A0A077ZAG7_TRITR Loading...

Trypsin domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZAG7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 339 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	46.8	Very low	46.4	Very low	242 Å²	242	135.8 Å²	135.8	100%	1.192	81%	0.806	S	S	*	*				0	100.1	0	-80.4	-178.5	171.1	0	0	108
2	A	42.3	Very low	46.4	Very low	98 Å²	98	133.6 Å²	133.6	81%	0.81	79%	0.794	S	S	*	*			trans	-92.1	111.8	176.5	0	0	0	0	0	108.3	L4	A2-L4 PolarHBondContact O-N 3.31Å
3	I	41	Very low	46.3	Very low	152 Å²	152	134.8 Å²	134.8	78%	0.779	79%	0.786	S	S	*	*			trans	-81.6	103	179.1	-61.9	172.1	0	0	0	107	I5	I3-I5 HydrophobicContact CG2-CG1 4.3Å; I3-I5 PolarHBondContact O-N 3.19Å
4	L	43	Very low	46.5	Very low	166 Å²	166	135.8 Å²	135.8	87%	0.869	78%	0.784	S	S	*	*			trans	-71.1	103.1	169.1	-97.2	122.4	0	0	0	108.7	A2 A6	A2-L4 PolarHBondContact O-N 3.31Å; L4-A6 PolarHBondContact O-N 3.13Å; L4-A6 VanDerWaalsContact O-N 3.13Å
5	I	47.5	Very low	46.9	Very low	151 Å²	151	134.2 Å²	134.2	77%	0.774	78%	0.777	S	S	*	*			trans	-76.6	95	169.5	-58.8	173.6	0	0	0	106.9	I3 A7	I3-I5 HydrophobicContact CG2-CG1 4.3Å; I3-I5 PolarHBondContact O-N 3.19Å; I5-A7 PolarHBondContact O-N 3.01Å
6	A	49.2	Very low	47.5	Very low	95 Å²	95	128.9 Å²	128.9	79%	0.785	74%	0.743	S	S	*	*			trans	-71.1	96.3	168.6	0	0	0	0	0	108.5	L4 A8	L4-A6 PolarHBondContact O-N 3.13Å; L4-A6 VanDerWaalsContact O-N 3.13Å; A6-A8 PolarHBondContact O-N 3.06Å
7	A	49.5	Very low	49.4	Very low	86 Å²	86	123.4 Å²	123.4	71%	0.711	71%	0.713	S	S	*	*			trans	-68.4	97.4	169.7	0	0	0	0	0	108.7	I5 M9	I5-A7 PolarHBondContact O-N 3.01Å; A7-M9 PolarHBondContact O-N 2.93Å
8	A	48	Very low	51.9	Low	90 Å²	90	117.3 Å²	117.3	74%	0.744	68%	0.679	S	S	*	*			trans	-65.2	100.3	170	0	0	0	0	0	108.5	A6 V10	A6-A8 PolarHBondContact O-N 3.06Å; A8-V10 VanDerWaalsContact C-N 3.31Å; A8-V10 PolarHBondContact O-N 2.99Å
9	M	49.2	Very low	54.3	Low	174 Å²	174	111.2 Å²	111.2	86%	0.857	64%	0.644	S	S	*	*			trans	-65.4	95.5	166.5	-75	-170.4	179	0	0	107.8	A7 I11	A7-M9 PolarHBondContact O-N 2.93Å; M9-I11 VanDerWaalsContact C-N 3.26Å; M9-I11 PolarHBondContact O-N 2.92Å
10	V	46.5	Very low	56.3	Low	119 Å²	119	108.8 Å²	108.8	72%	0.721	63%	0.628	S	S	*	*			trans	-67.6	94.7	164.9	-177.9	0	0	0	0	106	A8 V12	A8-V10 VanDerWaalsContact C-N 3.31Å; A8-V10 PolarHBondContact O-N 2.99Å; V10-V12 HydrophobicContact CG1-CG2 3.84Å; V10-V12 PolarHBondContact O-N 2.85Å
11	I	47.1	Very low	58.2	Low	121 Å²	121	104.1 Å²	104.1	62%	0.621	60%	0.601	S	S	*	*			trans	-67.7	90.2	166.9	-57.8	175.3	0	0	0	105.3	M9 H13	M9-I11 VanDerWaalsContact C-N 3.26Å; M9-I11 PolarHBondContact O-N 2.92Å; I11-H13 PolarHBondContact O-N 2.86Å
12	V	46.4	Very low	60.4	Low	109 Å²	109	95.5 Å²	95.5	66%	0.661	57%	0.569	S	S	*	*			trans	-67.9	89.2	166	-178.1	0	0	0	0	105	V10 I14	V10-V12 HydrophobicContact CG1-CG2 3.84Å; V10-V12 PolarHBondContact O-N 2.85Å; V12-I14 VanDerWaalsContact C-N 3.27Å; V12-I14 PolarHBondContact O-N 2.74Å
13	H	45.3	Very low	62.9	Low	150 Å²	150	93 Å²	93	69%	0.694	54%	0.541	S	S	*	.			trans	-58.4	103.4	162.5	-73.7	-70.2	0	0	0	105.4	I11 V15	I11-H13 PolarHBondContact O-N 2.86Å; H13-V15 PolarHBondContact O-N 2.87Å
14	I	49	Very low	65.3	Low	148 Å²	148	92.5 Å²	92.5	76%	0.759	53%	0.529	S	S	*	.			trans	-63.6	90.6	170.4	-58.5	173	0	0	0	104.1	V12 Q16	V12-I14 VanDerWaalsContact C-N 3.27Å; V12-I14 PolarHBondContact O-N 2.74Å; I14-Q16 PolarHBondContact O-N 2.84Å
15	V	52.2	Low	67.6	Low	112 Å²	112	85 Å²	85	68%	0.679	49%	0.491	S	S	*	.			trans	-61.4	100.5	167.2	179.3	0	0	0	0	103.5	H13 S17	H13-V15 PolarHBondContact O-N 2.87Å; V15-S17 VanDerWaalsContact C-N 3.29Å; V15-S17 PolarHBondContact O-N 2.79Å; V15-S17 PolarHBondContact O-OG 3.43Å
16	Q	56.9	Low	69.4	Low	50 Å²	50	80.6 Å²	80.6	23%	0.234	47%	0.468	C	S	.	.			trans	-62	101.7	-179.3	-164	170.2	-7.6	0	0	105.9	I14	I14-Q16 PolarHBondContact O-N 2.84Å
17	S	80.3	Confident	71	Confident	34 Å²	34	81.1 Å²	81.1	24%	0.238	45%	0.453	C	S	.	.			trans	-69.3	150.4	-176.6	-57.1	0	0	0	0	109.2	V15 R245	V15-S17 VanDerWaalsContact C-N 3.29Å; V15-S17 PolarHBondContact O-N 2.79Å; V15-S17 PolarHBondContact O-OG 3.43Å; S17-R245 PolarHBondContact OG-NH2 3.1Å
18	C	94.9	Very high	72.2	Confident	15 Å²	15	85 Å²	85	10%	0.101	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-44.9	152.6	169.1	65.6	0	0	0	0	113.1	I20 E71 P154 C156	C18-I20 PolarHBondContact O-N 3.23Å; C18-E71 HydrophobicContact CB-CG 3.94Å; C18-E71 WeakPolarHBondContact CB-OE1 3.36Å; C18-E71 PolarHBondContact N-OE1 3.21Å; C18-P154 HydrophobicContact CB-CG 4.21Å; C18-C156 HydrophobicContact CB-CB 3.96Å; C18-C156 WeakPolarHBondContact CB-SG 3.39Å; C18-C156 PolarHBondContact O-SG 3.04Å; C18-C156 WeakPolarHBondContact SG-CA 2.97Å; C18-C156 WeakPolarHBondContact SG-CB 3.49Å; C18-C156 CovalentContact SG-SG 2.05Å; C18-C156 PolarHBondContact SG-SG 3.02Å
19	G	95.8	Very high	73.1	Confident	0 Å²	0	83.7 Å²	83.7	0%	0	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.8	9.7	170.9	0	0	0	0	0	115	P21 P154 R245 Y246	G19-P21 WeakPolarHBondContact O-CD 3.39Å; G19-P154 PolarHBondContact N-O 2.91Å; G19-R245 WeakPolarHBondContact O-CA 3.42Å; G19-Y246 VanDerWaalsContact CA-O 3.24Å; G19-Y246 WeakPolarHBondContact CA-O 3.26Å; G19-Y246 WeakPolarHBondContact O-CD2 3.27Å; G19-Y246 PolarHBondContact O-N 2.68Å
20	I	95.2	Very high	74	Confident	64 Å²	64	78.1 Å²	78.1	33%	0.328	42%	0.415	S	S	.	.			trans	-115.5	96.2	177.1	-55.6	176.4	0	0	0	109.1	C18 R245	C18-I20 PolarHBondContact O-N 3.23Å; I20-R245 HydrophobicContact CD1-CG 4.24Å; I20-R245 HydrophobicContact CG1-CG 3.96Å
21	P	95.2	Very high	74.7	Confident	10 Å²	10	83.4 Å²	83.4	7%	0.065	43%	0.428	C	S	.	.			trans	-77.3	146.3	176.1	33.3	-34.8	0	0	0	110.6	G19 I23 P49 W50 Y246	G19-P21 WeakPolarHBondContact O-CD 3.39Å; P21-I23 WeakPolarHBondContact CB-O 3.3Å; P21-I23 PolarHBondContact O-N 3.06Å; P21-P49 HydrophobicContact CB-CG 3.71Å; P21-W50 HydrophobicContact CB-CH2 4.22Å; P21-W50 HydrophobicContact CB-CZ3 3.9Å; P21-W50 HydrophobicContact CG-CH2 3.99Å; P21-W50 HydrophobicContact CG-CZ3 4.01Å; P21-Y246 HydrophobicContact CG-CD2 4.25Å; P21-Y246 HydrophobicContact CG-CE2 4.14Å
22	A	94.7	Very high	74.9	Confident	62 Å²	62	82.2 Å²	82.2	51%	0.512	44%	0.436	S	S	.	.	S	Bend	trans	-63.8	-31.1	174	0	0	0	0	0	112
23	I	94	Very high	75.1	Confident	44 Å²	44	79.8 Å²	79.8	23%	0.226	42%	0.424	C	S	.	.	S	Bend	trans	-116.3	117.3	176.2	-57.6	174.1	0	0	0	107.6	P21 K44 P45 H46 S47	P21-I23 WeakPolarHBondContact CB-O 3.3Å; P21-I23 PolarHBondContact O-N 3.06Å; I23-K44 HydrophobicContact CG2-CD 3.53Å; I23-K44 VanDerWaalsContact CG2-CE 3.43Å; I23-K44 HydrophobicContact CG2-CG 3.96Å; I23-P45 WeakPolarHBondContact CD1-O 3.33Å; I23-H46 HydrophobicContact CD1-CB 4.26Å; I23-S47 VanDerWaalsContact O-CA 3.24Å; I23-S47 WeakPolarHBondContact O-CA 3.19Å; I23-S47 WeakPolarHBondContact O-CB 3.38Å
24	R	92	Very high	75.2	Confident	142 Å²	142	78 Å²	78	54%	0.536	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-70.1	138.5	179.5	-70.3	-173	174.9	-106	-0.1	111.8	E241	R24-E241 IonicContact NH1-OE1 2.95Å; R24-E241 PolarHBondContact NH1-OE1 3.17Å
25	P	90.2	Very high	75.1	Confident	9 Å²	9	74.1 Å²	74.1	6%	0.058	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-56.6	150.5	169.9	-24.8	33.1	0	0	0	112.3	S47 L48 F171 Y246	P25-S47 WeakPolarHBondContact CG-O 3.32Å; P25-L48 HydrophobicContact CB-CD2 4.24Å; P25-L48 HydrophobicContact CG-CD2 3.73Å; P25-F171 HydrophobicContact CB-CE1 4.45Å; P25-Y246 WeakPolarHBondContact CD-OH 3.43Å; P25-Y246 HydrophobicContact CG-CE1 4.44Å; P25-Y246 HydrophobicContact CG-CE2 4.17Å
26	L	86.2	Confident	74.7	Confident	59 Å²	59	73.5 Å²	73.5	31%	0.309	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-70.6	137.9	168.9	-65.2	176	0	0	0	108.7	P30 W41 K44	L26-P30 HydrophobicContact CD1-CG 4.14Å; L26-W41 WeakPolarHBondContact O-CZ2 3.49Å; L26-K44 HydrophobicContact CD1-CB 4.5Å; L26-K44 HydrophobicContact CG-CB 4.23Å
27	K	81.7	Confident	74.1	Confident	106 Å²	106	73.1 Å²	73.1	46%	0.461	39%	0.391	S	S	.	.	S	Bend	trans	-94.1	-8.8	173	-61.4	-170.2	175.5	-172.4	0	112.8	F171 L191 E241	K27-F171 HydrophobicContact CG-CZ 4.33Å; K27-L191 VanDerWaalsContact O-CD2 3.24Å; K27-L191 WeakPolarHBondContact O-CD2 3.44Å; K27-E241 WeakPolarHBondContact CE-OE2 3.41Å; K27-E241 IonicContact NZ-OE2 3.73Å; K27-E241 PolarHBondContact NZ-OE2 2.81Å
28	K	75.2	Confident	72.4	Confident	168 Å²	168	74 Å²	74	73%	0.73	40%	0.395	S	S	*	.	S	Bend	trans	-144.2	146.1	-178	-64.9	-176.6	-178.2	178.6	0	108.3
29	P	68.2	Low	70.3	Confident	62 Å²	62	77.5 Å²	77.5	40%	0.403	41%	0.413	S	S	.	.			trans	-60.3	144	177.3	24	-31.6	0	0	0	110.4	K31 W41	P29-K31 PolarHBondContact O-N 3.38Å; P29-W41 HydrophobicContact CB-CB 4.27Å; P29-W41 HydrophobicContact CB-CD2 4.02Å; P29-W41 HydrophobicContact CB-CE3 3.65Å; P29-W41 HydrophobicContact CB-CG 4.3Å; P29-W41 HydrophobicContact CB-CZ3 4.31Å; P29-W41 HydrophobicContact CG-CE3 4.13Å; P29-W41 HydrophobicContact CG-CZ3 4.33Å
30	P	67.3	Low	68.8	Low	57 Å²	57	77.5 Å²	77.5	37%	0.37	41%	0.413	S	S	.	.			trans	-61	136.7	172.8	5.4	-2	0	0	0	110	L26 A32 S33	L26-P30 HydrophobicContact CD1-CG 4.14Å; P30-A32 PolarHBondContact O-N 2.91Å; P30-S33 PolarHBondContact O-N 3.05Å
31	K	61.2	Low	67.8	Low	229 Å²	229	74.9 Å²	74.9	100%	0.996	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-16	-175.3	-74.3	-175	177.2	-179.8	0	115.2	P29	P29-K31 PolarHBondContact O-N 3.38Å
32	A	52	Low	67.3	Low	97 Å²	97	77.7 Å²	77.7	80%	0.802	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.2	13.4	-166.8	0	0	0	0	0	115.2	P30	P30-A32 PolarHBondContact O-N 2.91Å
33	S	50	Low	67	Low	57 Å²	57	74.8 Å²	74.8	40%	0.399	39%	0.387	S	S	.	.			trans	-101	125	176.5	-173.1	0	0	0	0	111	P30 N35	P30-S33 PolarHBondContact O-N 3.05Å; S33-N35 VanDerWaalsContact C-N 3.33Å; S33-N35 PolarHBondContact O-N 2.67Å
34	P	47.5	Very low	66.9	Low	114 Å²	114	77.4 Å²	77.4	74%	0.74	40%	0.397	S	S	*	.			trans	-61.9	99.2	163.5	24.9	-29.3	0	0	0	108.3	R36	P34-R36 PolarHBondContact O-N 3.16Å; P34-R36 VanDerWaalsContact O-N 3.16Å
35	N	46	Very low	66.9	Low	66 Å²	66	73.8 Å²	73.8	35%	0.353	39%	0.392	S	S	.	.			trans	-56.5	119.1	-179.8	-92.1	-2.8	0	0	0	110.4	S33 I37 G40	S33-N35 VanDerWaalsContact C-N 3.33Å; S33-N35 PolarHBondContact O-N 2.67Å; N35-I37 VanDerWaalsContact C-N 3.3Å; N35-G40 PolarHBondContact ND2-O 3.31Å; N35-G40 VanDerWaalsContact ND2-O 3.08Å; N35-G40 PolarHBondContact OD1-O 2.05Å
36	R	44.4	Very low	67	Low	98 Å²	98	74.9 Å²	74.9	37%	0.37	40%	0.396	S	S	.	.	S	Bend	trans	-79.5	-14.5	175.7	-71.2	-177.9	-79.6	167.8	-6.5	112.7	P34 E42	P34-R36 PolarHBondContact O-N 3.16Å; P34-R36 VanDerWaalsContact O-N 3.16Å; R36-E42 IonicContact NH2-OE2 2.98Å; R36-E42 PolarHBondContact NH2-OE2 3.24Å
37	I	44.6	Very low	67.4	Low	42 Å²	42	72.1 Å²	72.1	22%	0.215	38%	0.381	C	S	.	.	S	Bend	trans	-122.6	135.9	-179	-68.6	162.7	0	0	0	108.8	N35 N39 G40 T178 Q188	N35-I37 VanDerWaalsContact C-N 3.3Å; I37-N39 PolarHBondContact O-N 2.8Å; I37-N39 VanDerWaalsContact O-N 3.1Å; I37-G40 PolarHBondContact O-N 3.4Å; I37-G40 VanDerWaalsContact O-O 3.13Å; I37-T178 HydrophobicContact CD1-CG2 4.07Å; I37-T178 HydrophobicContact CG1-CG2 3.68Å; I37-Q188 HydrophobicContact CD1-CB 3.11Å; I37-Q188 HydrophobicContact CD1-CG 3.27Å
38	V	43.3	Very low	68.1	Low	54 Å²	54	67.4 Å²	67.4	33%	0.327	36%	0.361	S	S	.	.	S	Bend	trans	-62.4	115.9	172.5	171.8	0	0	0	0	108.8	G40 E179	V38-G40 PolarHBondContact O-N 3.25Å; V38-G40 VanDerWaalsContact O-N 3.13Å; V38-E179 WeakPolarHBondContact CG2-OE1 3.28Å
