	-63.1	-179.2	-10.9	0	0	110.9	I273 K274	Q218-I273 CarbonylContact O-C 3.52Å; Q218-I273 VanDerWaalsContact O-CA 3.25Å; Q218-I273 WeakPolarHBondContact O-CA 3.08Å; Q218-I273 WeakPolarHBondContact O-CB 3.46Å; Q218-K274 PolarHBondContact O-N 2.98Å
219	S	92.5	Very high	87.1	Confident	38 Å²	38	69.7 Å²	69.7	27%	0.266	41%	0.407	S	S	.	.	B	Isolated β-bridge	trans	-59.1	144.5	173.1	178.9	0	0	0	0	111	G221	S219-G221 PolarHBondContact O-N 3.01Å; S219-G221 VanDerWaalsContact O-N 3.17Å; S219-G221 PolarHBondContact OG-N 3.47Å
220	A	92.2	Very high	87.5	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.008	37%	0.37	C	S	.	.			trans	-66.8	-7.6	173.2	0	0	0	0	0	113.8	Q251 P255 I258 M272	A220-Q251 HydrophobicContact CB-CB 3.7Å; A220-Q251 HydrophobicContact CB-CG 3.53Å; A220-P255 VanDerWaalsContact O-CA 3.32Å; A220-P255 WeakPolarHBondContact O-CA 3.32Å; A220-I258 HydrophobicContact CB-CD1 3.99Å; A220-I258 WeakPolarHBondContact O-CD1 3.33Å; A220-M272 WeakPolarHBondContact CB-O 3.19Å; A220-M272 PolarHBondContact N-O 3.33Å
221	G	88.7	Confident	88	Confident	23 Å²	23	57 Å²	57	24%	0.237	34%	0.344	C	S	.	.	S	Bend	trans	103.4	7.9	-176.9	0	0	0	0	0	114.2	S219 P223	S219-G221 PolarHBondContact O-N 3.01Å; S219-G221 VanDerWaalsContact O-N 3.17Å; S219-G221 PolarHBondContact OG-N 3.47Å; G221-P223 WeakPolarHBondContact O-CD 3.43Å
222	V	87.8	Confident	88.2	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.024	33%	0.33	C	S	.	.			trans	-72	123.3	173	-172.9	0	0	0	0	109.3	F189 Y225 I258 P262 I266 M272	F189-V222 HydrophobicContact CD1-CG1 4.06Å; F189-V222 HydrophobicContact CE1-CG1 3.84Å; F189-V222 HydrophobicContact CE1-CG2 4.39Å; V222-Y225 HydrophobicContact CB-CD2 3.73Å; V222-Y225 HydrophobicContact CB-CE2 3.94Å; V222-Y225 HydrophobicContact CG1-CD2 3.74Å; V222-Y225 HydrophobicContact CG1-CE2 3.62Å; V222-I258 HydrophobicContact CG2-CG2 3.52Å; V222-P262 HydrophobicContact CG1-CB 4.48Å; V222-I266 HydrophobicContact CG2-CD1 3.54Å; V222-M272 HydrophobicContact CG2-SD 4.26Å
223	P	85.2	Confident	88.6	Confident	68 Å²	68	49.9 Å²	49.9	44%	0.442	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	139.4	-179.1	-26	34.9	0	0	0	112.7	K192 G221 E259	K192-P223 WeakPolarHBondContact CE-O 3.43Å; K192-P223 PolarHBondContact NZ-O 2.91Å; G221-P223 WeakPolarHBondContact O-CD 3.43Å; P223-E259 HydrophobicContact CG-CG 4.31Å
224	G	84.9	Confident	88.8	Confident	55 Å²	55	49.9 Å²	49.9	57%	0.567	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.5	7.1	172.9	0	0	0	0	0	116.4
225	Y	89.1	Confident	89	Confident	19 Å²	19	49.9 Å²	49.9	8%	0.075	29%	0.291	C	S	.	.			trans	-82.7	121.9	171.5	-88.7	-99.9	0	0	0	111.3	F189 E191 K192 V222 Q229 L230 M272	F189-Y225 WeakPolarHBondContact CA-OH 3.4Å; F189-Y225 HydrophobicContact CD1-CE2 4.1Å; E191-Y225 HydrophobicContact CB-CE1 4.04Å; E191-Y225 PolarHBondContact OE2-OH 2.78Å; K192-Y225 HydrophobicContact CD-CE2 4.29Å; K192-Y225 VanDerWaalsContact CE-CE2 3.48Å; K192-Y225 HydrophobicContact CG-CE2 4.03Å; V222-Y225 HydrophobicContact CB-CD2 3.73Å; V222-Y225 HydrophobicContact CB-CE2 3.94Å; V222-Y225 HydrophobicContact CG1-CD2 3.74Å; V222-Y225 HydrophobicContact CG1-CE2 3.62Å; Y225-Q229 HydrophobicContact CD1-CB 3.56Å; Y225-Q229 HydrophobicContact CE1-CB 3.87Å; Y225-Q229 HydrophobicContact CG-CB 4.46Å; Y225-L230 HydrophobicContact CD1-CD2 3.75Å; Y225-L230 HydrophobicContact CD1-CG 4.36Å; Y225-L230 HydrophobicContact CG-CD2 4.24Å; Y225-M272 HydrophobicContact CD1-CB 4.22Å; Y225-M272 HydrophobicContact CE1-CB 3.83Å; Y225-M272 HydrophobicContact CE1-CG 3.86Å; Y225-M272 HydrophobicContact CE2-CG 4.43Å
226	Q	87.8	Confident	89.2	Confident	118 Å²	118	44.4 Å²	44.4	55%	0.551	27%	0.268	S	S	*	.			trans	-97	168.9	168.8	-52.1	-66.5	-19.1	0	0	109.9	A228 Q229 L230	Q226-A228 PolarHBondContact O-N 3.37Å; Q226-A228 VanDerWaalsContact O-N 3.14Å; Q226-Q229 VanDerWaalsContact C-OE1 3.26Å; Q226-Q229 VanDerWaalsContact CA-OE1 3.25Å; Q226-Q229 VanDerWaalsContact N-OE1 3.08Å; Q226-Q229 PolarHBondContact O-N 2.86Å; Q226-Q229 VanDerWaalsContact O-N 3.17Å; Q226-Q229 PolarHBondContact O-OE1 3Å; Q226-L230 PolarHBondContact O-N 3.1Å
227	P	88.6	Confident	89.4	Confident	69 Å²	69	42.4 Å²	42.4	45%	0.448	25%	0.247	S	C	.	.	H	α-helix	trans	-54.4	-34.7	-178.5	-29.5	37.1	0	0	0	114.2	L230 V231	P227-L230 PolarHBondContact O-N 3.44Å; P227-V231 WeakPolarHBondContact O-CG2 3.3Å; P227-V231 PolarHBondContact O-N 2.93Å
228	A	88	Confident	89.3	Confident	37 Å²	37	45.7 Å²	45.7	31%	0.306	26%	0.264	S	S	.	.	H	α-helix	trans	-63.7	-43.7	179.1	0	0	0	0	0	112.9	Q226 L230 V231 H232	Q226-A228 PolarHBondContact O-N 3.37Å; Q226-A228 VanDerWaalsContact O-N 3.14Å; A228-L230 VanDerWaalsContact C-N 3.32Å; A228-L230 PolarHBondContact O-N 2.67Å; A228-V231 WeakPolarHBondContact O-CB 3.32Å; A228-V231 PolarHBondContact O-N 2.99Å; A228-H232 PolarHBondContact O-N 2.7Å
229	Q	90.4	Very high	89	Confident	8 Å²	8	44.9 Å²	44.9	4%	0.037	27%	0.271	C	S	.	.	H	α-helix	trans	-67.7	-35.9	178.4	-64.6	83.7	-13.6	0	0	111	E191 Y225 Q226 V231 H232 S233	E191-Q229 HydrophobicContact CB-CB 3.97Å; E191-Q229 HydrophobicContact CB-CG 4.35Å; E191-Q229 WeakPolarHBondContact O-CG 3.37Å; Y225-Q229 HydrophobicContact CD1-CB 3.56Å; Y225-Q229 HydrophobicContact CE1-CB 3.87Å; Y225-Q229 HydrophobicContact CG-CB 4.46Å; Q226-Q229 VanDerWaalsContact C-OE1 3.26Å; Q226-Q229 VanDerWaalsContact CA-OE1 3.25Å; Q226-Q229 VanDerWaalsContact N-OE1 3.08Å; Q226-Q229 PolarHBondContact O-N 2.86Å; Q226-Q229 VanDerWaalsContact O-N 3.17Å; Q226-Q229 PolarHBondContact O-OE1 3Å; Q229-V231 VanDerWaalsContact C-N 3.33Å; Q229-H232 PolarHBondContact O-N 2.95Å; Q229-S233 WeakPolarHBondContact O-CB 3.31Å; Q229-S233 PolarHBondContact O-N 3.36Å