39	N	52.1	Low	69.1	Low	88 Å²	88	59.5 Å²	59.5	47%	0.471	33%	0.327	S	S	.	.	S	Bend	trans	67.6	-11.2	-174.1	-55.9	-33.2	0	0	0	117	I37 W41 V190	I37-N39 PolarHBondContact O-N 2.8Å; I37-N39 VanDerWaalsContact O-N 3.1Å; N39-W41 VanDerWaalsContact O-CZ3 3.28Å; N39-W41 WeakPolarHBondContact O-CZ3 3.4Å; N39-V190 HydrophobicContact CB-CG2 3.95Å; N39-V190 WeakPolarHBondContact O-CG2 3.11Å
40	G	64.5	Low	70.5	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	161.5	174.5	0	0	0	0	0	112.9	N35 I37 V38 D189	N35-G40 PolarHBondContact ND2-O 3.31Å; N35-G40 VanDerWaalsContact ND2-O 3.08Å; N35-G40 PolarHBondContact OD1-O 2.05Å; I37-G40 PolarHBondContact O-N 3.4Å; I37-G40 VanDerWaalsContact O-O 3.13Å; V38-G40 PolarHBondContact O-N 3.25Å; V38-G40 VanDerWaalsContact O-N 3.13Å; G40-D189 CarbonylContact C-O 3.55Å; G40-D189 WeakPolarHBondContact CA-O 3.42Å
41	W	74.7	Confident	71.9	Confident	8 Å²	8	54 Å²	54	3%	0.03	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	170.4	172	50.6	85.8	0	0	0	109.2	L26 P29 N39 A43 Q188 D189 L191	L26-W41 WeakPolarHBondContact O-CZ2 3.49Å; P29-W41 HydrophobicContact CB-CB 4.27Å; P29-W41 HydrophobicContact CB-CD2 4.02Å; P29-W41 HydrophobicContact CB-CE3 3.65Å; P29-W41 HydrophobicContact CB-CG 4.3Å; P29-W41 HydrophobicContact CB-CZ3 4.31Å; P29-W41 HydrophobicContact CG-CE3 4.13Å; P29-W41 HydrophobicContact CG-CZ3 4.33Å; N39-W41 VanDerWaalsContact O-CZ3 3.28Å; N39-W41 WeakPolarHBondContact O-CZ3 3.4Å; W41-A43 PolarHBondContact O-N 3.4Å; W41-Q188 WeakPolarHBondContact O-CA 3.38Å; W41-Q188 PolarHBondContact O-OE1 3.11Å; W41-D189 PolarHBondContact N-O 3.44Å; W41-D189 PolarHBondContact NE1-OD1 3.03Å; W41-D189 PolarHBondContact NE1-OD2 3.21Å; W41-D189 PolarHBondContact O-N 3.42Å; W41-D189 VanDerWaalsContact O-OD1 3.11Å; W41-L191 HydrophobicContact CH2-CB 3.53Å; W41-L191 HydrophobicContact CZ2-CB 4.29Å; W41-L191 HydrophobicContact CZ3-CB 4.34Å
42	E	84	Confident	73.6	Confident	70 Å²	70	43 Å²	43	33%	0.327	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	126.4	169.1	-178	170.7	152.4	0	0	108.7	R36 H107 A186	R36-E42 IonicContact NH2-OE2 2.98Å; R36-E42 PolarHBondContact NH2-OE2 3.24Å; E42-H107 IonicContact OE1-CE1 3.69Å; E42-H107 IonicContact OE1-NE2 2.64Å; E42-H107 PolarHBondContact OE1-NE2 3.37Å; E42-A186 HydrophobicContact CG-CB 4.04Å; E42-A186 WeakPolarHBondContact OE1-CB 3.25Å
43	A	87.7	Confident	75.4	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.008	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-57.5	146.1	178.5	0	0	0	0	0	109.3	W41 L48 H107 L187 D189	W41-A43 PolarHBondContact O-N 3.4Å; A43-L48 HydrophobicContact CB-CD1 3.85Å; A43-L48 HydrophobicContact CB-CG 4.34Å; A43-H107 PolarHBondContact O-CE1 2.84Å; A43-L187 HydrophobicContact CB-CD2 4.3Å; A43-L187 HydrophobicContact CB-CG 4.26Å; A43-L187 PolarHBondContact N-O 3.35Å; A43-D189 VanDerWaalsContact CA-OD1 3.28Å; A43-D189 WeakPolarHBondContact CA-OD1 3.43Å; A43-D189 HydrophobicContact CB-CB 4.18Å; A43-D189 PolarHBondContact N-OD1 3.22Å
44	K	91.5	Very high	77.4	Confident	99 Å²	99	37.7 Å²	37.7	43%	0.43	20%	0.196	S	C	.	.	P	Polyproline II helix	trans	-59.9	131.3	171.1	179.7	175.8	177.8	-175	0	107.5	I23 L26 H46 S47	I23-K44 HydrophobicContact CG2-CD 3.53Å; I23-K44 VanDerWaalsContact CG2-CE 3.43Å; I23-K44 HydrophobicContact CG2-CG 3.96Å; L26-K44 HydrophobicContact CD1-CB 4.5Å; L26-K44 HydrophobicContact CG-CB 4.23Å; K44-H46 PolarHBondContact O-N 2.94Å; K44-S47 VanDerWaalsContact O-CB 3.23Å; K44-S47 WeakPolarHBondContact O-CB 3.07Å; K44-S47 PolarHBondContact O-N 2.91Å; K44-S47 PolarHBondContact O-OG 2.82Å
45	P	92.1	Very high	79.3	Confident	65 Å²	65	35 Å²	35	42%	0.422	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.9	127.3	-175.9	-31.7	35.5	0	0	0	112.6	I23 S47 H107	I23-P45 WeakPolarHBondContact CD1-O 3.33Å; P45-S47 PolarHBondContact O-N 3.01Å; P45-H107 HydrophobicContact CB-CB 4.47Å
46	H	93	Very high	81.2	Confident	33 Å²	33	31.9 Å²	31.9	15%	0.153	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	17	-178.4	-45.4	-77.5	0	0	0	115.7	I23 K44 L48 G105 D114 H151	I23-H46 HydrophobicContact CD1-CB 4.26Å; K44-H46 PolarHBondContact O-N 2.94Å; H46-L48 PolarHBondContact O-N 3.29Å; H46-G105 PolarHBondContact ND1-O 2.91Å; H46-D114 IonicContact CE1-OD2 2.77Å; H46-D114 IonicContact NE2-OD2 3.49Å; H46-H151 HydrophobicContact CB-CB 4.18Å; H46-H151 VanDerWaalsContact CB-CD2 3.49Å; H46-H151 WeakPolarHBondContact CB-CD2 3.47Å; H46-H151 AromaticContact CD2-CD2 3.88Å; H46-H151 AromaticContact CD2-NE2 3.97Å; H46-H151 AromaticContact CG-CD2 3.43Å; H46-H151 VanDerWaalsContact CG-CD2 3.43Å; H46-H151 AromaticContact CG-CG 3.65Å; H46-H151 AromaticContact CG-NE2 4Å; H46-H151 AromaticContact ND1-CD2 3.83Å; H46-H151 AromaticContact ND1-CG 3.53Å; H46-H151 AromaticContact ND1-ND1 3.94Å
47	S	94.9	Very high	83	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.151	C	C	.	.	S	Bend	trans	-76.3	-10.9	174.8	72.1	0	0	0	0	114.4	I23 P25 K44 P45 P49	I23-S47 VanDerWaalsContact O-CA 3.24Å; I23-S47 WeakPolarHBondContact O-CA 3.19Å; I23-S47 WeakPolarHBondContact O-CB 3.38Å; P25-S47 WeakPolarHBondContact CG-O 3.32Å; K44-S47 VanDerWaalsContact O-CB 3.23Å; K44-S47 WeakPolarHBondContact O-CB 3.07Å; K44-S47 PolarHBondContact O-N 2.91Å; K44-S47 PolarHBondContact O-OG 2.82Å; P45-S47 PolarHBondContact O-N 3.01Å; S47-P49 VanDerWaalsContact O-CD 3.26Å; S47-P49 WeakPolarHBondContact O-CD 3.38Å
48	L	95.7	Very high	84.3	Confident	8 Å²	8	28.7 Å²	28.7	4%	0.042	15%	0.148	C	C	.	.			trans	-119.2	62.5	178.5	-58.3	-179.2	0	0	0	110.5	P25 A43 H46 W50 M51 A173 L187 D189 F239	P25-L48 HydrophobicContact CB-CD2 4.24Å; P25-L48 HydrophobicContact CG-CD2 3.73Å; A43-L48 HydrophobicContact CB-CD1 3.85Å; A43-L48 HydrophobicContact CB-CG 4.34Å; H46-L48 PolarHBondContact O-N 3.29Å; L48-W50 HydrophobicContact CD2-CH2 4.49Å; L48-W50 HydrophobicContact CD2-CZ2 3.58Å; L48-W50 PolarHBondContact O-N 2.74Å; L48-M51 HydrophobicContact CB-CG 3.78Å; L48-M51 WeakPolarHBondContact O-CG 3.24Å; L48-M51 PolarHBondContact O-N 2.71Å; L48-M51 VanDerWaalsContact O-N 3.14Å; L48-A173 HydrophobicContact CD1-CB 3.45Å; L48-A173 VanDerWaalsContact CD1-CB 3.45Å; L48-L187 HydrophobicContact CB-CD2 3.76Å; L48-L187 HydrophobicContact CD1-CD2 3.71Å; L48-L187 HydrophobicContact CD1-CG 4.32Å; L48-L187 HydrophobicContact CG-CD2 4.23Å; L48-D189 HydrophobicContact CD1-CB 3.84Å; L48-F239 HydrophobicContact CD1-CZ 4.43Å; L48-F239 HydrophobicContact CD2-CE2 3.86Å; L48-F239 HydrophobicContact CD2-CZ 3.54Å
49	P	96.7	Very high	86	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.006	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-4.7	-167.8	34	-41.9	0	0	0	114.4	P21 S47 H151 I152 S153	P21-P49 HydrophobicContact CB-CG 3.71Å; S47-P49 VanDerWaalsContact O-CD 3.26Å; S47-P49 WeakPolarHBondContact O-CD 3.38Å; P49-H151 VanDerWaalsContact CA-O 3.32Å; P49-H151 WeakPolarHBondContact CA-O 3.34Å; P49-H151 VanDerWaalsContact CB-O 3.29Å; P49-H151 WeakPolarHBondContact CB-O 3.17Å; P49-I152 WeakPolarHBondContact O-CA 3.37Å; P49-S153 CarbonylContact C-O 3.59Å; P49-S153 WeakPolarHBondContact CG-OG 3.49Å; P49-S153 PolarHBondContact O-N 2.8Å; P49-S153 VanDerWaalsContact O-N 3.12Å
50	W	98	Very high	87.1	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-16.2	174.8	40.9	81.7	0	0	0	113.4	P21 L48 F68 L69 S153 L155 F239 Y246	P21-W50 HydrophobicContact CB-CH2 4.22Å; P21-W50 HydrophobicContact CB-CZ3 3.9Å; P21-W50 HydrophobicContact CG-CH2 3.99Å; P21-W50 HydrophobicContact CG-CZ3 4.01Å; L48-W50 HydrophobicContact CD2-CH2 4.49Å; L48-W50 HydrophobicContact CD2-CZ2 3.58Å; L48-W50 PolarHBondContact O-N 2.74Å; W50-F68 HydrophobicContact CB-CB 4.49Å; W50-F68 CarbonylContact O-C 3.59Å; W50-F68 WeakPolarHBondContact O-CA 3.32Å; W50-L69 PolarHBondContact O-N 2.85Å; W50-S153 WeakPolarHBondContact CA-O 3.36Å; W50-S153 VanDerWaalsContact CB-O 3.25Å; W50-S153 WeakPolarHBondContact CB-O 3.35Å; W50-S153 PolarHBondContact N-O 2.98Å; W50-S153 VanDerWaalsContact N-O 3.16Å; W50-L155 HydrophobicContact CB-CD1 4.27Å; W50-L155 HydrophobicContact CB-CG 3.82Å; W50-L155 HydrophobicContact CD2-CD1 4.22Å; W50-L155 HydrophobicContact CD2-CD2 3.6Å; W50-L155 HydrophobicContact CD2-CG 3.59Å; W50-L155 HydrophobicContact CE3-CD2 3.87Å; W50-L155 HydrophobicContact CE3-CG 4.1Å; W50-L155 HydrophobicContact CG-CD1 3.77Å; W50-L155 HydrophobicContact CG-CD2 4.02Å; W50-L155 HydrophobicContact CG-CG 3.45Å; W50-L155 VanDerWaalsContact CG-CG 3.45Å; W50-L155 HydrophobicContact CH2-CD2 4.28Å; W50-L155 HydrophobicContact CZ2-CD2 4.03Å; W50-L155 HydrophobicContact CZ3-CD2 4.2Å; W50-F239 AromaticContact CZ2-CD2 3.8Å; W50-F239 HydrophobicContact CZ2-CD2 3.8Å; W50-F239 AromaticContact CZ2-CE2 3.51Å; W50-F239 HydrophobicContact CZ2-CE2 3.51Å; W50-F239 HydrophobicContact CZ2-CZ 4.12Å; W50-F239 AromaticContact NE1-CZ 3.96Å; W50-Y246 HydrophobicContact CH2-CD1 4.48Å; W50-Y246 AromaticContact CH2-CD2 3.69Å; W50-Y246 HydrophobicContact CH2-CD2 3.69Å; W50-Y246 HydrophobicContact CH2-CE2 4.33Å; W50-Y246 AromaticContact CH2-CG 3.77Å; W50-Y246 HydrophobicContact CH2-CG 3.77Å; W50-Y246 HydrophobicContact CZ2-CG 4.31Å; W50-Y246 HydrophobicContact CZ3-CD2 4.35Å
51	M	96.6	Very high	87.6	Confident	3 Å²	3	41.2 Å²	41.2	2%	0.015	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	138.4	-172.6	-66.6	-62.6	-63.7	0	0	111.6	L48 A173 W175 L187 P237	L48-M51 HydrophobicContact CB-CG 3.78Å; L48-M51 WeakPolarHBondContact O-CG 3.24Å; L48-M51 PolarHBondContact O-N 2.71Å; L48-M51 VanDerWaalsContact O-N 3.14Å; M51-A173 HydrophobicContact CE-CB 4.26Å; M51-A173 WeakPolarHBondContact CE-O 3.39Å; M51-A173 HydrophobicContact SD-CB 4.34Å; M51-W175 HydrophobicContact CB-CH2 3.53Å; M51-W175 HydrophobicContact CB-CZ2 4.39Å; M51-W175 HydrophobicContact CB-CZ3 4.06Å; M51-W175 HydrophobicContact CE-CZ3 4.08Å; M51-L187 HydrophobicContact CB-CD2 4.29Å; M51-L187 HydrophobicContact CE-CD1 4.26Å; M51-L187 HydrophobicContact CG-CD1 4.49Å; M51-L187 HydrophobicContact CG-CD2 4.02Å; M51-P237 HydrophobicContact SD-CG 3.79Å
52	V	96.6	Very high	87.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	125.7	178.7	-178.8	0	0	0	0	108.9	I54 S66 G67 L69 V81 F102 V104	V52-I54 HydrophobicContact CG1-CG1 4.37Å; V52-S66 CarbonylContact O-C 3.6Å; V52-S66 WeakPolarHBondContact O-CA 3.32Å; V52-G67 PolarHBondContact N-O 2.92Å; V52-G67 PolarHBondContact O-N 2.97Å; V52-L69 HydrophobicContact CG2-CD2 3.93Å; V52-L69 HydrophobicContact CG2-CG 3.87Å; V52-V81 HydrophobicContact CB-CG1 4.3Å; V52-V81 HydrophobicContact CG1-CG1 4.33Å; V52-V81 HydrophobicContact CG1-CG2 4.34Å; V52-V81 HydrophobicContact CG2-CG1 4.39Å; V52-V81 HydrophobicContact CG2-CG2 4.16Å; V52-F102 HydrophobicContact CG1-CB 4.02Å; V52-F102 HydrophobicContact CG1-CD1 3.89Å; V52-F102 HydrophobicContact CG1-CG 4.46Å; V52-V104 HydrophobicContact CG1-CG2 4.15Å; V52-V104 HydrophobicContact CG2-CG1 4.47Å; V52-V104 HydrophobicContact CG2-CG2 4.17Å
53	M	90	Very high	87.5	Confident	41 Å²	41	43.5 Å²	43.5	20%	0.202	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	133.6	167	-177.6	-175.9	-173.6	0	0	109	T64 F102 L103 V109 W175	M53-T64 HydrophobicContact CE-CG2 3.85Å; M53-F102 WeakPolarHBondContact O-CA 3.46Å; M53-L103 HydrophobicContact CB-CB 4.2Å; M53-L103 PolarHBondContact N-O 3.17Å; M53-L103 PolarHBondContact O-N 3.37Å; M53-V109 HydrophobicContact SD-CB 4.14Å; M53-V109 HydrophobicContact SD-CG1 3.54Å; M53-V109 VanDerWaalsContact SD-CG1 3.54Å; M53-W175 HydrophobicContact CB-CE3 4.06Å; M53-W175 HydrophobicContact CB-CH2 4.36Å; M53-W175 HydrophobicContact CB-CZ3 3.97Å
54	I	91.9	Very high	87.2	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.8	179.7	-49.9	-179.7	0	0	0	108.3	V52 L56 T64 C65 S66 V81 T83 F102 I140	V52-I54 HydrophobicContact CG1-CG1 4.37Å; I54-L56 HydrophobicContact CG2-CD1 3.61Å; I54-L56 HydrophobicContact CG2-CG 4.42Å; I54-T64 WeakPolarHBondContact O-CA 3.36Å; I54-C65 HydrophobicContact CB-CB 4.24Å; I54-C65 PolarHBondContact N-O 3.46Å; I54-C65 PolarHBondContact O-N 3Å; I54-S66 WeakPolarHBondContact CD1-O 3.31Å; I54-V81 HydrophobicContact CD1-CG1 4.47Å; I54-T83 HydrophobicContact CD1-CG2 3.83Å; I54-T83 WeakPolarHBondContact CD1-OG1 3.41Å; I54-F102 HydrophobicContact CB-CE1 4.36Å; I54-F102 HydrophobicContact CD1-CD1 4.45Å; I54-F102 HydrophobicContact CD1-CE1 4.01Å; I54-F102 HydrophobicContact CG1-CD1 3.9Å; I54-F102 HydrophobicContact CG1-CE1 3.86Å; I54-F102 HydrophobicContact CG2-CD1 4.28Å; I54-F102 HydrophobicContact CG2-CE1 3.76Å; I54-F102 HydrophobicContact CG2-CZ 4.17Å; I54-I140 HydrophobicContact CD1-CD1 4.34Å
55	L	87.3	Confident	87.2	Confident	59 Å²	59	40.3 Å²	40.3	31%	0.309	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	121.9	173.8	179.4	70.2	0	0	0	109	Y62 T64 F101	L55-Y62 HydrophobicContact CD1-CD1 4.14Å; L55-Y62 HydrophobicContact CD1-CG 4.43Å; L55-Y62 HydrophobicContact CG-CD1 4.48Å; L55-T64 HydrophobicContact CD1-CG2 3.93Å; L55-F101 HydrophobicContact CB-CB 4.3Å; L55-F101 PolarHBondContact N-O 3.42Å; L55-F101 PolarHBondContact O-N 3.12Å
56	L	86	Confident	87.1	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	134	174	-66.8	98.1	0	0	0	110.8	I54 Y62 V63 C87 L88 Q95 N99 M100	I54-L56 HydrophobicContact CG2-CD1 3.61Å; I54-L56 HydrophobicContact CG2-CG 4.42Å; L56-Y62 CarbonylContact O-C 3.57Å; L56-Y62 VanDerWaalsContact O-CA 3.3Å; L56-Y62 WeakPolarHBondContact O-CA 3.11Å; L56-V63 HydrophobicContact CB-CB 4.46Å; L56-V63 PolarHBondContact N-O 2.84Å; L56-V63 PolarHBondContact O-N 2.84Å; L56-C87 WeakPolarHBondContact CD1-O 3.33Å; L56-C87 WeakPolarHBondContact CD2-O 3.19Å; L56-L88 HydrophobicContact CD1-CD2 4.35Å; L56-L88 HydrophobicContact CD2-CD2 3.83Å; L56-Q95 HydrophobicContact CD2-CB 4.08Å; L56-Q95 HydrophobicContact CD2-CG 4.32Å; L56-N99 WeakPolarHBondContact CA-O 3.26Å; L56-M100 HydrophobicContact CD2-CE 4.12Å; L56-M100 HydrophobicContact CD2-CG 3.92Å; L56-M100 HydrophobicContact CG-CG 4.24Å
57	T	81	Confident	87.3	Confident	35 Å²	35	35.7 Å²	35.7	22%	0.215	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	124.9	171.9	62.9	0	0	0	0	110.2	Y62 N99 F101	T57-Y62 HydrophobicContact CG2-CD1 3.77Å; T57-Y62 HydrophobicContact CG2-CE1 3.6Å; T57-N99 PolarHBondContact N-O 3.49Å; T57-N99 WeakPolarHBondContact O-CB 3.25Å; T57-N99 PolarHBondContact O-ND2 2.73Å; T57-N99 WeakPolarHBondContact OG1-CB 3.44Å; T57-N99 PolarHBondContact OG1-O 3.05Å; T57-F101 HydrophobicContact CG2-CD2 4.3Å; T57-F101 HydrophobicContact CG2-CE2 3.81Å
58	Y	73.7	Confident	87.5	Confident	37 Å²	37	35.7 Å²	35.7	15%	0.145	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	105.3	177.1	173.4	-114.6	0	0	0	110	R60 R61 I90 E91 Q95	Y58-R60 PolarHBondContact O-N 3.26Å; Y58-R60 VanDerWaalsContact O-N 3.15Å; Y58-R61 PolarHBondContact N-O 3.4Å; Y58-R61 WeakPolarHBondContact O-CA 3.08Å; Y58-R61 WeakPolarHBondContact O-CB 3.24Å; Y58-R61 PolarHBondContact O-N 3.26Å; Y58-I90 HydrophobicContact CD1-CG2 3.95Å; Y58-I90 HydrophobicContact CE1-CG2 4.12Å; Y58-I90 HydrophobicContact CG-CG2 4.34Å; Y58-E91 HydrophobicContact CE1-CG 4.45Å; Y58-E91 VanDerWaalsContact CE1-OE2 3.26Å; Y58-E91 WeakPolarHBondContact CE1-OE2 3.47Å; Y58-E91 PolarHBondContact OH-OE2 3.24Å; Y58-Q95 VanDerWaalsContact CD2-OE1 3.25Å
59	G	77.6	Confident	87.6	Confident	63 Å²	63	35.3 Å²	35.3	65%	0.649	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.4	-117.6	-170.9	0	0	0	0	0	111.2
60	R	75.6	Confident	87.7	Confident	245 Å²	245	35.3 Å²	35.3	93%	0.925	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99	6.4	174.1	-63.4	-175.8	179.1	173	-0.2	113.6	Y58	Y58-R60 PolarHBondContact O-N 3.26Å; Y58-R60 VanDerWaalsContact O-N 3.15Å
61	R	74.2	Confident	87.6	Confident	97 Å²	97	38.9 Å²	38.9	37%	0.366	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	157.4	-177.8	-60	-179.5	-178.5	163.5	0.3	110.1	Y58 E91	Y58-R61 PolarHBondContact N-O 3.4Å; Y58-R61 WeakPolarHBondContact O-CA 3.08Å; Y58-R61 WeakPolarHBondContact O-CB 3.24Å; Y58-R61 PolarHBondContact O-N 3.26Å; R61-E91 IonicContact NH1-OE1 2.95Å; R61-E91 PolarHBondContact NH1-OE1 3.24Å
62	Y	76.9	Confident	87.5	Confident	126 Å²	126	39.2 Å²	39.2	49%	0.494	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	142.6	172.3	-57.1	-87.3	0	0	0	109.1	L55 L56 T57	L55-Y62 HydrophobicContact CD1-CD1 4.14Å; L55-Y62 HydrophobicContact CD1-CG 4.43Å; L55-Y62 HydrophobicContact CG-CD1 4.48Å; L56-Y62 CarbonylContact O-C 3.57Å; L56-Y62 VanDerWaalsContact O-CA 3.3Å; L56-Y62 WeakPolarHBondContact O-CA 3.11Å; T57-Y62 HydrophobicContact CG2-CD1 3.77Å; T57-Y62 HydrophobicContact CG2-CE1 3.6Å
63	V	80.4	Confident	87.2	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	132.5	170.2	175	0	0	0	0	107.9	L56 I90 W230	L56-V63 HydrophobicContact CB-CB 4.46Å; L56-V63 PolarHBondContact N-O 2.84Å; L56-V63 PolarHBondContact O-N 2.84Å; V63-I90 HydrophobicContact CB-CD1 4.02Å; V63-I90 HydrophobicContact CG2-CD1 3.64Å; V63-I90 HydrophobicContact CG2-CG1 4.48Å; V63-W230 HydrophobicContact CG1-CE3 3.81Å; V63-W230 HydrophobicContact CG1-CZ3 4.35Å
64	T	82	Confident	87.4	Confident	32 Å²	32	43.5 Å²	43.5	20%	0.196	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	131.5	176.3	52.1	0	0	0	0	110.1	M53 I54 L55	M53-T64 HydrophobicContact CE-CG2 3.85Å; I54-T64 WeakPolarHBondContact O-CA 3.36Å; L55-T64 HydrophobicContact CD1-CG2 3.93Å
65	C	90.3	Very high	87.4	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.007	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	176.4	172.2	-85.7	0	0	0	0	110.1	I54 C87 G232 S234	I54-C65 HydrophobicContact CB-CB 4.24Å; I54-C65 PolarHBondContact N-O 3.46Å; I54-C65 PolarHBondContact O-N 3Å; C65-C87 HydrophobicContact CB-CB 3.65Å; C65-C87 WeakPolarHBondContact CB-SG 3.47Å; C65-C87 WeakPolarHBondContact SG-CB 3.38Å; C65-C87 CovalentContact SG-SG 2.03Å; C65-C87 PolarHBondContact SG-SG 3.18Å; C65-G232 CarbonylContact C-O 3.43Å; C65-G232 WeakPolarHBondContact CA-O 3.28Å; C65-S234 WeakPolarHBondContact CB-O 3.43Å
66	S	91.6	Very high	87.8	Confident	1 Å²	1	53 Å²	53	1%	0.007	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	162	172.9	-67.6	0	0	0	0	110.4	V52 I54 T83 G232 S234 G235	V52-S66 CarbonylContact O-C 3.6Å; V52-S66 WeakPolarHBondContact O-CA 3.32Å; I54-S66 WeakPolarHBondContact CD1-O 3.31Å; S66-T83 PolarHBondContact O-OG1 3.32Å; S66-G232 WeakPolarHBondContact CB-O 3.33Å; S66-G232 PolarHBondContact N-O 2.64Å; S66-G232 VanDerWaalsContact N-O 3.13Å; S66-G232 PolarHBondContact OG-O 3.24Å; S66-S234 PolarHBondContact N-O 2.82Å; S66-G235 CarbonylContact O-C 3.58Å; S66-G235 VanDerWaalsContact O-CA 3.29Å; S66-G235 WeakPolarHBondContact O-CA 3.22Å
67	G	97	Very high	88.2	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	-175.1	170.8	0	0	0	0	0	109.7	V52 L82	V52-G67 PolarHBondContact N-O 2.92Å; V52-G67 PolarHBondContact O-N 2.97Å; G67-L82 CarbonylContact C-O 3.17Å; G67-L82 WeakPolarHBondContact CA-O 3.43Å
68	F	98.6	Very high	89	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	149.3	177.2	58	-81	0	0	0	112.9	W50 I70 V81 L82 L155 P237 A248 I251 L270	W50-F68 HydrophobicContact CB-CB 4.49Å; W50-F68 CarbonylContact O-C 3.59Å; W50-F68 WeakPolarHBondContact O-CA 3.32Å; F68-I70 HydrophobicContact CD2-CG2 3.95Å; F68-I70 HydrophobicContact CE2-CG2 3.79Å; F68-V81 WeakPolarHBondContact O-CA 3.31Å; F68-L82 HydrophobicContact CD1-CB 4.44Å; F68-L82 HydrophobicContact CD2-CB 4.4Å; F68-L82 HydrophobicContact CE1-CB 3.86Å; F68-L82 HydrophobicContact CE2-CB 3.82Å; F68-L82 HydrophobicContact CE2-CD1 3.87Å; F68-L82 HydrophobicContact CE2-CG 4.39Å; F68-L82 HydrophobicContact CZ-CB 3.5Å; F68-L82 HydrophobicContact CZ-CD1 3.85Å; F68-L82 HydrophobicContact CZ-CG 4.33Å; F68-L82 PolarHBondContact N-O 3.47Å; F68-L82 PolarHBondContact O-N 3.08Å; F68-L155 HydrophobicContact CB-CD1 4.19Å; F68-L155 HydrophobicContact CD2-CB 4.33Å; F68-L155 HydrophobicContact CD2-CD1 3.91Å; F68-L155 HydrophobicContact CG-CD1 4.17Å; F68-P237 HydrophobicContact CB-CB 4.32Å; F68-P237 HydrophobicContact CB-CG 3.84Å; F68-P237 HydrophobicContact CD1-CB 3.54Å; F68-P237 HydrophobicContact CD1-CG 3.81Å; F68-P237 HydrophobicContact CD2-CB 4.34Å; F68-P237 HydrophobicContact CE1-CB 3.86Å; F68-P237 HydrophobicContact CG-CB 3.8Å; F68-P237 HydrophobicContact CG-CG 3.89Å; F68-P237 HydrophobicContact CZ-CB 4.38Å; F68-A248 HydrophobicContact CD2-CB 4.1Å; F68-A248 HydrophobicContact CE2-CB 3.48Å; F68-A248 VanDerWaalsContact CE2-CB 3.48Å; F68-A248 HydrophobicContact CZ-CB 3.92Å; F68-I251 HydrophobicContact CE1-CD1 4.32Å; F68-I251 HydrophobicContact CE1-CG1 3.94Å; F68-I251 HydrophobicContact CZ-CD1 4.33Å; F68-I251 HydrophobicContact CZ-CG1 4.05Å; F68-L270 HydrophobicContact CE2-CD1 4.45Å; F68-L270 HydrophobicContact CZ-CD1 3.95Å
69	L	98.7	Very high	90.2	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	140.5	177.1	-61.9	174.1	0	0	0	111.2	W50 V52 T78 V81 V104 V146 I152 P154 L155	W50-L69 PolarHBondContact O-N 2.85Å; V52-L69 HydrophobicContact CG2-CD2 3.93Å; V52-L69 HydrophobicContact CG2-CG 3.87Å; L69-T78 HydrophobicContact CB-CG2 4.15Å; L69-T78 HydrophobicContact CD1-CG2 4.43Å; L69-T78 HydrophobicContact CD2-CG2 3.9Å; L69-T78 HydrophobicContact CG-CG2 4.39Å; L69-V81 HydrophobicContact CD2-CG2 4Å; L69-V104 HydrophobicContact CD1-CG1 3.75Å; L69-V104 HydrophobicContact CD2-CG1 4.4Å; L69-V104 HydrophobicContact CG-CG1 4.4Å; L69-V146 HydrophobicContact CD1-CG2 4.08Å; L69-V146 HydrophobicContact CD2-CG2 4.03Å; L69-I152 HydrophobicContact CD1-CG2 3.57Å; L69-P154 HydrophobicContact CB-CB 4.19Å; L69-P154 WeakPolarHBondContact O-CA 3.38Å; L69-L155 PolarHBondContact O-N 3.09Å
70	I	98	Very high	91.1	Very high	1 Å²	1	50 Å²	50	1%	0.005	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-125.7	160	168.7	62.1	164.5	0	0	0	110.4	F68 T78 I80 L82 M139 L157 L281	F68-I70 HydrophobicContact CD2-CG2 3.95Å; F68-I70 HydrophobicContact CE2-CG2 3.79Å; I70-T78 VanDerWaalsContact O-CB 3.31Å; I70-T78 WeakPolarHBondContact O-CB 3.49Å; I70-T78 PolarHBondContact O-OG1 3.15Å; I70-I80 HydrophobicContact CD1-CB 4.48Å; I70-I80 HydrophobicContact CD1-CG2 3.7Å; I70-I80 HydrophobicContact CG1-CB 3.95Å; I70-I80 HydrophobicContact CG1-CG2 3.57Å; I70-I80 PolarHBondContact N-O 2.77Å; I70-L82 HydrophobicContact CD1-CD1 4.02Å; I70-L82 HydrophobicContact CD1-CG 4Å; I70-L82 HydrophobicContact CG1-CG 4.45Å; I70-L82 HydrophobicContact CG2-CD1 3.85Å; I70-L82 HydrophobicContact CG2-CG 4.21Å; I70-M139 HydrophobicContact CD1-CE 4.29Å; I70-L157 HydrophobicContact CB-CD1 4.44Å; I70-L157 HydrophobicContact CB-CG 4.47Å; I70-L157 HydrophobicContact CD1-CD1 3.84Å; I70-L157 HydrophobicContact CG2-CD1 4.31Å; I70-L157 HydrophobicContact CG2-CD2 3.95Å; I70-L157 HydrophobicContact CG2-CG 4.03Å; I70-L281 HydrophobicContact CD1-CD2 4.48Å
71	E	95.9	Very high	92.2	Very high	75 Å²	75	38.3 Å²	38.3	35%	0.35	20%	0.195	S	C	.	.			trans	-68.9	146.2	168.7	-69.8	-179.1	164.9	0	0	110.9	C18 P154	C18-E71 HydrophobicContact CB-CG 3.94Å; C18-E71 WeakPolarHBondContact CB-OE1 3.36Å; C18-E71 PolarHBondContact N-OE1 3.21Å; E71-P154 HydrophobicContact CG-CB 4.18Å; E71-P154 HydrophobicContact CG-CG 3.53Å