230	L	91.8	Very high	88.5	Confident	10 Å²	10	44.3 Å²	44.3	5%	0.052	27%	0.267	C	S	.	.	H	α-helix	trans	-63.8	-40.3	173.7	-64.3	179.5	0	0	0	111.3	L213 Y225 Q226 P227 A228 S233 L234 M272 I273	L213-L230 HydrophobicContact CD1-CB 3.41Å; L213-L230 VanDerWaalsContact CD1-CB 3.41Å; L213-L230 HydrophobicContact CD1-CD1 3.96Å; L213-L230 HydrophobicContact CD1-CG 4.35Å; Y225-L230 HydrophobicContact CD1-CD2 3.75Å; Y225-L230 HydrophobicContact CD1-CG 4.36Å; Y225-L230 HydrophobicContact CG-CD2 4.24Å; Q226-L230 PolarHBondContact O-N 3.1Å; P227-L230 PolarHBondContact O-N 3.44Å; A228-L230 VanDerWaalsContact C-N 3.32Å; A228-L230 PolarHBondContact O-N 2.67Å; L230-S233 PolarHBondContact O-N 3.03Å; L230-L234 WeakPolarHBondContact O-CB 3.41Å; L230-L234 PolarHBondContact O-N 2.86Å; L230-M272 HydrophobicContact CD2-CB 4.22Å; L230-M272 WeakPolarHBondContact CD2-O 3.25Å; L230-I273 HydrophobicContact CB-CG2 4.23Å; L230-I273 HydrophobicContact CD2-CG2 4.09Å
231	V	90.9	Very high	87.3	Confident	12 Å²	12	47.7 Å²	47.7	7%	0.073	29%	0.291	C	S	.	.	H	α-helix	trans	-60.7	-47.1	172.7	172.5	0	0	0	0	110.7	I211 L213 P227 A228 Q229 S233 L234 I235	I211-V231 HydrophobicContact CB-CG1 4.36Å; I211-V231 HydrophobicContact CB-CG2 4.38Å; I211-V231 HydrophobicContact CD1-CG1 4.33Å; I211-V231 HydrophobicContact CG2-CG1 4.45Å; I211-V231 HydrophobicContact CG2-CG2 4.26Å; L213-V231 HydrophobicContact CD1-CG2 4.05Å; L213-V231 HydrophobicContact CD2-CG2 3.64Å; L213-V231 HydrophobicContact CG-CG2 3.55Å; P227-V231 WeakPolarHBondContact O-CG2 3.3Å; P227-V231 PolarHBondContact O-N 2.93Å; A228-V231 WeakPolarHBondContact O-CB 3.32Å; A228-V231 PolarHBondContact O-N 2.99Å; Q229-V231 VanDerWaalsContact C-N 3.33Å; V231-S233 VanDerWaalsContact C-N 3.33Å; V231-S233 PolarHBondContact O-N 3.32Å; V231-L234 PolarHBondContact O-N 3.44Å; V231-I235 HydrophobicContact CG1-CD1 3.54Å; V231-I235 HydrophobicContact CG1-CG1 4.17Å; V231-I235 WeakPolarHBondContact O-CB 3.37Å; V231-I235 VanDerWaalsContact O-CG1 3.28Å; V231-I235 WeakPolarHBondContact O-CG1 3.43Å; V231-I235 PolarHBondContact O-N 3.44Å
232	H	89.5	Confident	86.2	Confident	65 Å²	65	47.9 Å²	47.9	30%	0.301	29%	0.289	S	S	.	.	H	α-helix	trans	-58.9	-44.6	177.4	-63.1	163	0	0	0	112.1	W190 E191 A228 Q229 I235 H236	W190-H232 HydrophobicContact CH2-CB 4.12Å; E191-H232 HydrophobicContact CG-CB 4.15Å; A228-H232 PolarHBondContact O-N 2.7Å; Q229-H232 PolarHBondContact O-N 2.95Å; H232-I235 PolarHBondContact O-N 2.94Å; H232-H236 WeakPolarHBondContact O-CB 3.44Å; H232-H236 PolarHBondContact O-N 3.27Å
233	S	90.6	Very high	85.1	Confident	4 Å²	4	49.8 Å²	49.8	3%	0.028	30%	0.302	C	S	.	.	H	α-helix	trans	-61.3	-44.7	177.3	-160.1	0	0	0	0	111.7	E191 Q229 L230 V231 H236 A237 M272	E191-S233 WeakPolarHBondContact OE1-CA 3.44Å; E191-S233 WeakPolarHBondContact OE1-CB 3.28Å; E191-S233 PolarHBondContact OE1-OG 2.98Å; Q229-S233 WeakPolarHBondContact O-CB 3.31Å; Q229-S233 PolarHBondContact O-N 3.36Å; L230-S233 PolarHBondContact O-N 3.03Å; V231-S233 VanDerWaalsContact C-N 3.33Å; V231-S233 PolarHBondContact O-N 3.32Å; S233-H236 PolarHBondContact O-N 3.13Å; S233-A237 WeakPolarHBondContact O-CB 3.25Å; S233-A237 PolarHBondContact O-N 3.43Å; S233-M272 PolarHBondContact OG-N 2.98Å; S233-M272 VanDerWaalsContact OG-N 3.1Å
234	L	90.6	Very high	84.5	Confident	34 Å²	34	55.3 Å²	55.3	18%	0.178	32%	0.319	C	S	.	.	H	α-helix	trans	-66.5	-45.9	178.7	-175.7	62.6	0	0	0	112	I217 L230 V231 H236 A237 L238 I248 P271 I273	I217-L234 HydrophobicContact CD1-CD2 4.46Å; L230-L234 WeakPolarHBondContact O-CB 3.41Å; L230-L234 PolarHBondContact O-N 2.86Å; V231-L234 PolarHBondContact O-N 3.44Å; L234-H236 VanDerWaalsContact C-N 3.31Å; L234-H236 PolarHBondContact O-N 3.41Å; L234-A237 PolarHBondContact O-N 3.18Å; L234-L238 HydrophobicContact CD1-CD1 4.36Å; L234-L238 HydrophobicContact CD1-CG 4.4Å; L234-L238 HydrophobicContact CG-CD1 4.1Å; L234-L238 WeakPolarHBondContact O-CB 3.16Å; L234-L238 VanDerWaalsContact O-CG 3.28Å; L234-L238 WeakPolarHBondContact O-CG 3.18Å; L234-L238 PolarHBondContact O-N 2.69Å; L234-I248 HydrophobicContact CD1-CG2 4.46Å; L234-P271 HydrophobicContact CD1-CB 4.38Å; L234-P271 HydrophobicContact CD1-CG 4.09Å; L234-I273 HydrophobicContact CD1-CD1 4.14Å
235	I	89.5	Confident	84	Confident	85 Å²	85	59.8 Å²	59.8	44%	0.436	33%	0.329	S	S	.	.	H	α-helix	trans	-60	-44.1	176.6	-69.9	171.4	0	0	0	110.3	V231 H232 L238 S239	V231-I235 HydrophobicContact CG1-CD1 3.54Å; V231-I235 HydrophobicContact CG1-CG1 4.17Å; V231-I235 WeakPolarHBondContact O-CB 3.37Å; V231-I235 VanDerWaalsContact O-CG1 3.28Å; V231-I235 WeakPolarHBondContact O-CG1 3.43Å; V231-I235 PolarHBondContact O-N 3.44Å; H232-I235 PolarHBondContact O-N 2.94Å; I235-L238 PolarHBondContact O-N 3.39Å; I235-S239 VanDerWaalsContact O-CB 3.25Å; I235-S239 WeakPolarHBondContact O-CB 3.36Å; I235-S239 PolarHBondContact O-N 3.45Å; I235-S239 PolarHBondContact O-OG 3.48Å
236	H	88.3	Confident	83.7	Confident	89 Å²	89	60.3 Å²	60.3	41%	0.412	34%	0.335	S	S	.	.	H	α-helix	trans	-62.4	-45.6	176.9	-179.7	68	0	0	0	111.9	W190 H232 S233 L234 L238 S239 S240	W190-H236 HydrophobicContact CH2-CB 4.23Å; W190-H236 HydrophobicContact CZ2-CB 3.61Å; W190-H236 AromaticContact CZ2-CG 3.72Å; H232-H236 WeakPolarHBondContact O-CB 3.44Å; H232-H236 PolarHBondContact O-N 3.27Å; S233-H236 PolarHBondContact O-N 3.13Å; L234-H236 VanDerWaalsContact C-N 3.31Å; L234-H236 PolarHBondContact O-N 3.41Å; H236-L238 VanDerWaalsContact C-N 3.33Å; H236-L238 PolarHBondContact O-N 2.93Å; H236-S239 PolarHBondContact O-N 2.95Å; H236-S240 PolarHBondContact CE1-OG 3.46Å; H236-S240 PolarHBondContact ND1-OG 3.44Å; H236-S240 PolarHBondContact NE2-OG 2.86Å; H236-S240 WeakPolarHBondContact O-CB 3.44Å; H236-S240 PolarHBondContact O-N 2.87Å; H236-S240 PolarHBondContact O-OG 3.26Å
237	A	89.2	Confident	83.8	Confident	7 Å²	7	59.2 Å²	59.2	6%	0.058	34%	0.338	C	S	.	.	H	α-helix	trans	-61.3	-40.5	177.6	0	0	0	0	0	112.4	S233 L234 S243 I248 P271	S233-A237 WeakPolarHBondContact O-CB 3.25Å; S233-A237 PolarHBondContact O-N 3.43Å; L234-A237 PolarHBondContact O-N 3.18Å; A237-S243 WeakPolarHBondContact O-CB 3.18Å; A237-I248 HydrophobicContact CB-CD1 4.11Å; A237-I248 HydrophobicContact CB-CG2 4.32Å; A237-P271 HydrophobicContact CB-CB 3.97Å; A237-P271 HydrophobicContact CB-CG 4.11Å