72	N	94.1	Very high	93.4	Very high	10 Å²	10	33.7 Å²	33.7	5%	0.053	18%	0.178	C	C	.	.			trans	-134	16.7	179.3	71.3	-13.9	0	0	0	111.9	M74 D79 I80 L281 R285	N72-M74 PolarHBondContact ND2-SD 2.81Å; N72-M74 WeakPolarHBondContact OD1-CB 3.48Å; N72-M74 VanDerWaalsContact OD1-CG 3.27Å; N72-M74 WeakPolarHBondContact OD1-CG 3.28Å; N72-M74 PolarHBondContact OD1-N 2.95Å; N72-M74 VanDerWaalsContact OD1-N 3.16Å; N72-D79 PolarHBondContact ND2-N 3.45Å; N72-D79 PolarHBondContact ND2-OD1 3.01Å; N72-I80 HydrophobicContact CB-CB 4.32Å; N72-I80 HydrophobicContact CB-CG1 3.51Å; N72-L281 HydrophobicContact CB-CD2 3.92Å; N72-R285 PolarHBondContact O-NH2 2.87Å
73	G	91.4	Very high	94.3	Very high	69 Å²	69	27.7 Å²	27.7	71%	0.711	15%	0.154	S	C	*	.	S	Bend	trans	80.8	4.5	-178.9	0	0	0	0	0	115.9
74	M	93.4	Very high	94.9	Very high	62 Å²	62	27.7 Å²	27.7	31%	0.305	15%	0.154	S	C	.	.			trans	-76.3	151.9	168.8	-62.6	175.4	77.8	0	0	110.5	N72 E77 P145	N72-M74 PolarHBondContact ND2-SD 2.81Å; N72-M74 WeakPolarHBondContact OD1-CB 3.48Å; N72-M74 VanDerWaalsContact OD1-CG 3.27Å; N72-M74 WeakPolarHBondContact OD1-CG 3.28Å; N72-M74 PolarHBondContact OD1-N 2.95Å; N72-M74 VanDerWaalsContact OD1-N 3.16Å; M74-E77 HydrophobicContact CB-CG 3.73Å; M74-E77 WeakPolarHBondContact CB-O 3.47Å; M74-E77 VanDerWaalsContact CE-CD 3.48Å; M74-E77 HydrophobicContact CE-CG 3.67Å; M74-E77 WeakPolarHBondContact CE-OE1 3.5Å; M74-E77 HydrophobicContact SD-CG 4.29Å; M74-P145 HydrophobicContact CE-CB 3.98Å; M74-P145 HydrophobicContact CE-CG 4.12Å
75	Q	91.3	Very high	95.2	Very high	182 Å²	182	26.1 Å²	26.1	85%	0.85	15%	0.145	S	C	*	.	S	Bend	trans	-85.5	118.5	179.8	-66.4	-177.3	23.4	0	0	110.2	E77	Q75-E77 PolarHBondContact O-N 3.04Å; Q75-E77 VanDerWaalsContact O-N 3.17Å
76	N	95.2	Very high	95.1	Very high	78 Å²	78	27.2 Å²	27.2	42%	0.417	15%	0.15	S	C	.	.	S	Bend	trans	59.7	20.9	176.3	-160.6	51	0	0	0	115.3	T147 Y148	N76-T147 WeakPolarHBondContact O-CG2 3.37Å; N76-Y148 PolarHBondContact O-N 2.97Å
77	E	96.3	Very high	95	Very high	58 Å²	58	27.1 Å²	27.1	27%	0.271	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	163.7	178.2	64.9	-174	176.4	0	0	111	M74 Q75 P145 V146 Y148	M74-E77 HydrophobicContact CB-CG 3.73Å; M74-E77 WeakPolarHBondContact CB-O 3.47Å; M74-E77 VanDerWaalsContact CE-CD 3.48Å; M74-E77 HydrophobicContact CE-CG 3.67Å; M74-E77 WeakPolarHBondContact CE-OE1 3.5Å; M74-E77 HydrophobicContact SD-CG 4.29Å; Q75-E77 PolarHBondContact O-N 3.04Å; Q75-E77 VanDerWaalsContact O-N 3.17Å; E77-P145 HydrophobicContact CB-CB 4.21Å; E77-P145 HydrophobicContact CG-CB 4.14Å; E77-P145 WeakPolarHBondContact OE2-CG 3.34Å; E77-V146 CarbonylContact C-O 3.56Å; E77-V146 WeakPolarHBondContact CA-O 3.33Å; E77-V146 VanDerWaalsContact CB-O 3.3Å; E77-V146 WeakPolarHBondContact CB-O 3.29Å; E77-Y148 PolarHBondContact O-OH 2.83Å; E77-Y148 VanDerWaalsContact O-OH 3.06Å
78	T	97.5	Very high	94.6	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	155.4	168.3	-172.2	0	0	0	0	110.3	L69 I70 I80 P145 V146 Y148	L69-T78 HydrophobicContact CB-CG2 4.15Å; L69-T78 HydrophobicContact CD1-CG2 4.43Å; L69-T78 HydrophobicContact CD2-CG2 3.9Å; L69-T78 HydrophobicContact CG-CG2 4.39Å; I70-T78 VanDerWaalsContact O-CB 3.31Å; I70-T78 WeakPolarHBondContact O-CB 3.49Å; I70-T78 PolarHBondContact O-OG1 3.15Å; T78-I80 PolarHBondContact OG1-N 3.39Å; T78-P145 CarbonylContact O-C 3.55Å; T78-P145 VanDerWaalsContact O-CA 3.32Å; T78-P145 WeakPolarHBondContact O-CA 3.44Å; T78-V146 HydrophobicContact CG2-CG2 4.02Å; T78-V146 PolarHBondContact N-O 2.87Å; T78-V146 WeakPolarHBondContact O-CG2 3.49Å; T78-V146 PolarHBondContact O-N 3.17Å; T78-Y148 HydrophobicContact CG2-CE1 3.79Å
79	D	97.6	Very high	94	Very high	8 Å²	8	28.4 Å²	28.4	4%	0.043	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	16.2	169.4	67.3	2.5	0	0	0	112.1	N72 R141 L142 P145	N72-D79 PolarHBondContact ND2-N 3.45Å; N72-D79 PolarHBondContact ND2-OD1 3.01Å; D79-R141 HydrophobicContact CB-CG 4.48Å; D79-R141 CarbonylContact O-C 3.55Å; D79-R141 VanDerWaalsContact O-CA 3.32Å; D79-R141 WeakPolarHBondContact O-CA 3.38Å; D79-R141 IonicContact OD1-NE 3.82Å; D79-R141 IonicContact OD2-CZ 3.33Å; D79-R141 IonicContact OD2-NE 2.74Å; D79-R141 PolarHBondContact OD2-NE 3.2Å; D79-R141 IonicContact OD2-NH2 3.01Å; D79-R141 PolarHBondContact OD2-NH2 2.92Å; D79-L142 HydrophobicContact CB-CB 4.3Å; D79-L142 PolarHBondContact O-N 3.47Å; D79-P145 HydrophobicContact CB-CB 4.22Å
80	I	98.1	Very high	93.2	Very high	4 Å²	4	28.4 Å²	28.4	2%	0.021	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	130.5	-174.1	-55.2	-62	0	0	0	112.4	I70 N72 T78 M139 I140 R141 L281 L284	I70-I80 HydrophobicContact CD1-CB 4.48Å; I70-I80 HydrophobicContact CD1-CG2 3.7Å; I70-I80 HydrophobicContact CG1-CB 3.95Å; I70-I80 HydrophobicContact CG1-CG2 3.57Å; I70-I80 PolarHBondContact N-O 2.77Å; N72-I80 HydrophobicContact CB-CB 4.32Å; N72-I80 HydrophobicContact CB-CG1 3.51Å; T78-I80 PolarHBondContact OG1-N 3.39Å; I80-M139 HydrophobicContact CG2-CG 3.57Å; I80-M139 HydrophobicContact CG2-SD 3.95Å; I80-I140 WeakPolarHBondContact CA-O 3.49Å; I80-R141 HydrophobicContact CD1-CB 4.06Å; I80-R141 HydrophobicContact CD1-CG 4.06Å; I80-L281 HydrophobicContact CB-CD2 4.46Å; I80-L281 HydrophobicContact CD1-CD2 4.27Å; I80-L281 HydrophobicContact CG1-CD2 3.78Å; I80-L281 HydrophobicContact CG2-CD2 4.2Å; I80-L284 HydrophobicContact CD1-CD1 4.27Å
81	V	98.7	Very high	92.3	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	130.2	172.4	179.4	0	0	0	0	108.9	V52 I54 F68 L69 F102 I140 L142	V52-V81 HydrophobicContact CB-CG1 4.3Å; V52-V81 HydrophobicContact CG1-CG1 4.33Å; V52-V81 HydrophobicContact CG1-CG2 4.34Å; V52-V81 HydrophobicContact CG2-CG1 4.39Å; V52-V81 HydrophobicContact CG2-CG2 4.16Å; I54-V81 HydrophobicContact CD1-CG1 4.47Å; F68-V81 WeakPolarHBondContact O-CA 3.31Å; L69-V81 HydrophobicContact CD2-CG2 4Å; V81-F102 HydrophobicContact CG2-CD1 4.47Å; V81-I140 HydrophobicContact CB-CB 4.35Å; V81-I140 PolarHBondContact N-O 2.87Å; V81-I140 PolarHBondContact O-N 2.85Å; V81-L142 HydrophobicContact CG2-CD1 4.11Å; V81-L142 HydrophobicContact CG2-CD2 4.02Å; V81-L142 HydrophobicContact CG2-CG 4.1Å
82	L	98.5	Very high	91.5	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	143.8	164.8	-74.2	-179.6	0	0	0	110.4	G67 F68 I70 A138 M139 L157 I251 L270 W276	G67-L82 CarbonylContact C-O 3.17Å; G67-L82 WeakPolarHBondContact CA-O 3.43Å; F68-L82 HydrophobicContact CD1-CB 4.44Å; F68-L82 HydrophobicContact CD2-CB 4.4Å; F68-L82 HydrophobicContact CE1-CB 3.86Å; F68-L82 HydrophobicContact CE2-CB 3.82Å; F68-L82 HydrophobicContact CE2-CD1 3.87Å; F68-L82 HydrophobicContact CE2-CG 4.39Å; F68-L82 HydrophobicContact CZ-CB 3.5Å; F68-L82 HydrophobicContact CZ-CD1 3.85Å; F68-L82 HydrophobicContact CZ-CG 4.33Å; F68-L82 PolarHBondContact N-O 3.47Å; F68-L82 PolarHBondContact O-N 3.08Å; I70-L82 HydrophobicContact CD1-CD1 4.02Å; I70-L82 HydrophobicContact CD1-CG 4Å; I70-L82 HydrophobicContact CG1-CG 4.45Å; I70-L82 HydrophobicContact CG2-CD1 3.85Å; I70-L82 HydrophobicContact CG2-CG 4.21Å; L82-A138 WeakPolarHBondContact CA-O 2.99Å; L82-M139 HydrophobicContact CD2-CB 3.89Å; L82-M139 HydrophobicContact CD2-CE 3.9Å; L82-M139 HydrophobicContact CD2-CG 4.05Å; L82-L157 HydrophobicContact CD1-CD2 3.87Å; L82-I251 HydrophobicContact CB-CD1 4.34Å; L82-L270 HydrophobicContact CD1-CD2 4.05Å; L82-W276 HydrophobicContact CD2-CZ3 4.44Å
83	T	96.8	Very high	91	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	-174.2	176.9	-171.7	0	0	0	0	110.1	I54 S66 A138 I140 G235	I54-T83 HydrophobicContact CD1-CG2 3.83Å; I54-T83 WeakPolarHBondContact CD1-OG1 3.41Å; S66-T83 PolarHBondContact O-OG1 3.32Å; T83-A138 HydrophobicContact CG2-CB 4.12Å; T83-A138 PolarHBondContact N-O 3.12Å; T83-A138 PolarHBondContact O-N 2.92Å; T83-I140 HydrophobicContact CG2-CD1 3.54Å; T83-I140 HydrophobicContact CG2-CG1 4.4Å; T83-G235 WeakPolarHBondContact OG1-CA 3.3Å
84	A	92.1	Very high	90.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.194	C	C	.	.			trans	-83.5	147.6	174.1	0	0	0	0	0	111.4	C87 I251	A84-C87 WeakPolarHBondContact O-CB 3.29Å; A84-I251 HydrophobicContact CB-CG2 4.28Å
85	T	88.7	Confident	90.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.179	C	C	.	.	S	Bend	trans	-71.6	-35.7	175.5	-68.3	0	0	0	0	112.3	C87 L88 H89 Y94 T125 Y128 D136 I137	T85-C87 PolarHBondContact O-N 3.38Å; T85-C87 VanDerWaalsContact O-N 3.1Å; T85-L88 CarbonylContact O-C 3.58Å; T85-L88 WeakPolarHBondContact O-CA 3.32Å; T85-L88 PolarHBondContact O-N 3.07Å; T85-H89 HydrophobicContact CG2-CB 4.28Å; T85-H89 PolarHBondContact O-N 2.81Å; T85-Y94 HydrophobicContact CG2-CE1 3.77Å; T85-T125 HydrophobicContact CG2-CG2 3.73Å; T85-Y128 HydrophobicContact CG2-CD1 3.48Å; T85-Y128 VanDerWaalsContact CG2-CD1 3.48Å; T85-Y128 HydrophobicContact CG2-CD2 3.99Å; T85-Y128 HydrophobicContact CG2-CE1 4.15Å; T85-Y128 HydrophobicContact CG2-CG 3.38Å; T85-D136 WeakPolarHBondContact CA-OD1 3.47Å; T85-D136 PolarHBondContact N-OD1 3.03Å; T85-I137 PolarHBondContact OG1-N 3.25Å; T85-I137 PolarHBondContact OG1-O 3.2Å
86	H	88	Confident	90.2	Very high	23 Å²	23	27 Å²	27	11%	0.106	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-23.7	-179.8	80.5	-97.2	0	0	0	112.4	L88 H89 Y128 D136 S234 S253	H86-L88 PolarHBondContact O-N 2.99Å; H86-H89 PolarHBondContact O-N 3.25Å; H86-Y128 HydrophobicContact CB-CE2 4.41Å; H86-Y128 VanDerWaalsContact CB-OH 3.3Å; H86-Y128 WeakPolarHBondContact CB-OH 3.24Å; H86-D136 IonicContact CE1-OD2 2.86Å; H86-D136 IonicContact CG-OD2 3.03Å; H86-D136 PolarHBondContact N-OD1 3.47Å; H86-D136 IonicContact ND1-OD1 3.83Å; H86-D136 PolarHBondContact ND1-OD1 3.28Å; H86-D136 IonicContact ND1-OD2 3.62Å; H86-D136 PolarHBondContact ND1-OD2 3.34Å; H86-S234 VanDerWaalsContact CE1-CB 3.45Å; H86-S234 WeakPolarHBondContact CE1-CB 3.32Å; H86-S234 PolarHBondContact CE1-OG 2.86Å; H86-S234 WeakPolarHBondContact NE2-CB 3.35Å; H86-S234 PolarHBondContact NE2-OG 2.99Å; H86-S253 PolarHBondContact CE1-O 2.8Å
87	C	89.7	Confident	90	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-29.5	170.8	-69.9	0	0	0	0	113.2	L56 C65 A84 T85	L56-C87 WeakPolarHBondContact CD1-O 3.33Å; L56-C87 WeakPolarHBondContact CD2-O 3.19Å; C65-C87 HydrophobicContact CB-CB 3.65Å; C65-C87 WeakPolarHBondContact CB-SG 3.47Å; C65-C87 WeakPolarHBondContact SG-CB 3.38Å; C65-C87 CovalentContact SG-SG 2.03Å; C65-C87 PolarHBondContact SG-SG 3.18Å; A84-C87 WeakPolarHBondContact O-CB 3.29Å; T85-C87 PolarHBondContact O-N 3.38Å; T85-C87 VanDerWaalsContact O-N 3.1Å
88	L	88.3	Confident	89.6	Confident	0 Å²	0	21 Å²	21	0%	0	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-10.3	-177.2	-45.4	-175.5	0	0	0	112.4	L56 T85 H86 Q95 M100 Y123 A138 I140	L56-L88 HydrophobicContact CD1-CD2 4.35Å; L56-L88 HydrophobicContact CD2-CD2 3.83Å; T85-L88 CarbonylContact O-C 3.58Å; T85-L88 WeakPolarHBondContact O-CA 3.32Å; T85-L88 PolarHBondContact O-N 3.07Å; H86-L88 PolarHBondContact O-N 2.99Å; L88-Q95 WeakPolarHBondContact O-CG 3.38Å; L88-Q95 PolarHBondContact O-N 2.83Å; L88-M100 HydrophobicContact CB-CE 4.25Å; L88-M100 HydrophobicContact CD1-CE 4.42Å; L88-M100 HydrophobicContact CD2-CE 3.97Å; L88-M100 HydrophobicContact CD2-SD 4.05Å; L88-M100 HydrophobicContact CG-CE 4.44Å; L88-Y123 HydrophobicContact CD1-CD2 3.64Å; L88-Y123 HydrophobicContact CD1-CE2 4Å; L88-Y123 HydrophobicContact CD1-CG 3.96Å; L88-A138 HydrophobicContact CD1-CB 3.58Å; L88-A138 HydrophobicContact CG-CB 4.44Å; L88-I140 HydrophobicContact CD1-CD1 4.1Å; L88-I140 HydrophobicContact CD1-CG1 4.14Å; L88-I140 HydrophobicContact CD2-CD1 4.14Å