238	L	88.3	Confident	83.9	Confident	101 Å²	101	58.1 Å²	58.1	53%	0.529	33%	0.328	S	S	.	.	H	α-helix	trans	-70.2	-36.8	177.6	-70.9	174.5	0	0	0	113	L234 I235 H236 S243 I248	L234-L238 HydrophobicContact CD1-CD1 4.36Å; L234-L238 HydrophobicContact CD1-CG 4.4Å; L234-L238 HydrophobicContact CG-CD1 4.1Å; L234-L238 WeakPolarHBondContact O-CB 3.16Å; L234-L238 VanDerWaalsContact O-CG 3.28Å; L234-L238 WeakPolarHBondContact O-CG 3.18Å; L234-L238 PolarHBondContact O-N 2.69Å; I235-L238 PolarHBondContact O-N 3.39Å; H236-L238 VanDerWaalsContact C-N 3.33Å; H236-L238 PolarHBondContact O-N 2.93Å; L238-S243 PolarHBondContact O-OG 3.07Å; L238-S243 VanDerWaalsContact O-OG 3.13Å; L238-I248 HydrophobicContact CD2-CG1 4.46Å
239	S	86.3	Confident	84.1	Confident	95 Å²	95	60.1 Å²	60.1	66%	0.664	33%	0.333	S	S	*	.	H	α-helix	trans	-85.3	-25.7	-175.8	-51.9	0	0	0	0	113.2	I235 H236	I235-S239 VanDerWaalsContact O-CB 3.25Å; I235-S239 WeakPolarHBondContact O-CB 3.36Å; I235-S239 PolarHBondContact O-N 3.45Å; I235-S239 PolarHBondContact O-OG 3.48Å; H236-S239 PolarHBondContact O-N 2.95Å
240	S	81.9	Confident	84.3	Confident	27 Å²	27	59.9 Å²	59.9	19%	0.189	33%	0.333	C	S	.	.	S	Bend	trans	-69.1	145.8	179.6	-66.9	0	0	0	0	111.1	H236 S242 S243	H236-S240 PolarHBondContact CE1-OG 3.46Å; H236-S240 PolarHBondContact ND1-OG 3.44Å; H236-S240 PolarHBondContact NE2-OG 2.86Å; H236-S240 WeakPolarHBondContact O-CB 3.44Å; H236-S240 PolarHBondContact O-N 2.87Å; H236-S240 PolarHBondContact O-OG 3.26Å; S240-S242 WeakPolarHBondContact CB-OG 3.47Å; S240-S242 PolarHBondContact O-N 3.32Å; S240-S243 PolarHBondContact O-N 3.5Å; S240-S243 PolarHBondContact O-OG 2.92Å
241	S	66	Low	84.4	Confident	72 Å²	72	59.5 Å²	59.5	50%	0.503	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-56.7	-16.9	175.9	-61.2	0	0	0	0	113.8	S243 K244	S241-S243 PolarHBondContact O-N 2.91Å; S241-K244 WeakPolarHBondContact O-CB 3.39Å; S241-K244 PolarHBondContact O-N 3.26Å; S241-K244 VanDerWaalsContact O-N 3.13Å
242	S	66.2	Low	84.4	Confident	27 Å²	27	66.9 Å²	66.9	19%	0.189	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-60.7	-30.1	174.3	55.4	0	0	0	0	113.1	S240 K244 I245 S246	S240-S242 WeakPolarHBondContact CB-OG 3.47Å; S240-S242 PolarHBondContact O-N 3.32Å; S242-K244 PolarHBondContact O-N 2.78Å; S242-I245 PolarHBondContact O-N 3.38Å; S242-S246 PolarHBondContact O-N 3.41Å; S242-S246 VanDerWaalsContact O-N 3.08Å
243	S	64.9	Low	84.5	Confident	44 Å²	44	68.4 Å²	68.4	31%	0.308	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-64.2	-20	175.9	65.4	0	0	0	0	113.3	A237 L238 S240 S241	A237-S243 WeakPolarHBondContact O-CB 3.18Å; L238-S243 PolarHBondContact O-OG 3.07Å; L238-S243 VanDerWaalsContact O-OG 3.13Å; S240-S243 PolarHBondContact O-N 3.5Å; S240-S243 PolarHBondContact O-OG 2.92Å; S241-S243 PolarHBondContact O-N 2.91Å
244	K	71.4	Confident	84.5	Confident	183 Å²	183	74.4 Å²	74.4	80%	0.796	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-79.4	-22.3	174.1	-58.2	-178.5	-179.2	178.5	0	112.8	S241 S242	S241-K244 WeakPolarHBondContact O-CB 3.39Å; S241-K244 PolarHBondContact O-N 3.26Å; S241-K244 VanDerWaalsContact O-N 3.13Å; S242-K244 PolarHBondContact O-N 2.78Å
245	I	75.6	Confident	84.5	Confident	150 Å²	150	74.8 Å²	74.8	77%	0.769	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-38.5	-174.3	-59.5	168.6	0	0	0	110.2	S242	S242-I245 PolarHBondContact O-N 3.38Å
246	S	82.7	Confident	84.5	Confident	30 Å²	30	74.2 Å²	74.2	21%	0.21	41%	0.407	C	S	.	.	S	Bend	trans	-141.6	143.8	-176.5	58	0	0	0	0	111.8	S242	S242-S246 PolarHBondContact O-N 3.41Å; S242-S246 VanDerWaalsContact O-N 3.08Å
247	P	89.1	Confident	84.6	Confident	94 Å²	94	71.7 Å²	71.7	61%	0.61	40%	0.402	S	S	*	.			trans	-61.5	142.5	175.4	26.9	-34.7	0	0	0	111.2	I249 Q270	P247-I249 HydrophobicContact CB-CD1 4.41Å; P247-I249 HydrophobicContact CB-CG1 4.21Å; P247-I249 HydrophobicContact CG-CD1 3.99Å; P247-I249 HydrophobicContact CG-CG1 4.32Å; P247-I249 PolarHBondContact O-N 2.91Å; P247-Q270 PolarHBondContact O-NE2 3.14Å
248	I	91.2	Very high	84.7	Confident	47 Å²	47	71.3 Å²	71.3	24%	0.241	40%	0.399	C	S	.	.			trans	-87	109.2	174.4	-57.4	-54.3	0	0	0	108.5	L234 A237 L238 P271	L234-I248 HydrophobicContact CD1-CG2 4.46Å; A237-I248 HydrophobicContact CB-CD1 4.11Å; A237-I248 HydrophobicContact CB-CG2 4.32Å; L238-I248 HydrophobicContact CD2-CG1 4.46Å; I248-P271 HydrophobicContact CG2-CG 3.65Å
249	I	92.7	Very high	84.7	Confident	78 Å²	78	72.5 Å²	72.5	40%	0.4	40%	0.401	S	S	.	.			trans	-115	-28.5	-174.3	-57.4	171.4	0	0	0	110.9	P247 T275 F276	P247-I249 HydrophobicContact CB-CD1 4.41Å; P247-I249 HydrophobicContact CB-CG1 4.21Å; P247-I249 HydrophobicContact CG-CD1 3.99Å; P247-I249 HydrophobicContact CG-CG1 4.32Å; P247-I249 PolarHBondContact O-N 2.91Å; I249-T275 HydrophobicContact CG2-CG2 3.54Å; I249-T275 WeakPolarHBondContact O-CA 3.42Å; I249-F276 PolarHBondContact O-N 3.24Å
250	G	93.3	Very high	84.9	Confident	4 Å²	4	75.8 Å²	75.8	4%	0.041	40%	0.404	C	S	.	.			trans	101.5	-178.5	-169.1	0	0	0	0	0	112.2	E252 Q270	G250-E252 PolarHBondContact O-N 3.2Å; G250-Q270 WeakPolarHBondContact O-CG 3.42Å
251	Q	94.3	Very high	85.2	Confident	2 Å²	2	77.2 Å²	77.2	1%	0.009	41%	0.41	C	S	.	.	B	Isolated β-bridge	trans	-72	124.6	177	-60	-60	-38	0	0	109.9	A220 I258 N267 Q270 P271 M272 I273 T275	A220-Q251 HydrophobicContact CB-CB 3.7Å; A220-Q251 HydrophobicContact CB-CG 3.53Å; Q251-I258 HydrophobicContact CB-CD1 3.86Å; Q251-I258 HydrophobicContact CG-CD1 4.37Å; Q251-N267 PolarHBondContact NE2-O 3.5Å; Q251-Q270 PolarHBondContact NE2-O 3.34Å; Q251-P271 WeakPolarHBondContact CG-O 3.28Å; Q251-P271 PolarHBondContact NE2-O 3.2Å; Q251-M272 VanDerWaalsContact NE2-CE 3.35Å; Q251-I273 PolarHBondContact N-O 2.86Å; Q251-T275 PolarHBondContact O-N 3.31Å; Q251-T275 VanDerWaalsContact O-N 3.1Å; Q251-T275 PolarHBondContact O-OG1 3.01Å
252	E	91.9	Very high	86.2	Confident	166 Å²	166	75.2 Å²	75.2	78%	0.776	40%	0.395	S	S	*	.			trans	-79.8	-27.1	179.4	-171.7	-179.9	175.9	0	0	112.5	G250 T275	G250-E252 PolarHBondContact O-N 3.2Å; E252-T275 WeakPolarHBondContact CA-OG1 3.36Å