89	H	85.3	Confident	89.2	Confident	26 Å²	26	21.6 Å²	21.6	12%	0.12	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	88.9	-176.4	-177.7	-90.4	0	0	0	110.1	T85 H86 G92 I93 Y94 Y128	T85-H89 HydrophobicContact CG2-CB 4.28Å; T85-H89 PolarHBondContact O-N 2.81Å; H86-H89 PolarHBondContact O-N 3.25Å; H89-G92 WeakPolarHBondContact CE1-CA 3.21Å; H89-G92 VanDerWaalsContact NE2-C 3.3Å; H89-G92 PolarHBondContact NE2-O 3.38Å; H89-I93 CarbonylContact C-O 3.57Å; H89-I93 WeakPolarHBondContact CA-O 3.38Å; H89-Y94 HydrophobicContact CB-CD1 4.12Å; H89-Y94 HydrophobicContact CB-CE1 4.02Å; H89-Y94 AromaticContact CD2-CD1 3.94Å; H89-Y94 AromaticContact CD2-CD2 3.81Å; H89-Y94 AromaticContact CD2-CE1 3.83Å; H89-Y94 AromaticContact CD2-CE2 3.7Å; H89-Y94 AromaticContact CD2-CG 3.93Å; H89-Y94 AromaticContact CD2-CZ 3.72Å; H89-Y128 HydrophobicContact CB-CD1 4.34Å; H89-Y128 HydrophobicContact CB-CE1 4.07Å; H89-Y128 AromaticContact CG-CE1 3.94Å; H89-Y128 AromaticContact ND1-CE1 3.7Å
90	I	81.4	Confident	88.9	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.005	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	130.2	-173.6	-55.9	172.6	0	0	0	108.8	Y58 V63 G92 I93 Q95 W230	Y58-I90 HydrophobicContact CD1-CG2 3.95Å; Y58-I90 HydrophobicContact CE1-CG2 4.12Å; Y58-I90 HydrophobicContact CG-CG2 4.34Å; V63-I90 HydrophobicContact CB-CD1 4.02Å; V63-I90 HydrophobicContact CG2-CD1 3.64Å; V63-I90 HydrophobicContact CG2-CG1 4.48Å; I90-G92 PolarHBondContact O-N 3.33Å; I90-G92 VanDerWaalsContact O-N 3.17Å; I90-I93 PolarHBondContact N-O 2.71Å; I90-I93 PolarHBondContact O-N 3.24Å; I90-Q95 HydrophobicContact CB-CG 4.31Å; I90-Q95 HydrophobicContact CD1-CG 3.81Å; I90-Q95 HydrophobicContact CG1-CG 4.06Å; I90-W230 HydrophobicContact CG1-CZ3 4.49Å
91	E	80.9	Confident	88.7	Confident	114 Å²	114	24.7 Å²	24.7	53%	0.533	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	37.8	176.6	-65.9	178.5	-179.7	0	0	113.5	Y58 R61 I93	Y58-E91 HydrophobicContact CE1-CG 4.45Å; Y58-E91 VanDerWaalsContact CE1-OE2 3.26Å; Y58-E91 WeakPolarHBondContact CE1-OE2 3.47Å; Y58-E91 PolarHBondContact OH-OE2 3.24Å; R61-E91 IonicContact NH1-OE1 2.95Å; R61-E91 PolarHBondContact NH1-OE1 3.24Å; E91-I93 VanDerWaalsContact C-N 3.33Å
92	G	79	Confident	88.5	Confident	57 Å²	57	24.8 Å²	24.8	59%	0.588	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.5	5.2	179.6	0	0	0	0	0	114.8	H89 I90	H89-G92 WeakPolarHBondContact CE1-CA 3.21Å; H89-G92 VanDerWaalsContact NE2-C 3.3Å; H89-G92 PolarHBondContact NE2-O 3.38Å; I90-G92 PolarHBondContact O-N 3.33Å; I90-G92 VanDerWaalsContact O-N 3.17Å
93	I	82	Confident	88.2	Confident	88 Å²	88	25.7 Å²	25.7	45%	0.451	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	126.7	-172.8	-57	174.7	0	0	0	110.3	H89 I90 E91 Q95	H89-I93 CarbonylContact C-O 3.57Å; H89-I93 WeakPolarHBondContact CA-O 3.38Å; I90-I93 PolarHBondContact N-O 2.71Å; I90-I93 PolarHBondContact O-N 3.24Å; E91-I93 VanDerWaalsContact C-N 3.33Å; I93-Q95 PolarHBondContact O-N 3.15Å; I93-Q95 PolarHBondContact O-NE2 3.4Å
94	Y	86.1	Confident	88.1	Confident	91 Å²	91	25.7 Å²	25.7	36%	0.357	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	121.6	167.1	-76.6	-68.9	0	0	0	110.8	T85 H89 Y123 T125	T85-Y94 HydrophobicContact CG2-CE1 3.77Å; H89-Y94 HydrophobicContact CB-CD1 4.12Å; H89-Y94 HydrophobicContact CB-CE1 4.02Å; H89-Y94 AromaticContact CD2-CD1 3.94Å; H89-Y94 AromaticContact CD2-CD2 3.81Å; H89-Y94 AromaticContact CD2-CE1 3.83Å; H89-Y94 AromaticContact CD2-CE2 3.7Å; H89-Y94 AromaticContact CD2-CG 3.93Å; H89-Y94 AromaticContact CD2-CZ 3.72Å; Y94-Y123 WeakPolarHBondContact CB-OH 3.16Å; Y94-Y123 HydrophobicContact CD1-CE2 4.37Å; Y94-T125 HydrophobicContact CE1-CG2 3.92Å
95	Q	85.9	Confident	88.2	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.139	C	C	.	.	P	Polyproline II helix	trans	-76.3	141.2	-178.7	-59.9	-52	-51.9	0	0	111.1	L56 Y58 L88 I90 I93 M100 Y123	L56-Q95 HydrophobicContact CD2-CB 4.08Å; L56-Q95 HydrophobicContact CD2-CG 4.32Å; Y58-Q95 VanDerWaalsContact CD2-OE1 3.25Å; L88-Q95 WeakPolarHBondContact O-CG 3.38Å; L88-Q95 PolarHBondContact O-N 2.83Å; I90-Q95 HydrophobicContact CB-CG 4.31Å; I90-Q95 HydrophobicContact CD1-CG 3.81Å; I90-Q95 HydrophobicContact CG1-CG 4.06Å; I93-Q95 PolarHBondContact O-N 3.15Å; I93-Q95 PolarHBondContact O-NE2 3.4Å; Q95-M100 HydrophobicContact CB-CE 4.2Å; Q95-M100 WeakPolarHBondContact O-CE 3.42Å; Q95-Y123 WeakPolarHBondContact O-CE1 3.37Å; Q95-Y123 PolarHBondContact O-OH 3.26Å
96	P	89.2	Confident	88.2	Confident	19 Å²	19	26.4 Å²	26.4	12%	0.123	14%	0.143	C	C	.	.	P	Polyproline II helix	trans	-74.1	150.5	-177.5	32.5	-36.4	0	0	0	111.2	G98 N99 H293 Q295	P96-G98 PolarHBondContact O-N 3.34Å; P96-G98 VanDerWaalsContact O-N 3.14Å; P96-N99 HydrophobicContact CG-CB 4.37Å; P96-N99 WeakPolarHBondContact O-CB 3.05Å; P96-N99 PolarHBondContact O-N 2.84Å; P96-N99 VanDerWaalsContact O-N 3.11Å; P96-H293 WeakPolarHBondContact CB-O 3.26Å; P96-Q295 HydrophobicContact CG-CG 4.33Å
97	P	89.3	Confident	88.2	Confident	6 Å²	6	26 Å²	26	4%	0.039	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-57.3	-32.1	-175.8	-26.4	35	0	0	0	114.6	N99 M100 A120 Y123 Q290	P97-N99 PolarHBondContact O-N 3.16Å; P97-N99 VanDerWaalsContact O-N 3.14Å; P97-M100 WeakPolarHBondContact O-CB 3.38Å; P97-M100 PolarHBondContact O-N 3.08Å; P97-A120 HydrophobicContact CB-CB 3.87Å; P97-Y123 HydrophobicContact CG-CD1 4.02Å; P97-Y123 HydrophobicContact CG-CE1 4.03Å; P97-Q290 HydrophobicContact CB-CB 4.36Å; P97-Q290 HydrophobicContact CG-CB 3.92Å
98	G	88.1	Confident	87.8	Confident	3 Å²	3	28.2 Å²	28.2	3%	0.031	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-67.7	-12.1	-178.9	0	0	0	0	0	115.1	P96 R119 T291 H293	P96-G98 PolarHBondContact O-N 3.34Å; P96-G98 VanDerWaalsContact O-N 3.14Å; G98-R119 PolarHBondContact O-NH2 2.64Å; G98-R119 VanDerWaalsContact O-NH2 3.12Å; G98-T291 WeakPolarHBondContact CA-O 3.49Å; G98-H293 WeakPolarHBondContact CA-O 2.75Å; G98-H293 PolarHBondContact N-O 3.25Å
99	N	89.4	Confident	87.4	Confident	14 Å²	14	30.1 Å²	30.1	8%	0.075	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-92.1	1.8	174.5	-70.5	15	0	0	0	113.2	L56 T57 P96 P97	L56-N99 WeakPolarHBondContact CA-O 3.26Å; T57-N99 PolarHBondContact N-O 3.49Å; T57-N99 WeakPolarHBondContact O-CB 3.25Å; T57-N99 PolarHBondContact O-ND2 2.73Å; T57-N99 WeakPolarHBondContact OG1-CB 3.44Å; T57-N99 PolarHBondContact OG1-O 3.05Å; P96-N99 HydrophobicContact CG-CB 4.37Å; P96-N99 WeakPolarHBondContact O-CB 3.05Å; P96-N99 PolarHBondContact O-N 2.84Å; P96-N99 VanDerWaalsContact O-N 3.11Å; P97-N99 PolarHBondContact O-N 3.16Å; P97-N99 VanDerWaalsContact O-N 3.14Å
100	M	92.5	Very high	86.9	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	124.9	-173.2	-53.2	179	-177.3	0	0	111.6	L56 L88 Q95 P97 F102 R119 A120 Y123	L56-M100 HydrophobicContact CD2-CE 4.12Å; L56-M100 HydrophobicContact CD2-CG 3.92Å; L56-M100 HydrophobicContact CG-CG 4.24Å; L88-M100 HydrophobicContact CB-CE 4.25Å; L88-M100 HydrophobicContact CD1-CE 4.42Å; L88-M100 HydrophobicContact CD2-CE 3.97Å; L88-M100 HydrophobicContact CD2-SD 4.05Å; L88-M100 HydrophobicContact CG-CE 4.44Å; Q95-M100 HydrophobicContact CB-CE 4.2Å; Q95-M100 WeakPolarHBondContact O-CE 3.42Å; P97-M100 WeakPolarHBondContact O-CB 3.38Å; P97-M100 PolarHBondContact O-N 3.08Å; M100-F102 HydrophobicContact CB-CE2 3.65Å; M100-F102 HydrophobicContact CB-CZ 3.84Å; M100-R119 WeakPolarHBondContact O-CA 3.31Å; M100-A120 HydrophobicContact CB-CB 3.9Å; M100-A120 HydrophobicContact CG-CB 4.46Å; M100-A120 PolarHBondContact O-N 2.74Å; M100-A120 HydrophobicContact SD-CB 4.02Å; M100-Y123 HydrophobicContact CE-CD1 3.64Å; M100-Y123 HydrophobicContact CE-CE1 3.34Å; M100-Y123 HydrophobicContact SD-CD1 3.97Å; M100-Y123 HydrophobicContact SD-CE1 4.27Å
101	F	91.9	Very high	86.9	Confident	76 Å²	76	40.3 Å²	40.3	33%	0.333	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	141.3	179.9	-56	-93.9	0	0	0	109.7	L55 T57 R119	L55-F101 HydrophobicContact CB-CB 4.3Å; L55-F101 PolarHBondContact N-O 3.42Å; L55-F101 PolarHBondContact O-N 3.12Å; T57-F101 HydrophobicContact CG2-CD2 4.3Å; T57-F101 HydrophobicContact CG2-CE2 3.81Å; F101-R119 HydrophobicContact CD1-CG 4.3Å; F101-R119 HydrophobicContact CE1-CG 4.41Å
102	F	95.4	Very high	87	Confident	3 Å²	3	38.1 Å²	38.1	1%	0.013	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	132	-174.3	-57.3	-94.8	0	0	0	109.1	V52 M53 I54 V81 M100 Q117 R118 A120 I140 L142	V52-F102 HydrophobicContact CG1-CB 4.02Å; V52-F102 HydrophobicContact CG1-CD1 3.89Å; V52-F102 HydrophobicContact CG1-CG 4.46Å; M53-F102 WeakPolarHBondContact O-CA 3.46Å; I54-F102 HydrophobicContact CB-CE1 4.36Å; I54-F102 HydrophobicContact CD1-CD1 4.45Å; I54-F102 HydrophobicContact CD1-CE1 4.01Å; I54-F102 HydrophobicContact CG1-CD1 3.9Å; I54-F102 HydrophobicContact CG1-CE1 3.86Å; I54-F102 HydrophobicContact CG2-CD1 4.28Å; I54-F102 HydrophobicContact CG2-CE1 3.76Å; I54-F102 HydrophobicContact CG2-CZ 4.17Å; V81-F102 HydrophobicContact CG2-CD1 4.47Å; M100-F102 HydrophobicContact CB-CE2 3.65Å; M100-F102 HydrophobicContact CB-CZ 3.84Å; F102-Q117 CarbonylContact O-C 3.19Å; F102-Q117 WeakPolarHBondContact O-CA 3.44Å; F102-R118 HydrophobicContact CB-CB 4.24Å; F102-R118 PolarHBondContact N-O 2.93Å; F102-R118 PolarHBondContact O-N 2.93Å; F102-A120 HydrophobicContact CE2-CB 3.74Å; F102-A120 HydrophobicContact CZ-CB 4.21Å; F102-I140 HydrophobicContact CE1-CB 4.5Å; F102-I140 HydrophobicContact CE1-CD1 3.59Å; F102-I140 HydrophobicContact CE1-CG2 4.02Å; F102-I140 HydrophobicContact CE2-CG2 4.18Å; F102-I140 HydrophobicContact CZ-CB 4.44Å; F102-I140 HydrophobicContact CZ-CD1 3.74Å; F102-I140 HydrophobicContact CZ-CG1 4.5Å; F102-I140 HydrophobicContact CZ-CG2 3.6Å; F102-L142 HydrophobicContact CB-CD2 3.95Å; F102-L142 HydrophobicContact CD1-CD2 4.05Å; F102-L142 HydrophobicContact CD2-CD2 3.64Å; F102-L142 HydrophobicContact CE2-CD2 4.27Å; F102-L142 HydrophobicContact CG-CD2 3.57Å
103	L	91.7	Very high	87.3	Confident	19 Å²	19	41 Å²	41	10%	0.099	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	118.1	172.7	-170	72.6	0	0	0	108.3	M53 A106 V109 L112 A115 Q117	M53-L103 HydrophobicContact CB-CB 4.2Å; M53-L103 PolarHBondContact N-O 3.17Å; M53-L103 PolarHBondContact O-N 3.37Å; L103-A106 HydrophobicContact CD2-CB 3.64Å; L103-A106 HydrophobicContact CG-CB 3.92Å; L103-V109 HydrophobicContact CD2-CB 4.47Å; L103-V109 HydrophobicContact CD2-CG1 4.3Å; L103-L112 HydrophobicContact CD1-CD2 4.04Å; L103-L112 HydrophobicContact CD2-CD2 3.49Å; L103-L112 VanDerWaalsContact CD2-CD2 3.49Å; L103-L112 HydrophobicContact CG-CD2 4.33Å; L103-A115 HydrophobicContact CD1-CB 3.57Å; L103-A115 HydrophobicContact CD2-CB 4.46Å; L103-A115 HydrophobicContact CG-CB 3.95Å; L103-Q117 HydrophobicContact CD1-CG 3.75Å
104	V	96.2	Very high	87.4	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	138.3	-172.9	-173.1	0	0	0	0	109.5	V52 L69 A106 A115 V116 V146 I152	V52-V104 HydrophobicContact CG1-CG2 4.15Å; V52-V104 HydrophobicContact CG2-CG1 4.47Å; V52-V104 HydrophobicContact CG2-CG2 4.17Å; L69-V104 HydrophobicContact CD1-CG1 3.75Å; L69-V104 HydrophobicContact CD2-CG1 4.4Å; L69-V104 HydrophobicContact CG-CG1 4.4Å; V104-A106 VanDerWaalsContact C-N 3.26Å; V104-A106 PolarHBondContact O-N 2.85Å; V104-A115 CarbonylContact O-C 3.47Å; V104-A115 WeakPolarHBondContact O-CA 3.37Å; V104-V116 PolarHBondContact N-O 3.43Å; V104-V116 PolarHBondContact O-N 2.76Å; V104-V146 HydrophobicContact CB-CG1 4.43Å; V104-V146 HydrophobicContact CG1-CG1 4.38Å; V104-V146 HydrophobicContact CG1-CG2 4.35Å; V104-V146 HydrophobicContact CG2-CG1 4.34Å; V104-I152 HydrophobicContact CG1-CD1 3.99Å; V104-I152 HydrophobicContact CG1-CG1 4.13Å; V104-I152 HydrophobicContact CG1-CG2 4.05Å