253	Q	91.6	Very high	87.2	Confident	98 Å²	98	78.3 Å²	78.3	46%	0.458	42%	0.415	S	S	.	.	S	Bend	trans	-70.9	148.8	-175.3	-62.1	-64.4	-37.5	0	0	111.6	I258 V265	Q253-I258 HydrophobicContact CB-CD1 4.01Å; Q253-I258 HydrophobicContact CB-CG1 3.93Å; Q253-I258 WeakPolarHBondContact O-CD1 3.45Å; Q253-V265 HydrophobicContact CB-CG1 3.39Å; Q253-V265 HydrophobicContact CG-CG1 3.48Å; Q253-V265 VanDerWaalsContact CG-CG1 3.48Å
254	Q	90.1	Very high	88.1	Confident	129 Å²	129	80.4 Å²	80.4	60%	0.603	43%	0.426	S	S	*	.			trans	-62.6	139.5	179.9	-71.8	-69.4	3.7	0	0	111	S256 A257 I258	Q254-S256 PolarHBondContact O-N 3.04Å; Q254-S256 VanDerWaalsContact O-N 3.1Å; Q254-A257 WeakPolarHBondContact O-CB 3.41Å; Q254-A257 PolarHBondContact O-N 3.21Å; Q254-I258 PolarHBondContact O-N 3.02Å; Q254-I258 VanDerWaalsContact O-N 3.15Å
255	P	90.2	Very high	89	Confident	42 Å²	42	73.5 Å²	73.5	27%	0.273	40%	0.399	S	S	.	.	H	α-helix	trans	-54	-35.7	-179	-28.8	35.5	0	0	0	114	A220 A257 I258 E259	A220-P255 VanDerWaalsContact O-CA 3.32Å; A220-P255 WeakPolarHBondContact O-CA 3.32Å; P255-A257 VanDerWaalsContact C-N 3.33Å; P255-A257 PolarHBondContact O-N 3.47Å; P255-I258 PolarHBondContact O-N 3.13Å; P255-E259 WeakPolarHBondContact O-CB 3.37Å; P255-E259 PolarHBondContact O-N 3Å
256	S	90	Very high	89.7	Confident	74 Å²	74	67.2 Å²	67.2	52%	0.517	37%	0.367	S	S	.	.	H	α-helix	trans	-67.9	-27.9	177.7	58	0	0	0	0	113.9	Q254 K260	Q254-S256 PolarHBondContact O-N 3.04Å; Q254-S256 VanDerWaalsContact O-N 3.1Å; S256-K260 WeakPolarHBondContact O-CG 3.38Å
257	A	89.5	Confident	90.1	Very high	35 Å²	35	69.1 Å²	69.1	29%	0.289	38%	0.375	S	S	.	.	H	α-helix	trans	-77.6	-41.5	174.3	0	0	0	0	0	110.7	Q254 P255 E259 K260 N261 V265	Q254-A257 WeakPolarHBondContact O-CB 3.41Å; Q254-A257 PolarHBondContact O-N 3.21Å; P255-A257 VanDerWaalsContact C-N 3.33Å; P255-A257 PolarHBondContact O-N 3.47Å; A257-E259 VanDerWaalsContact C-N 3.34Å; A257-K260 PolarHBondContact O-N 3.36Å; A257-N261 PolarHBondContact O-N 3.24Å; A257-V265 HydrophobicContact CB-CG1 4.24Å
258	I	91.2	Very high	90	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-63	-41.7	176.9	-66.4	172.4	0	0	0	110.7	A220 V222 Q251 Q253 Q254 P255 K260 N261 P262 V265 I266	A220-I258 HydrophobicContact CB-CD1 3.99Å; A220-I258 WeakPolarHBondContact O-CD1 3.33Å; V222-I258 HydrophobicContact CG2-CG2 3.52Å; Q251-I258 HydrophobicContact CB-CD1 3.86Å; Q251-I258 HydrophobicContact CG-CD1 4.37Å; Q253-I258 HydrophobicContact CB-CD1 4.01Å; Q253-I258 HydrophobicContact CB-CG1 3.93Å; Q253-I258 WeakPolarHBondContact O-CD1 3.45Å; Q254-I258 PolarHBondContact O-N 3.02Å; Q254-I258 VanDerWaalsContact O-N 3.15Å; P255-I258 PolarHBondContact O-N 3.13Å; I258-K260 VanDerWaalsContact C-N 3.33Å; I258-K260 PolarHBondContact O-N 3.14Å; I258-N261 CarbonylContact O-C 3.54Å; I258-N261 PolarHBondContact O-N 2.75Å; I258-P262 HydrophobicContact CG2-CB 4.42Å; I258-P262 WeakPolarHBondContact O-CA 3.33Å; I258-P262 VanDerWaalsContact O-CB 3.32Å; I258-P262 WeakPolarHBondContact O-CB 3.41Å; I258-P262 WeakPolarHBondContact O-CD 3.33Å; I258-V265 HydrophobicContact CG1-CB 4.5Å; I258-V265 HydrophobicContact CG1-CG1 3.79Å; I258-I266 HydrophobicContact CG2-CD1 4.1Å; I258-I266 HydrophobicContact CG2-CG1 4.03Å
259	E	89.8	Confident	89.8	Confident	125 Å²	125	69 Å²	69	58%	0.584	37%	0.366	S	S	*	.	H	α-helix	trans	-61.3	-40.1	179	-174	177.6	-171.3	0	0	112.4	P223 P255 A257	P223-E259 HydrophobicContact CG-CG 4.31Å; P255-E259 WeakPolarHBondContact O-CB 3.37Å; P255-E259 PolarHBondContact O-N 3Å; A257-E259 VanDerWaalsContact C-N 3.34Å
260	K	89.4	Confident	89.8	Confident	164 Å²	164	66.1 Å²	66.1	71%	0.713	35%	0.351	S	S	*	.	H	α-helix	trans	-68.5	-45	-179.9	-71.8	176.5	-176.8	-178.8	0	112.6	S256 A257 I258	S256-K260 WeakPolarHBondContact O-CG 3.38Å; A257-K260 PolarHBondContact O-N 3.36Å; I258-K260 VanDerWaalsContact C-N 3.33Å; I258-K260 PolarHBondContact O-N 3.14Å
261	N	87.6	Confident	89.8	Confident	58 Å²	58	66 Å²	66	31%	0.31	35%	0.35	S	S	.	.			trans	-145.3	70	-172.7	-70.7	-58.9	0	0	0	111.9	T64 A257 I258 C263 V264 V265	T64-N261 WeakPolarHBondContact CG2-OD1 3.33Å; A257-N261 PolarHBondContact O-N 3.24Å; I258-N261 CarbonylContact O-C 3.54Å; I258-N261 PolarHBondContact O-N 2.75Å; N261-C263 VanDerWaalsContact C-N 3.3Å; N261-C263 PolarHBondContact O-N 2.94Å; N261-V264 HydrophobicContact CB-CB 4.43Å; N261-V264 PolarHBondContact O-N 2.9Å; N261-V264 VanDerWaalsContact O-N 3.17Å; N261-V265 HydrophobicContact CB-CG2 4.33Å; N261-V265 WeakPolarHBondContact O-CG2 3.44Å; N261-V265 PolarHBondContact O-N 2.71Å
262	P	88	Confident	89.7	Confident	30 Å²	30	66.4 Å²	66.4	20%	0.195	35%	0.352	C	S	.	.	H	α-helix	trans	-62.5	-37.4	-171.8	24	-33.1	0	0	0	111.9	F189 V222 I258 V264 I266	F189-P262 HydrophobicContact CE1-CB 4.3Å; F189-P262 HydrophobicContact CZ-CB 3.9Å; F189-P262 HydrophobicContact CZ-CG 4.48Å; V222-P262 HydrophobicContact CG1-CB 4.48Å; I258-P262 HydrophobicContact CG2-CB 4.42Å; I258-P262 WeakPolarHBondContact O-CA 3.33Å; I258-P262 VanDerWaalsContact O-CB 3.32Å; I258-P262 WeakPolarHBondContact O-CB 3.41Å; I258-P262 WeakPolarHBondContact O-CD 3.33Å; P262-V264 PolarHBondContact O-N 3.31Å; P262-I266 HydrophobicContact CB-CD1 3.64Å; P262-I266 HydrophobicContact CB-CG1 4.47Å; P262-I266 WeakPolarHBondContact O-CB 3.15Å; P262-I266 WeakPolarHBondContact O-CD1 3.45Å; P262-I266 WeakPolarHBondContact O-CG1 3.38Å; P262-I266 PolarHBondContact O-N 2.94Å; P262-I266 VanDerWaalsContact O-N 3.16Å
263	C	85.8	Confident	89.8	Confident	92 Å²	92	58.8 Å²	58.8	62%	0.622	32%	0.317	S	S	*	.	H	α-helix	trans	-66.8	-19.5	-178.2	-56.4	0	0	0	0	114.8	N261	N261-C263 VanDerWaalsContact C-N 3.3Å; N261-C263 PolarHBondContact O-N 2.94Å
264	V	85.6	Confident	89.9	Confident	87 Å²	87	58.6 Å²	58.6	53%	0.527	31%	0.314	S	S	.	.	H	α-helix	trans	-100.8	-35.5	-177.4	-179.7	0	0	0	0	111	N261 P262	N261-V264 HydrophobicContact CB-CB 4.43Å; N261-V264 PolarHBondContact O-N 2.9Å; N261-V264 VanDerWaalsContact O-N 3.17Å; P262-V264 PolarHBondContact O-N 3.31Å
265	V	89.6	Confident	90	Very high	39 Å²	39	54.9 Å²	54.9	24%	0.236	30%	0.3	C	S	.	.	H	α-helix	trans	-91.4	-26.3	-168.8	179.3	0	0	0	0	112.1	Q253 A257 I258 N261	Q253-V265 HydrophobicContact CB-CG1 3.39Å; Q253-V265 HydrophobicContact CG-CG1 3.48Å; Q253-V265 VanDerWaalsContact CG-CG1 3.48Å; A257-V265 HydrophobicContact CB-CG1 4.24Å; I258-V265 HydrophobicContact CG1-CB 4.5Å; I258-V265 HydrophobicContact CG1-CG1 3.79Å; N261-V265 HydrophobicContact CB-CG2 4.33Å; N261-V265 WeakPolarHBondContact O-CG2 3.44Å; N261-V265 PolarHBondContact O-N 2.71Å
266	I	90.8	Very high	90.1	Very high	17 Å²	17	56.5 Å²	56.5	9%	0.087	30%	0.303	C	S	.	.			trans	-74	134.7	-174.4	-72.3	171.8	0	0	0	111.7	F189 V222 I258 P262 M272	F189-I266 HydrophobicContact CE1-CD1 3.4Å; F189-I266 VanDerWaalsContact CE1-CD1 3.4Å; F189-I266 HydrophobicContact CZ-CD1 3.7Å; V222-I266 HydrophobicContact CG2-CD1 3.54Å; I258-I266 HydrophobicContact CG2-CD1 4.1Å; I258-I266 HydrophobicContact CG2-CG1 4.03Å; P262-I266 HydrophobicContact CB-CD1 3.64Å; P262-I266 HydrophobicContact CB-CG1 4.47Å; P262-I266 WeakPolarHBondContact O-CB 3.15Å; P262-I266 WeakPolarHBondContact O-CD1 3.45Å; P262-I266 WeakPolarHBondContact O-CG1 3.38Å; P262-I266 PolarHBondContact O-N 2.94Å; P262-I266 VanDerWaalsContact O-N 3.16Å; I266-M272 HydrophobicContact CD1-SD 4.03Å; I266-M272 HydrophobicContact CG2-CE 3.58Å; I266-M272 HydrophobicContact CG2-SD 3.99Å
267	N	90	Very high	90.1	Very high	70 Å²	70	59 Å²	59	37%	0.374	31%	0.31	S	S	.	.			trans	-82.8	115.2	165.9	-177.5	-7.1	0	0	0	109.4	Q251 L269 Q270	Q251-N267 PolarHBondContact NE2-O 3.5Å; N267-L269 PolarHBondContact O-N 3.38Å; N267-L269 WeakPolarHBondContact OD1-CB 3.38Å; N267-L269 PolarHBondContact OD1-N 3.3Å; N267-Q270 HydrophobicContact CB-CB 4.4Å; N267-Q270 HydrophobicContact CB-CG 4.35Å; N267-Q270 PolarHBondContact O-N 2.96Å
268	H	87.8	Confident	90.2	Very high	75 Å²	75	61.6 Å²	61.6	35%	0.347	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-16.1	-179	61.5	-76	0	0	0	114.3	E183 H186 L188	E183-H268 IonicContact OE1-CE1 3.61Å; E183-H268 IonicContact OE1-NE2 3.28Å; E183-H268 PolarHBondContact OE1-NE2 2.87Å; H186-H268 HydrophobicContact CB-CB 4.5Å; H186-H268 AromaticContact CD2-CD2 3.61Å; H186-H268 AromaticContact CG-CD2 3.8Å; L188-H268 HydrophobicContact CD2-CB 3.78Å
269	L	87.7	Confident	90.3	Very high	63 Å²	63	64.7 Å²	64.7	33%	0.33	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-10.7	178.9	-57.7	178	0	0	0	113.1	N267	N267-L269 PolarHBondContact O-N 3.38Å; N267-L269 WeakPolarHBondContact OD1-CB 3.38Å; N267-L269 PolarHBondContact OD1-N 3.3Å
270	Q	92.1	Very high	90.6	Very high	19 Å²	19	64.8 Å²	64.8	9%	0.089	35%	0.345	C	S	.	.	S	Bend	trans	-109.1	145.1	-179.3	-66.4	-65.3	-27.4	0	0	110.6	P247 G250 Q251 N267 M272	P247-Q270 PolarHBondContact O-NE2 3.14Å; G250-Q270 WeakPolarHBondContact O-CG 3.42Å; Q251-Q270 PolarHBondContact NE2-O 3.34Å; N267-Q270 HydrophobicContact CB-CB 4.4Å; N267-Q270 HydrophobicContact CB-CG 4.35Å; N267-Q270 PolarHBondContact O-N 2.96Å; Q270-M272 VanDerWaalsContact O-CE 3.28Å; Q270-M272 WeakPolarHBondContact O-CE 3.48Å
271	P	92.5	Very high	90.8	Very high	2 Å²	2	60 Å²	60	1%	0.013	33%	0.327	C	S	.	.			trans	-63.8	160.1	176.7	26.3	-33.7	0	0	0	111.4	L234 A237 I248 Q251 I273	L234-P271 HydrophobicContact CD1-CB 4.38Å; L234-P271 HydrophobicContact CD1-CG 4.09Å; A237-P271 HydrophobicContact CB-CB 3.97Å; A237-P271 HydrophobicContact CB-CG 4.11Å; I248-P271 HydrophobicContact CG2-CG 3.65Å; Q251-P271 WeakPolarHBondContact CG-O 3.28Å; Q251-P271 PolarHBondContact NE2-O 3.2Å; P271-I273 HydrophobicContact CB-CG1 4.13Å; P271-I273 HydrophobicContact CG-CD1 4.12Å; P271-I273 HydrophobicContact CG-CG1 3.76Å; P271-I273 PolarHBondContact O-N 3.47Å
272	M	92.8	Very high	91	Very high	9 Å²	9	59.6 Å²	59.6	4%	0.044	33%	0.325	C	S	.	.	S	Bend	trans	-74.7	30	-177.9	-60.8	-61.1	110.8	0	0	114.4	F189 A220 V222 Y225 L230 S233 Q251 I266 Q270	F189-M272 HydrophobicContact CE1-SD 4.43Å; A220-M272 WeakPolarHBondContact CB-O 3.19Å; A220-M272 PolarHBondContact N-O 3.33Å; V222-M272 HydrophobicContact CG2-SD 4.26Å; Y225-M272 HydrophobicContact CD1-CB 4.22Å; Y225-M272 HydrophobicContact CE1-CB 3.83Å; Y225-M272 HydrophobicContact CE1-CG 3.86Å; Y225-M272 HydrophobicContact CE2-CG 4.43Å; L230-M272 HydrophobicContact CD2-CB 4.22Å; L230-M272 WeakPolarHBondContact CD2-O 3.25Å; S233-M272 PolarHBondContact OG-N 2.98Å; S233-M272 VanDerWaalsContact OG-N 3.1Å; Q251-M272 VanDerWaalsContact NE2-CE 3.35Å; I266-M272 HydrophobicContact CD1-SD 4.03Å; I266-M272 HydrophobicContact CG2-CE 3.58Å; I266-M272 HydrophobicContact CG2-SD 3.99Å; Q270-M272 VanDerWaalsContact O-CE 3.28Å; Q270-M272 WeakPolarHBondContact O-CE 3.48Å
273	I	93.7	Very high	91.4	Very high	7 Å²	7	61.6 Å²	61.6	4%	0.036	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-104.7	153.7	176.7	59.8	166.1	0	0	0	110.3	I217 Q218 L230 L234 Q251 P271	I217-I273 HydrophobicContact CG2-CB 4.08Å; I217-I273 HydrophobicContact CG2-CD1 4.08Å; I217-I273 HydrophobicContact CG2-CG2 3.62Å; Q218-I273 CarbonylContact O-C 3.52Å; Q218-I273 VanDerWaalsContact O-CA 3.25Å; Q218-I273 WeakPolarHBondContact O-CA 3.08Å; Q218-I273 WeakPolarHBondContact O-CB 3.46Å; L230-I273 HydrophobicContact CB-CG2 4.23Å; L230-I273 HydrophobicContact CD2-CG2 4.09Å; L234-I273 HydrophobicContact CD1-CD1 4.14Å; Q251-I273 PolarHBondContact N-O 2.86Å; P271-I273 HydrophobicContact CB-CG1 4.13Å; P271-I273 HydrophobicContact CG-CD1 4.12Å; P271-I273 HydrophobicContact CG-CG1 3.76Å; P271-I273 PolarHBondContact O-N 3.47Å
274	K	93.5	Very high	92	Very high	94 Å²	94	64.7 Å²	64.7	41%	0.409	33%	0.332	S	S	.	.	B	Isolated β-bridge	trans	-59	152.5	169.4	-173.1	176.3	-179.9	-178.9	0	109.6	Q218 F276	Q218-K274 PolarHBondContact O-N 2.98Å; K274-F276 PolarHBondContact O-N 3.17Å; K274-F276 VanDerWaalsContact O-N 3.14Å
275	T	93.4	Very high	92.4	Very high	50 Å²	50	66.9 Å²	66.9	31%	0.307	33%	0.331	S	S	.	.			trans	-43.9	122.2	169.3	-40.5	0	0	0	0	110.3	I249 Q251 E252 I277	I249-T275 HydrophobicContact CG2-CG2 3.54Å; I249-T275 WeakPolarHBondContact O-CA 3.42Å; Q251-T275 PolarHBondContact O-N 3.31Å; Q251-T275 VanDerWaalsContact O-N 3.1Å; Q251-T275 PolarHBondContact O-OG1 3.01Å; E252-T275 WeakPolarHBondContact CA-OG1 3.36Å; T275-I277 HydrophobicContact CG2-CG1 4.4Å