105	G	93.3	Very high	87.6	Confident	5 Å²	5	36.7 Å²	36.7	5%	0.052	20%	0.2	C	C	.	.	S	Bend	trans	80	-0.9	177.1	0	0	0	0	0	115.6	H46 H151	H46-G105 PolarHBondContact ND1-O 2.91Å; G105-H151 WeakPolarHBondContact CA-O 3.15Å
106	A	88.9	Confident	88	Confident	9 Å²	9	38.6 Å²	38.6	7%	0.074	21%	0.211	C	C	.	.			trans	-69.1	134.5	174.8	0	0	0	0	0	111.2	L103 V104 A115 W175	L103-A106 HydrophobicContact CD2-CB 3.64Å; L103-A106 HydrophobicContact CG-CB 3.92Å; V104-A106 VanDerWaalsContact C-N 3.26Å; V104-A106 PolarHBondContact O-N 2.85Å; A106-A115 HydrophobicContact CB-CB 3.78Å; A106-W175 WeakPolarHBondContact O-CZ2 3.39Å
107	H	87.2	Confident	88.3	Confident	16 Å²	16	44 Å²	44	7%	0.074	24%	0.235	C	C	.	.	S	Bend	trans	-91.7	-50.1	160.4	177.2	63.6	0	0	0	110.3	E42 A43 P45 W175 L187	E42-H107 IonicContact OE1-CE1 3.69Å; E42-H107 IonicContact OE1-NE2 2.64Å; E42-H107 PolarHBondContact OE1-NE2 3.37Å; A43-H107 PolarHBondContact O-CE1 2.84Å; P45-H107 HydrophobicContact CB-CB 4.47Å; H107-W175 PolarHBondContact O-NE1 2.81Å; H107-L187 WeakPolarHBondContact O-CB 3.48Å; H107-L187 PolarHBondContact O-N 2.93Å
108	N	82.2	Confident	88.7	Confident	46 Å²	46	46.6 Å²	46.6	25%	0.246	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-113.1	121.9	177.9	-174.7	-28.5	0	0	0	110.2	E110 N111 S185	N108-E110 PolarHBondContact O-N 2.93Å; N108-E110 WeakPolarHBondContact OD1-CB 3.24Å; N108-E110 PolarHBondContact OD1-N 2.92Å; N108-N111 HydrophobicContact CB-CB 4.37Å; N108-N111 CarbonylContact O-C 3.42Å; N108-N111 VanDerWaalsContact O-C 3.29Å; N108-N111 PolarHBondContact O-N 3.06Å; N108-S185 CarbonylContact C-O 3.59Å; N108-S185 WeakPolarHBondContact CA-O 3.41Å; N108-S185 WeakPolarHBondContact OD1-CB 3.38Å; N108-S185 PolarHBondContact OD1-O 2.92Å
109	V	78.4	Confident	89	Confident	39 Å²	39	49.4 Å²	49.4	24%	0.236	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-9.2	-176.1	-54.8	0	0	0	0	113.7	M53 L103 L112 W175 S185	M53-V109 HydrophobicContact SD-CB 4.14Å; M53-V109 HydrophobicContact SD-CG1 3.54Å; M53-V109 VanDerWaalsContact SD-CG1 3.54Å; L103-V109 HydrophobicContact CD2-CB 4.47Å; L103-V109 HydrophobicContact CD2-CG1 4.3Å; V109-L112 VanDerWaalsContact O-CD2 3.25Å; V109-L112 WeakPolarHBondContact O-CD2 3.48Å; V109-W175 HydrophobicContact CG1-CD2 4.37Å; V109-W175 HydrophobicContact CG1-CG 4.05Å; V109-S185 PolarHBondContact N-O 3.16Å
110	E	76.9	Confident	89.2	Confident	152 Å²	152	48.8 Å²	48.8	71%	0.71	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-19.7	168	-69.4	170	-172.1	0	0	112.4	N108 S185	N108-E110 PolarHBondContact O-N 2.93Å; N108-E110 WeakPolarHBondContact OD1-CB 3.24Å; N108-E110 PolarHBondContact OD1-N 2.92Å; E110-S185 VanDerWaalsContact CD-CB 3.41Å; E110-S185 WeakPolarHBondContact OE1-CB 3.41Å; E110-S185 PolarHBondContact OE1-OG 3.2Å
111	N	81.1	Confident	89.1	Confident	89 Å²	89	51.5 Å²	51.5	48%	0.476	26%	0.261	S	S	.	.			trans	-115.3	95.3	176.2	-178.1	0.5	0	0	0	110.6	N108 T113	N108-N111 HydrophobicContact CB-CB 4.37Å; N108-N111 CarbonylContact O-C 3.42Å; N108-N111 VanDerWaalsContact O-C 3.29Å; N108-N111 PolarHBondContact O-N 3.06Å; N111-T113 VanDerWaalsContact C-N 3.34Å; N111-T113 PolarHBondContact O-N 2.98Å; N111-T113 WeakPolarHBondContact OD1-CB 3.37Å; N111-T113 PolarHBondContact OD1-N 3.01Å; N111-T113 PolarHBondContact OD1-OG1 3.15Å
112	L	81.8	Confident	89	Confident	68 Å²	68	48.4 Å²	48.4	36%	0.356	25%	0.248	S	C	.	.			trans	-91.7	13.3	-173.1	-54.8	-172.1	0	0	0	114.2	L103 V109 D114 A115	L103-L112 HydrophobicContact CD1-CD2 4.04Å; L103-L112 HydrophobicContact CD2-CD2 3.49Å; L103-L112 VanDerWaalsContact CD2-CD2 3.49Å; L103-L112 HydrophobicContact CG-CD2 4.33Å; V109-L112 VanDerWaalsContact O-CD2 3.25Å; V109-L112 WeakPolarHBondContact O-CD2 3.48Å; L112-D114 VanDerWaalsContact C-N 3.31Å; L112-D114 PolarHBondContact O-N 3.01Å; L112-A115 HydrophobicContact CB-CB 4.2Å; L112-A115 HydrophobicContact CD2-CB 4.21Å; L112-A115 PolarHBondContact O-N 3.44Å
113	T	85.3	Confident	89	Confident	117 Å²	117	50 Å²	50	72%	0.718	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-43.8	-173.1	-56.5	0	0	0	0	112.7	N111	N111-T113 VanDerWaalsContact C-N 3.34Å; N111-T113 PolarHBondContact O-N 2.98Å; N111-T113 WeakPolarHBondContact OD1-CB 3.37Å; N111-T113 PolarHBondContact OD1-N 3.01Å; N111-T113 PolarHBondContact OD1-OG1 3.15Å
114	D	85.5	Confident	88.9	Confident	70 Å²	70	51.3 Å²	51.3	37%	0.374	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-2.3	179.6	-62.7	-70.2	0	0	0	113.5	H46 L112 H151	H46-D114 IonicContact CE1-OD2 2.77Å; H46-D114 IonicContact NE2-OD2 3.49Å; L112-D114 VanDerWaalsContact C-N 3.31Å; L112-D114 PolarHBondContact O-N 3.01Å; D114-H151 WeakPolarHBondContact CB-ND1 3.47Å; D114-H151 IonicContact OD1-CE1 2.87Å; D114-H151 PolarHBondContact OD1-CE1 3.33Å; D114-H151 VanDerWaalsContact OD1-CE1 3.25Å; D114-H151 IonicContact OD1-ND1 2.79Å; D114-H151 PolarHBondContact OD1-ND1 3.1Å
115	A	89.3	Confident	88.6	Confident	20 Å²	20	53.1 Å²	53.1	17%	0.165	27%	0.272	C	S	.	.			trans	-89.1	138.6	-169.9	0	0	0	0	0	111.5	L103 V104 A106 L112	L103-A115 HydrophobicContact CD1-CB 3.57Å; L103-A115 HydrophobicContact CD2-CB 4.46Å; L103-A115 HydrophobicContact CG-CB 3.95Å; V104-A115 CarbonylContact O-C 3.47Å; V104-A115 WeakPolarHBondContact O-CA 3.37Å; A106-A115 HydrophobicContact CB-CB 3.78Å; L112-A115 HydrophobicContact CB-CB 4.2Å; L112-A115 HydrophobicContact CD2-CB 4.21Å; L112-A115 PolarHBondContact O-N 3.44Å
116	V	94.6	Very high	88.2	Confident	40 Å²	40	55 Å²	55	24%	0.242	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	121.9	178.6	-179.9	0	0	0	0	109.1	V104 R118 V146 I152	V104-V116 PolarHBondContact N-O 3.43Å; V104-V116 PolarHBondContact O-N 2.76Å; V116-R118 HydrophobicContact CG1-CG 4.43Å; V116-V146 HydrophobicContact CG1-CG1 4.12Å; V116-I152 HydrophobicContact CB-CD1 4.32Å; V116-I152 HydrophobicContact CG2-CD1 3.82Å
117	Q	94.7	Very high	87.8	Confident	133 Å²	133	59.5 Å²	59.5	62%	0.621	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.5	138.3	174.9	-64.8	-177.1	20.5	0	0	111.4	F102 L103	F102-Q117 CarbonylContact O-C 3.19Å; F102-Q117 WeakPolarHBondContact O-CA 3.44Å; L103-Q117 HydrophobicContact CD1-CG 3.75Å
118	R	97.4	Very high	87.4	Confident	60 Å²	60	60 Å²	60	23%	0.226	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	161.1	176.1	-67	-67	-177.2	-95.8	0.9	111.2	F102 V116 L142 K144 P145 V146	F102-R118 HydrophobicContact CB-CB 4.24Å; F102-R118 PolarHBondContact N-O 2.93Å; F102-R118 PolarHBondContact O-N 2.93Å; V116-R118 HydrophobicContact CG1-CG 4.43Å; R118-L142 HydrophobicContact CB-CB 4.4Å; R118-L142 HydrophobicContact CB-CD1 4.32Å; R118-L142 HydrophobicContact CB-CD2 3.92Å; R118-L142 HydrophobicContact CB-CG 4.44Å; R118-L142 HydrophobicContact CG-CD1 4.17Å; R118-K144 WeakPolarHBondContact CD-O 3.31Å; R118-K144 PolarHBondContact NE-O 2.99Å; R118-K144 VanDerWaalsContact NE-O 3.15Å; R118-P145 PolarHBondContact NE-O 3.18Å; R118-P145 PolarHBondContact NH2-O 2.87Å; R118-V146 HydrophobicContact CG-CG1 4.04Å
119	R	95.6	Very high	87.1	Confident	62 Å²	62	62.8 Å²	62.8	23%	0.234	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	160.7	170.3	-61	179.6	73.1	-167.9	3	109.2	G98 M100 F101 L142 N143 T291 E292	G98-R119 PolarHBondContact O-NH2 2.64Å; G98-R119 VanDerWaalsContact O-NH2 3.12Å; M100-R119 WeakPolarHBondContact O-CA 3.31Å; F101-R119 HydrophobicContact CD1-CG 4.3Å; F101-R119 HydrophobicContact CE1-CG 4.41Å; R119-L142 CarbonylContact O-C 3.55Å; R119-L142 WeakPolarHBondContact O-CA 3.25Å; R119-N143 HydrophobicContact CB-CB 4.46Å; R119-N143 PolarHBondContact N-OD1 3.05Å; R119-N143 VanDerWaalsContact N-OD1 3.08Å; R119-N143 WeakPolarHBondContact O-CB 3.37Å; R119-N143 PolarHBondContact O-N 3.14Å; R119-N143 PolarHBondContact O-OD1 3.14Å; R119-T291 HydrophobicContact CB-CG2 3.62Å; R119-T291 HydrophobicContact CG-CG2 4.32Å; R119-T291 PolarHBondContact NH2-O 3.26Å; R119-E292 IonicContact CZ-OE2 3.34Å; R119-E292 VanDerWaalsContact NH1-CD 3.31Å; R119-E292 IonicContact NH1-OE1 3.91Å; R119-E292 PolarHBondContact NH1-OE1 3.14Å; R119-E292 IonicContact NH1-OE2 3.01Å; R119-E292 PolarHBondContact NH1-OE2 2.56Å; R119-E292 IonicContact NH2-OE2 3.25Å
120	A	92.9	Very high	87.1	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	135	169.8	0	0	0	0	0	110.2	P97 M100 F102 I140 T291	P97-A120 HydrophobicContact CB-CB 3.87Å; M100-A120 HydrophobicContact CB-CB 3.9Å; M100-A120 HydrophobicContact CG-CB 4.46Å; M100-A120 PolarHBondContact O-N 2.74Å; M100-A120 HydrophobicContact SD-CB 4.02Å; F102-A120 HydrophobicContact CE2-CB 3.74Å; F102-A120 HydrophobicContact CZ-CB 4.21Å; A120-I140 HydrophobicContact CB-CG2 3.98Å; A120-T291 VanDerWaalsContact O-CA 3.27Å; A120-T291 WeakPolarHBondContact O-CA 3.07Å; A120-T291 VanDerWaalsContact O-CB 3.3Å; A120-T291 WeakPolarHBondContact O-CB 3.33Å; A120-T291 WeakPolarHBondContact O-CG2 3.41Å; A120-T291 PolarHBondContact O-OG1 3.13Å
121	R	89.8	Confident	87	Confident	58 Å²	58	63.3 Å²	63.3	22%	0.219	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	-50.7	161.2	-176.1	170.6	162.8	162.7	-3	110.5	R141 A287 Y289 Q290 T291	R121-R141 WeakPolarHBondContact CA-O 3.49Å; R121-R141 HydrophobicContact CB-CB 4.4Å; R121-R141 HydrophobicContact CB-CG 4.33Å; R121-R141 VanDerWaalsContact CB-O 3.3Å; R121-R141 WeakPolarHBondContact CB-O 3.47Å; R121-R141 PolarHBondContact N-O 2.81Å; R121-A287 PolarHBondContact NH2-O 2.93Å; R121-Y289 HydrophobicContact CG-CD2 3.6Å; R121-Y289 HydrophobicContact CG-CE2 4.12Å; R121-Y289 HydrophobicContact CG-CG 4.23Å; R121-Q290 CarbonylContact O-C 3.47Å; R121-Q290 VanDerWaalsContact O-CA 3.31Å; R121-Q290 WeakPolarHBondContact O-CA 3.42Å; R121-Q290 WeakPolarHBondContact O-CB 3.37Å; R121-Q290 PolarHBondContact O-N 2.95Å; R121-T291 VanDerWaalsContact CA-OG1 3.29Å; R121-T291 WeakPolarHBondContact CA-OG1 3.44Å; R121-T291 PolarHBondContact O-N 2.84Å
122	T	91.5	Very high	86.7	Confident	10 Å²	10	63.7 Å²	63.7	6%	0.061	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.1	171.1	-177.4	-176.9	0	0	0	0	107.5	R141 L284 A287 Q290	T122-R141 HydrophobicContact CG2-CB 4.4Å; T122-R141 PolarHBondContact N-O 3.36Å; T122-R141 PolarHBondContact O-N 2.93Å; T122-L284 HydrophobicContact CG2-CD2 3.64Å; T122-A287 HydrophobicContact CG2-CB 3.78Å; T122-Q290 PolarHBondContact OG1-OE1 3.35Å
123	Y	94.4	Very high	86.5	Confident	36 Å²	36	62.7 Å²	62.7	14%	0.141	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	167.6	173.8	67.6	-86.7	0	0	0	111.5	L88 Y94 Q95 P97 M100 T125 M139	L88-Y123 HydrophobicContact CD1-CD2 3.64Å; L88-Y123 HydrophobicContact CD1-CE2 4Å; L88-Y123 HydrophobicContact CD1-CG 3.96Å; Y94-Y123 WeakPolarHBondContact CB-OH 3.16Å; Y94-Y123 HydrophobicContact CD1-CE2 4.37Å; Q95-Y123 WeakPolarHBondContact O-CE1 3.37Å; Q95-Y123 PolarHBondContact O-OH 3.26Å; P97-Y123 HydrophobicContact CG-CD1 4.02Å; P97-Y123 HydrophobicContact CG-CE1 4.03Å; M100-Y123 HydrophobicContact CE-CD1 3.64Å; M100-Y123 HydrophobicContact CE-CE1 3.34Å; M100-Y123 HydrophobicContact SD-CD1 3.97Å; M100-Y123 HydrophobicContact SD-CE1 4.27Å; Y123-T125 HydrophobicContact CD2-CG2 3.9Å; Y123-T125 HydrophobicContact CE2-CG2 3.81Å; Y123-M139 CarbonylContact C-O 3.53Å; Y123-M139 WeakPolarHBondContact CA-O 3.3Å; Y123-M139 WeakPolarHBondContact CB-O 3.27Å
124	L	89.9	Confident	86.1	Confident	48 Å²	48	59.4 Å²	59.4	25%	0.251	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	149.6	170.8	-68	175.8	0	0	0	109.7	A138 M139 Q283 L284	L124-A138 CarbonylContact O-C 3.48Å; L124-A138 WeakPolarHBondContact O-CA 3.42Å; L124-M139 PolarHBondContact N-O 3.12Å; L124-M139 PolarHBondContact O-N 2.99Å; L124-Q283 HydrophobicContact CD1-CB 3.77Å; L124-L284 HydrophobicContact CD1-CD2 4.15Å; L124-L284 HydrophobicContact CD1-CG 3.81Å; L124-L284 HydrophobicContact CG-CD2 3.84Å; L124-L284 HydrophobicContact CG-CG 4.03Å