276	F	91.3	Very high	92.7	Very high	76 Å²	76	70 Å²	70	33%	0.333	34%	0.343	S	S	.	.			trans	-119.3	121.9	178.4	-177.5	-96.2	0	0	0	109.1	I217 I249 K274 V278	I217-F276 HydrophobicContact CG1-CD2 4.1Å; I217-F276 HydrophobicContact CG1-CE2 4.29Å; I217-F276 HydrophobicContact CG1-CG 4.42Å; I249-F276 PolarHBondContact O-N 3.24Å; K274-F276 PolarHBondContact O-N 3.17Å; K274-F276 VanDerWaalsContact O-N 3.14Å; F276-V278 HydrophobicContact CD1-CG2 4.28Å; F276-V278 HydrophobicContact CE1-CG2 3.72Å
277	I	90.8	Very high	93	Very high	128 Å²	128	75.1 Å²	75.1	66%	0.656	37%	0.366	S	S	*	.			trans	-113.9	123.5	179	-59.2	175.6	0	0	0	107.3	T275 T279	T275-I277 HydrophobicContact CG2-CG1 4.4Å; I277-T279 PolarHBondContact O-N 3.18Å
278	V	90.4	Very high	93.3	Very high	88 Å²	88	74.6 Å²	74.6	53%	0.533	37%	0.372	S	S	.	.			trans	-75.6	117.9	173.1	179	0	0	0	0	107.9	F276 D282 I283	F276-V278 HydrophobicContact CD1-CG2 4.28Å; F276-V278 HydrophobicContact CE1-CG2 3.72Å; V278-D282 HydrophobicContact CG1-CB 4.2Å; V278-I283 HydrophobicContact CG1-CD1 4.15Å; V278-I283 HydrophobicContact CG1-CG1 3.71Å
279	T	93.1	Very high	93.8	Very high	65 Å²	65	78.5 Å²	78.5	40%	0.399	38%	0.383	S	S	.	.			trans	-88.4	158.7	175.8	67.5	0	0	0	0	111.2	I277 D281 D282 I283	I277-T279 PolarHBondContact O-N 3.18Å; T279-D281 PolarHBondContact O-N 3.26Å; T279-D281 VanDerWaalsContact O-N 3.14Å; T279-D282 WeakPolarHBondContact CB-OD2 3.28Å; T279-D282 PolarHBondContact N-OD2 3.37Å; T279-D282 WeakPolarHBondContact O-CB 3.24Å; T279-D282 PolarHBondContact O-N 3.13Å; T279-D282 VanDerWaalsContact OG1-CG 3.22Å; T279-D282 PolarHBondContact OG1-N 3.44Å; T279-D282 PolarHBondContact OG1-OD2 3.26Å; T279-I283 PolarHBondContact O-N 3.28Å; T279-I283 VanDerWaalsContact O-N 3.14Å
280	D	96	Very high	94.2	Very high	127 Å²	127	77.8 Å²	77.8	68%	0.679	38%	0.382	S	S	*	.	H	α-helix	trans	-56.8	-29.8	172.5	-66.9	-30.4	0	0	0	112.1	I283 R284	D280-I283 PolarHBondContact O-N 3.05Å; D280-R284 VanDerWaalsContact O-CG 3.31Å; D280-R284 WeakPolarHBondContact O-CG 3.41Å; D280-R284 PolarHBondContact O-N 3.08Å
281	D	94.9	Very high	94.5	Very high	64 Å²	64	84.7 Å²	84.7	34%	0.342	41%	0.412	S	S	.	.	H	α-helix	trans	-70.2	-36	176.9	-157.2	52.1	0	0	0	112.6	T279 R284 R285	T279-D281 PolarHBondContact O-N 3.26Å; T279-D281 VanDerWaalsContact O-N 3.14Å; D281-R284 IonicContact OD1-CZ 3.9Å; D281-R284 IonicContact OD1-NE 3.4Å; D281-R284 IonicContact OD1-NH2 3.32Å; D281-R284 PolarHBondContact OD1-NH2 2.78Å; D281-R285 WeakPolarHBondContact O-CB 3.16Å; D281-R285 WeakPolarHBondContact O-CG 3.31Å; D281-R285 PolarHBondContact O-N 3.06Å; D281-R285 IonicContact OD2-CZ 3.66Å; D281-R285 IonicContact OD2-NH1 3.68Å; D281-R285 PolarHBondContact OD2-NH1 2.9Å; D281-R285 IonicContact OD2-NH2 2.91Å
282	D	92.3	Very high	94.8	Very high	50 Å²	50	89.5 Å²	89.5	27%	0.267	43%	0.434	S	S	.	.	H	α-helix	trans	-63	-43.1	170.8	-63.1	-53.7	0	0	0	111.5	V278 T279 R285 Q286	V278-D282 HydrophobicContact CG1-CB 4.2Å; T279-D282 WeakPolarHBondContact CB-OD2 3.28Å; T279-D282 PolarHBondContact N-OD2 3.37Å; T279-D282 WeakPolarHBondContact O-CB 3.24Å; T279-D282 PolarHBondContact O-N 3.13Å; T279-D282 VanDerWaalsContact OG1-CG 3.22Å; T279-D282 PolarHBondContact OG1-N 3.44Å; T279-D282 PolarHBondContact OG1-OD2 3.26Å; D282-R285 PolarHBondContact O-N 3.03Å; D282-R285 IonicContact OD1-CZ 2.67Å; D282-R285 IonicContact OD1-NE 2.74Å; D282-R285 IonicContact OD1-NH2 3.49Å; D282-R285 PolarHBondContact OD1-NH2 2.89Å; D282-Q286 WeakPolarHBondContact O-CB 3.35Å; D282-Q286 PolarHBondContact O-N 3.12Å
283	I	95.6	Very high	95	Very high	72 Å²	72	93.6 Å²	93.6	37%	0.369	46%	0.455	S	S	.	.	H	α-helix	trans	-62	-52.9	177.9	-61.4	172.4	0	0	0	109.7	V278 T279 D280 R285 Q286 E287	V278-I283 HydrophobicContact CG1-CD1 4.15Å; V278-I283 HydrophobicContact CG1-CG1 3.71Å; T279-I283 PolarHBondContact O-N 3.28Å; T279-I283 VanDerWaalsContact O-N 3.14Å; D280-I283 PolarHBondContact O-N 3.05Å; I283-R285 VanDerWaalsContact C-N 3.33Å; I283-R285 PolarHBondContact O-N 3.03Å; I283-Q286 PolarHBondContact O-N 2.78Å; I283-Q286 VanDerWaalsContact O-N 3.07Å; I283-E287 HydrophobicContact CG2-CG 4.29Å; I283-E287 WeakPolarHBondContact O-CG 3.28Å; I283-E287 PolarHBondContact O-N 3.47Å
284	R	97.3	Very high	95.1	Very high	156 Å²	156	101.9 Å²	101.9	59%	0.589	49%	0.486	S	S	*	.	H	α-helix	trans	-57.4	-43.3	178.9	-72.9	-174.7	-56.1	-173.5	5	112.5	D280 D281 Q286 E287 A288	D280-R284 VanDerWaalsContact O-CG 3.31Å; D280-R284 WeakPolarHBondContact O-CG 3.41Å; D280-R284 PolarHBondContact O-N 3.08Å; D281-R284 IonicContact OD1-CZ 3.9Å; D281-R284 IonicContact OD1-NE 3.4Å; D281-R284 IonicContact OD1-NH2 3.32Å; D281-R284 PolarHBondContact OD1-NH2 2.78Å; R284-Q286 VanDerWaalsContact C-N 3.35Å; R284-Q286 PolarHBondContact O-N 3.33Å; R284-E287 PolarHBondContact O-N 2.87Å; R284-A288 WeakPolarHBondContact O-CB 3.41Å; R284-A288 PolarHBondContact O-N 3.19Å
285	R	95.4	Very high	95.3	Very high	133 Å²	133	104 Å²	104	50%	0.502	50%	0.496	S	S	.	.	H	α-helix	trans	-60.1	-44.7	175.2	-82	-169.2	-72.2	-95	-5.6	112	D281 D282 I283 A288 R289	D281-R285 WeakPolarHBondContact O-CB 3.16Å; D281-R285 WeakPolarHBondContact O-CG 3.31Å; D281-R285 PolarHBondContact O-N 3.06Å; D281-R285 IonicContact OD2-CZ 3.66Å; D281-R285 IonicContact OD2-NH1 3.68Å; D281-R285 PolarHBondContact OD2-NH1 2.9Å; D281-R285 IonicContact OD2-NH2 2.91Å; D282-R285 PolarHBondContact O-N 3.03Å; D282-R285 IonicContact OD1-CZ 2.67Å; D282-R285 IonicContact OD1-NE 2.74Å; D282-R285 IonicContact OD1-NH2 3.49Å; D282-R285 PolarHBondContact OD1-NH2 2.89Å; I283-R285 VanDerWaalsContact C-N 3.33Å; I283-R285 PolarHBondContact O-N 3.03Å; R285-A288 PolarHBondContact O-N 3.29Å; R285-R289 WeakPolarHBondContact O-CB 3.15Å; R285-R289 PolarHBondContact O-N 3.24Å