125	T	90	Very high	85.9	Confident	37 Å²	37	57.3 Å²	57.3	23%	0.227	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	169.8	172.4	65.2	0	0	0	0	109.4	T85 Y94 Y123 A138	T85-T125 HydrophobicContact CG2-CG2 3.73Å; Y94-T125 HydrophobicContact CE1-CG2 3.92Å; Y123-T125 HydrophobicContact CD2-CG2 3.9Å; Y123-T125 HydrophobicContact CE2-CG2 3.81Å; T125-A138 HydrophobicContact CG2-CB 4.07Å
126	H	84	Confident	85.7	Confident	44 Å²	44	56.4 Å²	56.4	20%	0.204	28%	0.282	C	S	.	.			trans	-118.2	104.7	176.8	-168.1	58.1	0	0	0	110.5	Y128 N135 I137 Y273 W276	H126-Y128 WeakPolarHBondContact O-CA 3.33Å; H126-Y128 PolarHBondContact O-N 2.96Å; H126-N135 HydrophobicContact CB-CB 4.31Å; H126-N135 WeakPolarHBondContact O-CB 3.08Å; H126-I137 HydrophobicContact CB-CG2 3.96Å; H126-Y273 AromaticContact CD2-CE1 3.67Å; H126-W276 HydrophobicContact CB-CD2 4.1Å; H126-W276 HydrophobicContact CB-CG 4.23Å; H126-W276 HydrophobicContact CB-CZ2 4.15Å; H126-W276 AromaticContact CE1-CD1 3.82Å; H126-W276 AromaticContact CG-CD1 3.67Å; H126-W276 AromaticContact CG-NE1 3.79Å; H126-W276 AromaticContact ND1-CD1 3.05Å; H126-W276 AromaticContact ND1-CG 3.71Å; H126-W276 AromaticContact ND1-NE1 3.44Å; H126-W276 PolarHBondContact ND1-NE1 3Å
127	F	80.4	Confident	85.4	Confident	104 Å²	104	54.5 Å²	54.5	46%	0.456	27%	0.27	S	S	.	.	S	Bend	trans	29.5	49	171.2	-54	-69.1	0	0	0	116	N135 P309	F127-N135 PolarHBondContact O-ND2 3.17Å; F127-N135 VanDerWaalsContact O-ND2 3.1Å; F127-P309 HydrophobicContact CD2-CG 4.05Å; F127-P309 HydrophobicContact CE1-CG 4.03Å; F127-P309 HydrophobicContact CE2-CB 4.41Å; F127-P309 HydrophobicContact CE2-CG 3.13Å; F127-P309 HydrophobicContact CZ-CG 3.11Å
128	Y	78.8	Confident	85.3	Confident	28 Å²	28	48.1 Å²	48.1	11%	0.11	24%	0.24	C	C	.	.			trans	-69.1	134.4	-170.7	168.9	-109.1	0	0	0	110.3	T85 H86 H89 H126 D133 D134 D136	T85-Y128 HydrophobicContact CG2-CD1 3.48Å; T85-Y128 VanDerWaalsContact CG2-CD1 3.48Å; T85-Y128 HydrophobicContact CG2-CD2 3.99Å; T85-Y128 HydrophobicContact CG2-CE1 4.15Å; T85-Y128 HydrophobicContact CG2-CG 3.38Å; H86-Y128 HydrophobicContact CB-CE2 4.41Å; H86-Y128 VanDerWaalsContact CB-OH 3.3Å; H86-Y128 WeakPolarHBondContact CB-OH 3.24Å; H89-Y128 HydrophobicContact CB-CD1 4.34Å; H89-Y128 HydrophobicContact CB-CE1 4.07Å; H89-Y128 AromaticContact CG-CE1 3.94Å; H89-Y128 AromaticContact ND1-CE1 3.7Å; H126-Y128 WeakPolarHBondContact O-CA 3.33Å; H126-Y128 PolarHBondContact O-N 2.96Å; Y128-D133 HydrophobicContact CE2-CB 4.28Å; Y128-D133 PolarHBondContact OH-OD1 2.95Å; Y128-D134 WeakPolarHBondContact CA-O 3.07Å; Y128-D134 WeakPolarHBondContact CD2-O 3.19Å; Y128-D136 HydrophobicContact CD2-CB 4.2Å; Y128-D136 HydrophobicContact CE2-CB 4Å
129	K	76.4	Confident	85.3	Confident	104 Å²	104	45.3 Å²	45.3	45%	0.452	23%	0.23	S	C	.	.	B	Isolated β-bridge	trans	-113.8	104.6	176.9	-58.4	178.5	-168	143.5	0	109.9	T131 N132 D133 D134	K129-T131 PolarHBondContact O-N 3.25Å; K129-N132 WeakPolarHBondContact CB-OD1 3.46Å; K129-N132 PolarHBondContact O-N 3.02Å; K129-N132 PolarHBondContact O-OD1 2.77Å; K129-D133 WeakPolarHBondContact O-CA 3.29Å; K129-D133 PolarHBondContact O-N 3.4Å; K129-D134 HydrophobicContact CB-CB 4.11Å; K129-D134 HydrophobicContact CD-CB 4.14Å; K129-D134 HydrophobicContact CG-CB 4.37Å; K129-D134 PolarHBondContact N-O 3.16Å; K129-D134 IonicContact NZ-OD2 3.61Å; K129-D134 PolarHBondContact NZ-OD2 3.33Å; K129-D134 PolarHBondContact O-N 3.12Å
130	S	78.1	Confident	85.3	Confident	73 Å²	73	42.3 Å²	42.3	51%	0.51	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-10.6	-179.3	63.8	0	0	0	0	114.7	N132	S130-N132 VanDerWaalsContact C-N 3.34Å
131	T	75.4	Confident	85.5	Confident	129 Å²	129	43.9 Å²	43.9	79%	0.791	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-25	177.9	49.2	0	0	0	0	113.3	K129	K129-T131 PolarHBondContact O-N 3.25Å
132	N	75.1	Confident	85.9	Confident	96 Å²	96	41.1 Å²	41.1	51%	0.513	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-150.7	15	-173.4	66.2	-21.5	0	0	0	113.3	K129 S130 D134	K129-N132 WeakPolarHBondContact CB-OD1 3.46Å; K129-N132 PolarHBondContact O-N 3.02Å; K129-N132 PolarHBondContact O-OD1 2.77Å; S130-N132 VanDerWaalsContact C-N 3.34Å; N132-D134 PolarHBondContact O-N 3Å; N132-D134 VanDerWaalsContact O-N 3.07Å; N132-D134 VanDerWaalsContact OD1-CB 3.3Å; N132-D134 WeakPolarHBondContact OD1-CB 3.15Å; N132-D134 PolarHBondContact OD1-N 3.14Å
133	D	76.4	Confident	86.1	Confident	47 Å²	47	42.3 Å²	42.3	25%	0.251	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	30.7	-176.1	-60.4	-49.4	0	0	0	114.3	Y128 K129 D136	Y128-D133 HydrophobicContact CE2-CB 4.28Å; Y128-D133 PolarHBondContact OH-OD1 2.95Å; K129-D133 WeakPolarHBondContact O-CA 3.29Å; K129-D133 PolarHBondContact O-N 3.4Å; D133-D136 HydrophobicContact CB-CB 4.3Å; D133-D136 VanDerWaalsContact O-CB 3.3Å; D133-D136 WeakPolarHBondContact O-CB 3.45Å; D133-D136 PolarHBondContact O-N 3.03Å
134	D	77.3	Confident	86.2	Confident	49 Å²	49	46.8 Å²	46.8	26%	0.262	24%	0.24	S	C	.	.	B	Isolated β-bridge	trans	-67.5	139.1	173.5	-173.3	26.3	0	0	0	109.6	Y128 K129 N132 D136	Y128-D134 WeakPolarHBondContact CA-O 3.07Å; Y128-D134 WeakPolarHBondContact CD2-O 3.19Å; K129-D134 HydrophobicContact CB-CB 4.11Å; K129-D134 HydrophobicContact CD-CB 4.14Å; K129-D134 HydrophobicContact CG-CB 4.37Å; K129-D134 PolarHBondContact N-O 3.16Å; K129-D134 IonicContact NZ-OD2 3.61Å; K129-D134 PolarHBondContact NZ-OD2 3.33Å; K129-D134 PolarHBondContact O-N 3.12Å; N132-D134 PolarHBondContact O-N 3Å; N132-D134 VanDerWaalsContact O-N 3.07Å; N132-D134 VanDerWaalsContact OD1-CB 3.3Å; N132-D134 WeakPolarHBondContact OD1-CB 3.15Å; N132-D134 PolarHBondContact OD1-N 3.14Å; D134-D136 VanDerWaalsContact C-N 3.33Å; D134-D136 PolarHBondContact O-N 2.68Å
135	N	82.5	Confident	86.6	Confident	26 Å²	26	46.4 Å²	46.4	14%	0.139	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	42.3	-172.3	-51	-57.8	0	0	0	114.8	H126 F127 I137 Y273	H126-N135 HydrophobicContact CB-CB 4.31Å; H126-N135 WeakPolarHBondContact O-CB 3.08Å; F127-N135 PolarHBondContact O-ND2 3.17Å; F127-N135 VanDerWaalsContact O-ND2 3.1Å; N135-I137 PolarHBondContact O-N 3.4Å; N135-Y273 WeakPolarHBondContact CA-OH 3.34Å; N135-Y273 HydrophobicContact CB-CE1 4.42Å; N135-Y273 PolarHBondContact OD1-OH 2.86Å; N135-Y273 VanDerWaalsContact OD1-OH 3.13Å
136	D	85.6	Confident	87	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.23	C	C	.	.			trans	-74.1	70.9	177.5	-166.9	22.8	0	0	0	112.6	T85 H86 Y128 D133 D134 S253 T268	T85-D136 WeakPolarHBondContact CA-OD1 3.47Å; T85-D136 PolarHBondContact N-OD1 3.03Å; H86-D136 IonicContact CE1-OD2 2.86Å; H86-D136 IonicContact CG-OD2 3.03Å; H86-D136 PolarHBondContact N-OD1 3.47Å; H86-D136 IonicContact ND1-OD1 3.83Å; H86-D136 PolarHBondContact ND1-OD1 3.28Å; H86-D136 IonicContact ND1-OD2 3.62Å; H86-D136 PolarHBondContact ND1-OD2 3.34Å; Y128-D136 HydrophobicContact CD2-CB 4.2Å; Y128-D136 HydrophobicContact CE2-CB 4Å; D133-D136 HydrophobicContact CB-CB 4.3Å; D133-D136 VanDerWaalsContact O-CB 3.3Å; D133-D136 WeakPolarHBondContact O-CB 3.45Å; D133-D136 PolarHBondContact O-N 3.03Å; D134-D136 VanDerWaalsContact C-N 3.33Å; D134-D136 PolarHBondContact O-N 2.68Å; D136-S253 WeakPolarHBondContact CB-OG 3.3Å; D136-S253 VanDerWaalsContact OD2-CA 3.26Å; D136-S253 WeakPolarHBondContact OD2-CA 3.35Å; D136-S253 WeakPolarHBondContact OD2-CB 3.4Å; D136-S253 PolarHBondContact OD2-OG 3.21Å; D136-T268 PolarHBondContact O-OG1 3.04Å
137	I	88.2	Confident	87.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.245	C	C	.	.			trans	-144.2	131.4	178.8	-177	167.1	0	0	0	111.4	T85 H126 N135 I251 T268 L270 Y273 W276	T85-I137 PolarHBondContact OG1-N 3.25Å; T85-I137 PolarHBondContact OG1-O 3.2Å; H126-I137 HydrophobicContact CB-CG2 3.96Å; N135-I137 PolarHBondContact O-N 3.4Å; I137-I251 HydrophobicContact CB-CD1 4.27Å; I137-I251 HydrophobicContact CD1-CD1 3.83Å; I137-I251 HydrophobicContact CG1-CD1 3.63Å; I137-T268 HydrophobicContact CB-CG2 4.15Å; I137-L270 HydrophobicContact CD1-CD2 3.86Å; I137-Y273 HydrophobicContact CD1-CD1 4.41Å; I137-Y273 HydrophobicContact CD1-CG 4.18Å; I137-Y273 HydrophobicContact CG2-CD1 3.69Å; I137-Y273 HydrophobicContact CG2-CE1 3.57Å; I137-Y273 HydrophobicContact CG2-CG 4.41Å; I137-W276 HydrophobicContact CB-CZ3 4.46Å; I137-W276 HydrophobicContact CD1-CE3 3.93Å; I137-W276 HydrophobicContact CD1-CH2 4.33Å; I137-W276 HydrophobicContact CD1-CZ3 3.46Å; I137-W276 VanDerWaalsContact CD1-CZ3 3.46Å; I137-W276 HydrophobicContact CG1-CE3 4.31Å; I137-W276 HydrophobicContact CG1-CH2 3.86Å; I137-W276 HydrophobicContact CG1-CZ3 3.5Å; I137-W276 VanDerWaalsContact CG1-CZ3 3.5Å; I137-W276 HydrophobicContact CG2-CE3 4.41Å; I137-W276 HydrophobicContact CG2-CH2 4.32Å; I137-W276 HydrophobicContact CG2-CZ3 4.18Å
138	A	92.5	Very high	88.3	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	144.1	175.3	0	0	0	0	0	111.2	L82 T83 L88 L124 T125	L82-A138 WeakPolarHBondContact CA-O 2.99Å; T83-A138 HydrophobicContact CG2-CB 4.12Å; T83-A138 PolarHBondContact N-O 3.12Å; T83-A138 PolarHBondContact O-N 2.92Å; L88-A138 HydrophobicContact CD1-CB 3.58Å; L88-A138 HydrophobicContact CG-CB 4.44Å; L124-A138 CarbonylContact O-C 3.48Å; L124-A138 WeakPolarHBondContact O-CA 3.42Å; T125-A138 HydrophobicContact CG2-CB 4.07Å
139	M	95.9	Very high	89	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	117.9	174	-173.1	-178.1	-69.7	0	0	108.9	I70 I80 L82 Y123 L124 W276 I277 L281 L284	I70-M139 HydrophobicContact CD1-CE 4.29Å; I80-M139 HydrophobicContact CG2-CG 3.57Å; I80-M139 HydrophobicContact CG2-SD 3.95Å; L82-M139 HydrophobicContact CD2-CB 3.89Å; L82-M139 HydrophobicContact CD2-CE 3.9Å; L82-M139 HydrophobicContact CD2-CG 4.05Å; Y123-M139 CarbonylContact C-O 3.53Å; Y123-M139 WeakPolarHBondContact CA-O 3.3Å; Y123-M139 WeakPolarHBondContact CB-O 3.27Å; L124-M139 PolarHBondContact N-O 3.12Å; L124-M139 PolarHBondContact O-N 2.99Å; M139-W276 HydrophobicContact CB-CH2 3.79Å; M139-W276 HydrophobicContact CB-CZ3 4.38Å; M139-W276 HydrophobicContact CE-CZ3 4.45Å; M139-I277 HydrophobicContact CE-CB 4.2Å; M139-I277 HydrophobicContact CE-CG1 4.34Å; M139-I277 HydrophobicContact CE-CG2 3.82Å; M139-L281 HydrophobicContact CE-CD2 4.25Å; M139-L281 HydrophobicContact CE-CG 4.05Å; M139-L281 HydrophobicContact SD-CD2 3.81Å; M139-L281 HydrophobicContact SD-CG 4Å; M139-L284 HydrophobicContact CB-CD1 4.06Å; M139-L284 HydrophobicContact CG-CD1 3.51Å; M139-L284 HydrophobicContact SD-CD1 3.57Å; M139-L284 VanDerWaalsContact SD-CD1 3.57Å
140	I	96.5	Very high	89.9	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	134.8	-178.2	-60	161.5	0	0	0	108.2	I54 I80 V81 T83 L88 F102 A120	I54-I140 HydrophobicContact CD1-CD1 4.34Å; I80-I140 WeakPolarHBondContact CA-O 3.49Å; V81-I140 HydrophobicContact CB-CB 4.35Å; V81-I140 PolarHBondContact N-O 2.87Å; V81-I140 PolarHBondContact O-N 2.85Å; T83-I140 HydrophobicContact CG2-CD1 3.54Å; T83-I140 HydrophobicContact CG2-CG1 4.4Å; L88-I140 HydrophobicContact CD1-CD1 4.1Å; L88-I140 HydrophobicContact CD1-CG1 4.14Å; L88-I140 HydrophobicContact CD2-CD1 4.14Å; F102-I140 HydrophobicContact CE1-CB 4.5Å; F102-I140 HydrophobicContact CE1-CD1 3.59Å; F102-I140 HydrophobicContact CE1-CG2 4.02Å; F102-I140 HydrophobicContact CE2-CG2 4.18Å; F102-I140 HydrophobicContact CZ-CB 4.44Å; F102-I140 HydrophobicContact CZ-CD1 3.74Å; F102-I140 HydrophobicContact CZ-CG1 4.5Å; F102-I140 HydrophobicContact CZ-CG2 3.6Å; A120-I140 HydrophobicContact CB-CG2 3.98Å