286	Q	94.6	Very high	95.4	Very high	105 Å²	105	107.3 Å²	107.3	49%	0.491	51%	0.505	S	S	.	.	H	α-helix	trans	-68.5	-40.9	-179	-175	62.6	8.2	0	0	111.5	D282 I283 R284 R289 V290	D282-Q286 WeakPolarHBondContact O-CB 3.35Å; D282-Q286 PolarHBondContact O-N 3.12Å; I283-Q286 PolarHBondContact O-N 2.78Å; I283-Q286 VanDerWaalsContact O-N 3.07Å; R284-Q286 VanDerWaalsContact C-N 3.35Å; R284-Q286 PolarHBondContact O-N 3.33Å; Q286-R289 PolarHBondContact O-N 3.35Å; Q286-V290 WeakPolarHBondContact O-CG2 3.49Å; Q286-V290 PolarHBondContact O-N 3.44Å
287	E	97.6	Very high	95.6	Very high	124 Å²	124	109.5 Å²	109.5	58%	0.579	52%	0.52	S	S	*	.	H	α-helix	trans	-62.1	-44.3	174.5	-71.9	-179	160.8	0	0	112.1	I283 R284 R289 V290 K291	I283-E287 HydrophobicContact CG2-CG 4.29Å; I283-E287 WeakPolarHBondContact O-CG 3.28Å; I283-E287 PolarHBondContact O-N 3.47Å; R284-E287 PolarHBondContact O-N 2.87Å; E287-R289 VanDerWaalsContact C-N 3.33Å; E287-R289 PolarHBondContact O-N 3.32Å; E287-V290 PolarHBondContact O-N 2.93Å; E287-K291 WeakPolarHBondContact O-CB 3.4Å; E287-K291 PolarHBondContact O-N 3.49Å
288	A	97.4	Very high	95.7	Very high	60 Å²	60	107.4 Å²	107.4	50%	0.496	51%	0.508	S	S	.	.	H	α-helix	trans	-59.2	-44.5	175.2	0	0	0	0	0	111.5	R284 R285 K291 E292	R284-A288 WeakPolarHBondContact O-CB 3.41Å; R284-A288 PolarHBondContact O-N 3.19Å; R285-A288 PolarHBondContact O-N 3.29Å; A288-K291 PolarHBondContact O-N 2.7Å; A288-E292 PolarHBondContact O-N 2.76Å
289	R	96.8	Very high	95.8	Very high	156 Å²	156	107 Å²	107	59%	0.589	50%	0.501	S	S	*	.	H	α-helix	trans	-62.2	-43.9	175.8	-174.7	179.1	-177	-175.5	1.4	112.2	R285 Q286 E287 K291 E292 L293	R285-R289 WeakPolarHBondContact O-CB 3.15Å; R285-R289 PolarHBondContact O-N 3.24Å; Q286-R289 PolarHBondContact O-N 3.35Å; E287-R289 VanDerWaalsContact C-N 3.33Å; E287-R289 PolarHBondContact O-N 3.32Å; R289-K291 VanDerWaalsContact C-N 3.35Å; R289-E292 PolarHBondContact O-N 3.01Å; R289-L293 HydrophobicContact CG-CD1 4.28Å; R289-L293 WeakPolarHBondContact O-CG 3.18Å; R289-L293 PolarHBondContact O-N 2.65Å
290	V	97.7	Very high	95.7	Very high	49 Å²	49	106.5 Å²	106.5	30%	0.297	50%	0.504	S	S	.	.	H	α-helix	trans	-63	-42.4	176.4	169.3	0	0	0	0	110.8	Q286 E287 E292 L293 R294	Q286-V290 WeakPolarHBondContact O-CG2 3.49Å; Q286-V290 PolarHBondContact O-N 3.44Å; E287-V290 PolarHBondContact O-N 2.93Å; V290-E292 PolarHBondContact O-N 3.44Å; V290-L293 PolarHBondContact O-N 3.3Å; V290-R294 HydrophobicContact CG1-CG 4.35Å; V290-R294 WeakPolarHBondContact O-CB 3.39Å; V290-R294 VanDerWaalsContact O-CG 3.31Å; V290-R294 WeakPolarHBondContact O-CG 3.43Å; V290-R294 PolarHBondContact O-N 2.79Å
291	K	97.7	Very high	95.4	Very high	164 Å²	164	107.2 Å²	107.2	71%	0.713	50%	0.497	S	S	*	.	H	α-helix	trans	-61.5	-43.5	176.8	-172.6	177.4	-178.5	177.4	0	111.8	E287 A288 R289 R294 K295	E287-K291 WeakPolarHBondContact O-CB 3.4Å; E287-K291 PolarHBondContact O-N 3.49Å; A288-K291 PolarHBondContact O-N 2.7Å; R289-K291 VanDerWaalsContact C-N 3.35Å; K291-R294 PolarHBondContact O-N 2.98Å; K291-K295 PolarHBondContact O-N 3.41Å
292	E	97.9	Very high	95	Very high	102 Å²	102	108 Å²	108	48%	0.477	50%	0.498	S	S	.	.	H	α-helix	trans	-61.7	-47.7	175.2	-169.6	-163.8	156.7	0	0	111.8	A288 R289 V290 R294 K295 K296	A288-E292 PolarHBondContact O-N 2.76Å; R289-E292 PolarHBondContact O-N 3.01Å; V290-E292 PolarHBondContact O-N 3.44Å; E292-R294 PolarHBondContact O-N 3.34Å; E292-K295 PolarHBondContact O-N 3.24Å; E292-K296 HydrophobicContact CG-CD 4.49Å; E292-K296 PolarHBondContact O-N 2.73Å; E292-K296 VanDerWaalsContact OE1-CE 3.28Å; E292-K296 WeakPolarHBondContact OE1-CE 3.24Å; E292-K296 IonicContact OE1-NZ 3.38Å; E292-K296 PolarHBondContact OE1-NZ 3.19Å
293	L	97.5	Very high	94.8	Very high	95 Å²	95	113.8 Å²	113.8	50%	0.497	52%	0.52	S	S	.	.	H	α-helix	trans	-63.3	-39.7	178.3	-72	173.2	0	0	0	112.1	R289 V290 K296 L297	R289-L293 HydrophobicContact CG-CD1 4.28Å; R289-L293 WeakPolarHBondContact O-CG 3.18Å; R289-L293 PolarHBondContact O-N 2.65Å; V290-L293 PolarHBondContact O-N 3.3Å; L293-K296 PolarHBondContact O-N 3.32Å; L293-L297 WeakPolarHBondContact O-CB 3.31Å; L293-L297 PolarHBondContact O-N 2.87Å
294	R	96.8	Very high	94.4	Very high	181 Å²	181	116.7 Å²	116.7	68%	0.683	54%	0.536	S	S	*	.	H	α-helix	trans	-61.6	-43	174	-76.4	177.1	178.9	175.2	1.3	111.7	V290 K291 E292 L297 E298	V290-R294 HydrophobicContact CG1-CG 4.35Å; V290-R294 WeakPolarHBondContact O-CB 3.39Å; V290-R294 VanDerWaalsContact O-CG 3.31Å; V290-R294 WeakPolarHBondContact O-CG 3.43Å; V290-R294 PolarHBondContact O-N 2.79Å; K291-R294 PolarHBondContact O-N 2.98Å; E292-R294 PolarHBondContact O-N 3.34Å; R294-L297 PolarHBondContact O-N 3.5Å; R294-E298 WeakPolarHBondContact O-CB 3.45Å; R294-E298 PolarHBondContact O-N 2.87Å
295	K	96.5	Very high	93.6	Very high	140 Å²	140	113.7 Å²	113.7	61%	0.609	53%	0.529	S	S	*	.	H	α-helix	trans	-63.3	-43.6	174.9	-174.7	178	179.8	178.8	0	111.7	K291 E292 L297 E298 I299	K291-K295 PolarHBondContact O-N 3.41Å; E292-K295 PolarHBondContact O-N 3.24Å; K295-L297 PolarHBondContact O-N 3.18Å; K295-E298 PolarHBondContact O-N 3.35Å; K295-I299 HydrophobicContact CG-CD1 4.09Å; K295-I299 VanDerWaalsContact O-CG1 3.31Å; K295-I299 WeakPolarHBondContact O-CG1 3.43Å; K295-I299 PolarHBondContact O-N 3.46Å
296	K	96.2	Very high	92.4	Very high	118 Å²	118	111.3 Å²	111.3	51%	0.513	53%	0.53	S	S	.	.	H	α-helix	trans	-60.4	-43.7	175.2	-77.3	174.4	169.5	168.9	0	111.7	E292 L293 I299 A300	E292-K296 HydrophobicContact CG-CD 4.49Å; E292-K296 PolarHBondContact O-N 2.73Å; E292-K296 VanDerWaalsContact OE1-CE 3.28Å; E292-K296 WeakPolarHBondContact OE1-CE 3.24Å; E292-K296 IonicContact OE1-NZ 3.38Å; E292-K296 PolarHBondContact OE1-NZ 3.19Å; L293-K296 PolarHBondContact O-N 3.32Å; K296-I299 PolarHBondContact O-N 2.88Å; K296-A300 WeakPolarHBondContact O-CB 3.41Å; K296-A300 PolarHBondContact O-N 3.26Å
297	L	95.1	Very high	90.9	Very high	123 Å²	123	116.8 Å²	116.8	64%	0.644	55%	0.546	S	S	*	.	H	α-helix	trans	-63.9	-42.4	176	-179.3	62.4	0	0	0	112	L293 R294 K295 A300 R301	L293-L297 WeakPolarHBondContact O-CB 3.31Å; L293-L297 PolarHBondContact O-N 2.87Å; R294-L297 PolarHBondContact O-N 3.5Å; K295-L297 PolarHBondContact O-N 3.18Å; L297-A300 PolarHBondContact O-N 3.03Å; L297-R301 WeakPolarHBondContact O-CB 3.43Å; L297-R301 PolarHBondContact O-N 3.37Å
298	E	92.3	Very high	89.1	Confident	84 Å²	84	116.3 Å²	116.3	39%	0.393	54%	0.54	S	S	.	.	H	α-helix	trans	-59.7	-47.7	175.9	-174.2	-172.5	167.9	0	0	111.4	R294 K295 A300 R301 K302	R294-E298 WeakPolarHBondContact O-CB 3.45Å; R294-E298 PolarHBondContact O-N 2.87Å; K295-E298 PolarHBondContact O-N 3.35Å; E298-A300 PolarHBondContact O-N 3.04Å; E298-R301 PolarHBondContact O-N 2.98Å; E298-K302 HydrophobicContact CG-CD 4.5Å; E298-K302 WeakPolarHBondContact O-CG 3.27Å; E298-K302 PolarHBondContact O-N 3.33Å; E298-K302 WeakPolarHBondContact OE1-CE 3.35Å; E298-K302 IonicContact OE1-NZ 2.76Å; E298-K302 PolarHBondContact OE1-NZ 2.92Å
299	I	92.3	Very high	87.2	Confident	78 Å²	78	119.8 Å²	119.8	40%	0.4	55%	0.546	S	S	.	.	H	α-helix	trans	-61.2	-44.8	177.4	-66.5	164.6	0	0	0	110.7	K295 K296 R301 K302 K303	K295-I299 HydrophobicContact CG-CD1 4.09Å; K295-I299 VanDerWaalsContact O-CG1 3.31Å; K295-I299 WeakPolarHBondContact O-CG1 3.43Å; K295-I299 PolarHBondContact O-N 3.46Å; K296-I299 PolarHBondContact O-N 2.88Å; I299-R301 VanDerWaalsContact C-N 3.33Å; I299-R301 PolarHBondContact O-N 3.29Å; I299-K302 PolarHBondContact O-N 3.07Å; I299-K303 HydrophobicContact CG2-CD 4.47Å; I299-K303 WeakPolarHBondContact O-CG 3.36Å; I299-K303 PolarHBondContact O-N 2.74Å
300	A	92.5	Very high	85.4	Confident	56 Å²	56	118.1 Å²	118.1	46%	0.463	55%	0.553	S	S	.	*	H	α-helix	trans	-62.2	-40.5	177.4	0	0	0	0	0	111.9	K296 L297 E298 K303 L304	K296-A300 WeakPolarHBondContact O-CB 3.41Å; K296-A300 PolarHBondContact O-N 3.26Å; L297-A300 PolarHBondContact O-N 3.03Å; E298-A300 PolarHBondContact O-N 3.04Å; A300-K303 PolarHBondContact O-N 3.02Å; A300-L304 PolarHBondContact O-N 3.48Å
301	R	89.6	Confident	83.5	Confident	141 Å²	141	122.9 Å²	122.9	53%	0.532	57%	0.573	S	S	.	*	H	α-helix	trans	-66.4	-40.9	176.8	-172.2	178.5	174.3	-171.6	-2.5	112.1	L297 E298 I299 K303 L304 H305	L297-R301 WeakPolarHBondContact O-CB 3.43Å; L297-R301 PolarHBondContact O-N 3.37Å; E298-R301 PolarHBondContact O-N 2.98Å; I299-R301 VanDerWaalsContact C-N 3.33Å; I299-R301 PolarHBondContact O-N 3.29Å; R301-K303 VanDerWaalsContact C-N 3.34Å; R301-L304 PolarHBondContact O-N 2.95Å; R301-H305 PolarHBondContact O-N 3.08Å
302	K	87	Confident	81.7	Confident	82 Å²	82	124.5 Å²	124.5	36%	0.357	57%	0.574	S	S	.	*	H	α-helix	trans	-61.2	-42.3	174.2	-73.1	179.8	-176.7	173.3	0	111.6	E298 I299 L304 H305	E298-K302 HydrophobicContact CG-CD 4.5Å; E298-K302 WeakPolarHBondContact O-CG 3.27Å; E298-K302 PolarHBondContact O-N 3.33Å; E298-K302 WeakPolarHBondContact OE1-CE 3.35Å; E298-K302 IonicContact OE1-NZ 2.76Å; E298-K302 PolarHBondContact OE1-NZ 2.92Å; I299-K302 PolarHBondContact O-N 3.07Å; K302-L304 PolarHBondContact O-N 3.48Å; K302-H305 CarbonylContact O-C 3.28Å; K302-H305 VanDerWaalsContact O-C 3.28Å; K302-H305 PolarHBondContact O-N 3.46Å
303	K	88.1	Confident	79.5	Confident	170 Å²	170	129 Å²	129	74%	0.739	60%	0.595	S	S	*	*	H	α-helix	trans	-63.1	-37.7	175.1	-72.1	-178.2	178.4	-171.3	0	113.4	I299 A300 R301	I299-K303 HydrophobicContact CG2-CD 4.47Å; I299-K303 WeakPolarHBondContact O-CG 3.36Å; I299-K303 PolarHBondContact O-N 2.74Å; A300-K303 PolarHBondContact O-N 3.02Å; R301-K303 VanDerWaalsContact C-N 3.34Å
304	L	87	Confident	76.8	Confident	133 Å²	133	130.9 Å²	130.9	70%	0.696	64%	0.638	S	S	*	*	H	α-helix	trans	-80	-31.8	-179.6	-170.5	66.4	0	0	0	112.8	A300 R301 K302	A300-L304 PolarHBondContact O-N 3.48Å; R301-L304 PolarHBondContact O-N 2.95Å; K302-L304 PolarHBondContact O-N 3.48Å
305	H	80.6	Confident	75.8	Confident	94 Å²	94	128.4 Å²	128.4	44%	0.435	64%	0.636	S	S	.	*			trans	-130	82.1	179.2	-66.5	-71.6	0	0	0	111.1	R301 K302 R307 Y308	R301-H305 PolarHBondContact O-N 3.08Å; K302-H305 CarbonylContact O-C 3.28Å; K302-H305 VanDerWaalsContact O-C 3.28Å; K302-H305 PolarHBondContact O-N 3.46Å; H305-R307 PolarHBondContact O-N 2.85Å; H305-R307 VanDerWaalsContact O-N 3.07Å; H305-Y308 HydrophobicContact CB-CD2 3.49Å; H305-Y308 VanDerWaalsContact CB-CD2 3.49Å; H305-Y308 HydrophobicContact CB-CE2 3.6Å; H305-Y308 PolarHBondContact O-N 3.35Å
306	P	69.8	Low	74.8	Confident	82 Å²	82	127.8 Å²	127.8	53%	0.532	64%	0.637	S	S	.	*	G	3₁₀ helix	trans	-60	-20.9	178.7	-23.4	34	0	0	0	113.6	Y308 E309	P306-Y308 PolarHBondContact O-N 3.31Å; P306-Y308 VanDerWaalsContact O-N 3.08Å; P306-E309 PolarHBondContact O-N 3.29Å
307	R	63.4	Low	73.6	Confident	220 Å²	220	128.3 Å²	128.3	83%	0.83	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-62.8	-13.2	-179.9	-71.1	-163.9	175.5	-177.3	-0.7	115	H305	H305-R307 PolarHBondContact O-N 2.85Å; H305-R307 VanDerWaalsContact O-N 3.07Å
308	Y	59.4	Low	72.3	Confident	114 Å²	114	128.6 Å²	128.6	45%	0.447	64%	0.644	S	S	.	*	G	3₁₀ helix	trans	-87.9	-0.5	177.4	-68.4	-74.6	0	0	0	114.5	H305 P306 T310	H305-Y308 HydrophobicContact CB-CD2 3.49Å; H305-Y308 VanDerWaalsContact CB-CD2 3.49Å; H305-Y308 HydrophobicContact CB-CE2 3.6Å; H305-Y308 PolarHBondContact O-N 3.35Å; P306-Y308 PolarHBondContact O-N 3.31Å; P306-Y308 VanDerWaalsContact O-N 3.08Å; Y308-T310 VanDerWaalsContact C-N 3.35Å
309	E	57.2	Low	71	Confident	133 Å²	133	131.4 Å²	131.4	62%	0.621	66%	0.66	S	S	*	*	S	Bend	trans	-76.2	-22.8	177.4	-70.2	-173.9	160.5	0	0	112.9	P306	P306-E309 PolarHBondContact O-N 3.29Å
310	T	58	Low	69.6	Low	121 Å²	121	135 Å²	135	74%	0.742	68%	0.677	S	S	*	*	S	Bend	trans	-100.5	-4.8	-172.4	36.5	0	0	0	0	116.3	Y308	Y308-T310 VanDerWaalsContact C-N 3.35Å
311	E	58.1	Low	68	Low	150 Å²	150	140.6 Å²	140.6	70%	0.701	69%	0.692	S	S	*	*	S	Bend	trans	-103.9	7.1	-173.4	-71.5	-172.8	165.8	0	0	115.1
312	R	59.8	Low	66.3	Low	198 Å²	198	140.6 Å²	140.6	75%	0.747	71%	0.705	S	S	*	*	S	Bend	trans	-113.7	8.6	178.6	-72.6	-159	-134.6	165.5	6.9	115.8
313	E	52	Low	64.6	Low	195 Å²	195	145.5 Å²	145.5	91%	0.911	73%	0.734	S	S	*	*			trans	-106.5	22	173.3	-71.6	-166.5	157.8	0	0	113.7
314	G	42.1	Very low	62.5	Low	136 Å²	136	143.3 Å²	143.3	100%	1.402	73%	0.733	S	S	*	*			trans	-123.2	0	166.8	0	0	0	0	0	110.8

Retrieved 314 of 314 residues in 50.3 ms (Link to these results)

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