141	R	95.9	Very high	90.6	Very high	32 Å²	32	39 Å²	39	12%	0.121	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	124.7	166.7	-172.3	171.8	-175.1	-169.9	5.1	109.2	D79 I80 R121 T122 L284 R285	D79-R141 HydrophobicContact CB-CG 4.48Å; D79-R141 CarbonylContact O-C 3.55Å; D79-R141 VanDerWaalsContact O-CA 3.32Å; D79-R141 WeakPolarHBondContact O-CA 3.38Å; D79-R141 IonicContact OD1-NE 3.82Å; D79-R141 IonicContact OD2-CZ 3.33Å; D79-R141 IonicContact OD2-NE 2.74Å; D79-R141 PolarHBondContact OD2-NE 3.2Å; D79-R141 IonicContact OD2-NH2 3.01Å; D79-R141 PolarHBondContact OD2-NH2 2.92Å; I80-R141 HydrophobicContact CD1-CB 4.06Å; I80-R141 HydrophobicContact CD1-CG 4.06Å; R121-R141 WeakPolarHBondContact CA-O 3.49Å; R121-R141 HydrophobicContact CB-CB 4.4Å; R121-R141 HydrophobicContact CB-CG 4.33Å; R121-R141 VanDerWaalsContact CB-O 3.3Å; R121-R141 WeakPolarHBondContact CB-O 3.47Å; R121-R141 PolarHBondContact N-O 2.81Å; T122-R141 HydrophobicContact CG2-CB 4.4Å; T122-R141 PolarHBondContact N-O 3.36Å; T122-R141 PolarHBondContact O-N 2.93Å; R141-L284 HydrophobicContact CB-CB 4.4Å; R141-L284 HydrophobicContact CB-CD1 4.32Å; R141-L284 HydrophobicContact CB-CD2 4.22Å; R141-L284 WeakPolarHBondContact CD-O 3.36Å; R141-L284 PolarHBondContact NH1-O 3.18Å; R141-R285 PolarHBondContact NH1-O 3.44Å
142	L	98.3	Very high	91.6	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	152.9	174.2	-59.6	176.2	0	0	0	110.7	D79 V81 F102 R118 R119 K144 V146	D79-L142 HydrophobicContact CB-CB 4.3Å; D79-L142 PolarHBondContact O-N 3.47Å; V81-L142 HydrophobicContact CG2-CD1 4.11Å; V81-L142 HydrophobicContact CG2-CD2 4.02Å; V81-L142 HydrophobicContact CG2-CG 4.1Å; F102-L142 HydrophobicContact CB-CD2 3.95Å; F102-L142 HydrophobicContact CD1-CD2 4.05Å; F102-L142 HydrophobicContact CD2-CD2 3.64Å; F102-L142 HydrophobicContact CE2-CD2 4.27Å; F102-L142 HydrophobicContact CG-CD2 3.57Å; R118-L142 HydrophobicContact CB-CB 4.4Å; R118-L142 HydrophobicContact CB-CD1 4.32Å; R118-L142 HydrophobicContact CB-CD2 3.92Å; R118-L142 HydrophobicContact CB-CG 4.44Å; R118-L142 HydrophobicContact CG-CD1 4.17Å; R119-L142 CarbonylContact O-C 3.55Å; R119-L142 WeakPolarHBondContact O-CA 3.25Å; L142-K144 VanDerWaalsContact C-N 3.25Å; L142-K144 PolarHBondContact O-N 2.9Å; L142-V146 HydrophobicContact CD1-CG1 4.3Å
143	N	96.3	Very high	92.7	Very high	35 Å²	35	29 Å²	29	19%	0.187	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	-25.1	179	71.9	-37.6	0	0	0	113.6	R119 Y289 T291	R119-N143 HydrophobicContact CB-CB 4.46Å; R119-N143 PolarHBondContact N-OD1 3.05Å; R119-N143 VanDerWaalsContact N-OD1 3.08Å; R119-N143 WeakPolarHBondContact O-CB 3.37Å; R119-N143 PolarHBondContact O-N 3.14Å; R119-N143 PolarHBondContact O-OD1 3.14Å; N143-Y289 HydrophobicContact CB-CE2 4.08Å; N143-T291 HydrophobicContact CB-CG2 4.24Å
144	K	97.2	Very high	93.7	Very high	130 Å²	130	26.9 Å²	26.9	57%	0.565	15%	0.149	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-141.8	144.8	173.5	-64.5	-178	-178.8	-179.3	0	109.1	R118 L142	R118-K144 WeakPolarHBondContact CD-O 3.31Å; R118-K144 PolarHBondContact NE-O 2.99Å; R118-K144 VanDerWaalsContact NE-O 3.15Å; L142-K144 VanDerWaalsContact C-N 3.25Å; L142-K144 PolarHBondContact O-N 2.9Å
145	P	97.8	Very high	94.7	Very high	40 Å²	40	24.6 Å²	24.6	26%	0.26	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	160.7	175.5	27.6	-34.3	0	0	0	112.1	M74 E77 T78 D79 R118	M74-P145 HydrophobicContact CE-CB 3.98Å; M74-P145 HydrophobicContact CE-CG 4.12Å; E77-P145 HydrophobicContact CB-CB 4.21Å; E77-P145 HydrophobicContact CG-CB 4.14Å; E77-P145 WeakPolarHBondContact OE2-CG 3.34Å; T78-P145 CarbonylContact O-C 3.55Å; T78-P145 VanDerWaalsContact O-CA 3.32Å; T78-P145 WeakPolarHBondContact O-CA 3.44Å; D79-P145 HydrophobicContact CB-CB 4.22Å; R118-P145 PolarHBondContact NE-O 3.18Å; R118-P145 PolarHBondContact NH2-O 2.87Å
146	V	97.6	Very high	95.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	131.5	167.8	-65.4	0	0	0	0	108.5	L69 E77 T78 V104 V116 R118 L142 I152	L69-V146 HydrophobicContact CD1-CG2 4.08Å; L69-V146 HydrophobicContact CD2-CG2 4.03Å; E77-V146 CarbonylContact C-O 3.56Å; E77-V146 WeakPolarHBondContact CA-O 3.33Å; E77-V146 VanDerWaalsContact CB-O 3.3Å; E77-V146 WeakPolarHBondContact CB-O 3.29Å; T78-V146 HydrophobicContact CG2-CG2 4.02Å; T78-V146 PolarHBondContact N-O 2.87Å; T78-V146 WeakPolarHBondContact O-CG2 3.49Å; T78-V146 PolarHBondContact O-N 3.17Å; V104-V146 HydrophobicContact CB-CG1 4.43Å; V104-V146 HydrophobicContact CG1-CG1 4.38Å; V104-V146 HydrophobicContact CG1-CG2 4.35Å; V104-V146 HydrophobicContact CG2-CG1 4.34Å; V116-V146 HydrophobicContact CG1-CG1 4.12Å; R118-V146 HydrophobicContact CG-CG1 4.04Å; L142-V146 HydrophobicContact CD1-CG1 4.3Å; V146-I152 HydrophobicContact CB-CG2 4.24Å; V146-I152 HydrophobicContact CG2-CG2 3.95Å
147	T	96.4	Very high	95.8	Very high	84 Å²	84	25.8 Å²	25.8	52%	0.515	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	140.2	-179.7	-49.5	0	0	0	0	109.8	N76	N76-T147 WeakPolarHBondContact O-CG2 3.37Å
148	Y	95.9	Very high	95.9	Very high	19 Å²	19	26.6 Å²	26.6	8%	0.075	15%	0.148	C	C	.	.			trans	-69	149.3	175.9	-54.6	-25.5	0	0	0	111.3	N76 E77 T78 I152 P154	N76-Y148 PolarHBondContact O-N 2.97Å; E77-Y148 PolarHBondContact O-OH 2.83Å; E77-Y148 VanDerWaalsContact O-OH 3.06Å; T78-Y148 HydrophobicContact CG2-CE1 3.79Å; Y148-I152 CarbonylContact C-O 3.58Å; Y148-I152 VanDerWaalsContact CA-O 3.24Å; Y148-I152 WeakPolarHBondContact CA-O 3.23Å; Y148-P154 HydrophobicContact CE1-CG 3.97Å; Y148-P154 HydrophobicContact CE2-CG 4.24Å
149	G	94.2	Very high	95.5	Very high	29 Å²	29	28.9 Å²	28.9	30%	0.299	17%	0.172	S	C	.	.	S	Bend	trans	-170.8	-160.7	-179.8	0	0	0	0	0	111.7	H151 I152	G149-H151 PolarHBondContact O-N 3.12Å; G149-I152 PolarHBondContact N-O 3.45Å
150	S	93.8	Very high	94.6	Very high	59 Å²	59	35.3 Å²	35.3	41%	0.413	21%	0.206	S	C	.	.	S	Bend	trans	-64.5	-29.3	179.5	50.9	0	0	0	0	113.3
151	H	94.6	Very high	93.5	Very high	44 Å²	44	43.3 Å²	43.3	20%	0.204	24%	0.244	C	C	.	.	S	Bend	trans	-111.2	-7.1	-173.4	-48.7	157.5	0	0	0	113.5	H46 P49 G105 D114 G149	H46-H151 HydrophobicContact CB-CB 4.18Å; H46-H151 VanDerWaalsContact CB-CD2 3.49Å; H46-H151 WeakPolarHBondContact CB-CD2 3.47Å; H46-H151 AromaticContact CD2-CD2 3.88Å; H46-H151 AromaticContact CD2-NE2 3.97Å; H46-H151 AromaticContact CG-CD2 3.43Å; H46-H151 VanDerWaalsContact CG-CD2 3.43Å; H46-H151 AromaticContact CG-CG 3.65Å; H46-H151 AromaticContact CG-NE2 4Å; H46-H151 AromaticContact ND1-CD2 3.83Å; H46-H151 AromaticContact ND1-CG 3.53Å; H46-H151 AromaticContact ND1-ND1 3.94Å; P49-H151 VanDerWaalsContact CA-O 3.32Å; P49-H151 WeakPolarHBondContact CA-O 3.34Å; P49-H151 VanDerWaalsContact CB-O 3.29Å; P49-H151 WeakPolarHBondContact CB-O 3.17Å; G105-H151 WeakPolarHBondContact CA-O 3.15Å; D114-H151 WeakPolarHBondContact CB-ND1 3.47Å; D114-H151 IonicContact OD1-CE1 2.87Å; D114-H151 PolarHBondContact OD1-CE1 3.33Å; D114-H151 VanDerWaalsContact OD1-CE1 3.25Å; D114-H151 IonicContact OD1-ND1 2.79Å; D114-H151 PolarHBondContact OD1-ND1 3.1Å; G149-H151 PolarHBondContact O-N 3.12Å
152	I	96.4	Very high	92.2	Very high	14 Å²	14	43.2 Å²	43.2	7%	0.072	25%	0.247	C	C	.	.			trans	-135.6	114.9	-176.3	-59	-178.9	0	0	0	108.5	P49 L69 V104 V116 V146 Y148 G149	P49-I152 WeakPolarHBondContact O-CA 3.37Å; L69-I152 HydrophobicContact CD1-CG2 3.57Å; V104-I152 HydrophobicContact CG1-CD1 3.99Å; V104-I152 HydrophobicContact CG1-CG1 4.13Å; V104-I152 HydrophobicContact CG1-CG2 4.05Å; V116-I152 HydrophobicContact CB-CD1 4.32Å; V116-I152 HydrophobicContact CG2-CD1 3.82Å; V146-I152 HydrophobicContact CB-CG2 4.24Å; V146-I152 HydrophobicContact CG2-CG2 3.95Å; Y148-I152 CarbonylContact C-O 3.58Å; Y148-I152 VanDerWaalsContact CA-O 3.24Å; Y148-I152 WeakPolarHBondContact CA-O 3.23Å; G149-I152 PolarHBondContact N-O 3.45Å
153	S	96.8	Very high	90.9	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.007	26%	0.258	C	S	.	.			trans	-159.6	151.1	170.7	72.5	0	0	0	0	110.2	P49 W50	P49-S153 CarbonylContact C-O 3.59Å; P49-S153 WeakPolarHBondContact CG-OG 3.49Å; P49-S153 PolarHBondContact O-N 2.8Å; P49-S153 VanDerWaalsContact O-N 3.12Å; W50-S153 WeakPolarHBondContact CA-O 3.36Å; W50-S153 VanDerWaalsContact CB-O 3.25Å; W50-S153 WeakPolarHBondContact CB-O 3.35Å; W50-S153 PolarHBondContact N-O 2.98Å; W50-S153 VanDerWaalsContact N-O 3.16Å
154	P	98	Very high	89.8	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.006	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-84.5	159.4	-171.3	33	-34	0	0	0	113	C18 G19 L69 E71 Y148	C18-P154 HydrophobicContact CB-CG 4.21Å; G19-P154 PolarHBondContact N-O 2.91Å; L69-P154 HydrophobicContact CB-CB 4.19Å; L69-P154 WeakPolarHBondContact O-CA 3.38Å; E71-P154 HydrophobicContact CG-CB 4.18Å; E71-P154 HydrophobicContact CG-CG 3.53Å; Y148-P154 HydrophobicContact CE1-CG 3.97Å; Y148-P154 HydrophobicContact CE2-CG 4.24Å
155	L	97.9	Very high	88.5	Confident	1 Å²	1	46 Å²	46	1%	0.005	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-79	150.4	163.1	-79.6	168.7	0	0	0	110.8	W50 F68 L69 P237 F239 A248	W50-L155 HydrophobicContact CB-CD1 4.27Å; W50-L155 HydrophobicContact CB-CG 3.82Å; W50-L155 HydrophobicContact CD2-CD1 4.22Å; W50-L155 HydrophobicContact CD2-CD2 3.6Å; W50-L155 HydrophobicContact CD2-CG 3.59Å; W50-L155 HydrophobicContact CE3-CD2 3.87Å; W50-L155 HydrophobicContact CE3-CG 4.1Å; W50-L155 HydrophobicContact CG-CD1 3.77Å; W50-L155 HydrophobicContact CG-CD2 4.02Å; W50-L155 HydrophobicContact CG-CG 3.45Å; W50-L155 VanDerWaalsContact CG-CG 3.45Å; W50-L155 HydrophobicContact CH2-CD2 4.28Å; W50-L155 HydrophobicContact CZ2-CD2 4.03Å; W50-L155 HydrophobicContact CZ3-CD2 4.2Å; F68-L155 HydrophobicContact CB-CD1 4.19Å; F68-L155 HydrophobicContact CD2-CB 4.33Å; F68-L155 HydrophobicContact CD2-CD1 3.91Å; F68-L155 HydrophobicContact CG-CD1 4.17Å; L69-L155 PolarHBondContact O-N 3.09Å; L155-P237 HydrophobicContact CD1-CB 3.68Å; L155-P237 HydrophobicContact CD1-CG 3.73Å; L155-F239 HydrophobicContact CD1-CB 3.96Å; L155-F239 HydrophobicContact CD1-CG 4.33Å; L155-F239 HydrophobicContact CD2-CB 3.98Å; L155-F239 HydrophobicContact CD2-CD2 4.37Å; L155-F239 HydrophobicContact CD2-CG 4.31Å; L155-A248 HydrophobicContact CB-CB 4.11Å; L155-A248 HydrophobicContact CD1-CB 3.85Å
156	C	96.5	Very high	87	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.02	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-74.3	148.7	166	-62.1	0	0	0	0	110.3	C18 Y246 F247 A248	C18-C156 HydrophobicContact CB-CB 3.96Å; C18-C156 WeakPolarHBondContact CB-SG 3.39Å; C18-C156 PolarHBondContact O-SG 3.04Å; C18-C156 WeakPolarHBondContact SG-CA 2.97Å; C18-C156 WeakPolarHBondContact SG-CB 3.49Å; C18-C156 CovalentContact SG-SG 2.05Å; C18-C156 PolarHBondContact SG-SG 3.02Å; C156-Y246 PolarHBondContact N-O 3.14Å; C156-Y246 VanDerWaalsContact N-O 3.08Å; C156-F247 HydrophobicContact CB-CD1 3.35Å; C156-F247 HydrophobicContact CB-CD2 4.19Å; C156-F247 HydrophobicContact CB-CE1 3.39Å; C156-F247 HydrophobicContact CB-CE2 4.23Å; C156-F247 HydrophobicContact CB-CG 3.76Å; C156-F247 HydrophobicContact CB-CZ 3.85Å; C156-F247 CarbonylContact O-C 3.52Å; C156-F247 VanDerWaalsContact O-CA 3.32Å; C156-F247 WeakPolarHBondContact O-CA 3.37Å; C156-A248 PolarHBondContact O-N 2.88Å
157	L	95.4	Very high	85.6	Confident	48 Å²	48	57.2 Å²	57.2	25%	0.251	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-94.6	149.1	168.6	-71.8	178.1	0	0	0	110.6	I70 L82 F247 L270 I277	I70-L157 HydrophobicContact CB-CD1 4.44Å; I70-L157 HydrophobicContact CB-CG 4.47Å; I70-L157 HydrophobicContact CD1-CD1 3.84Å; I70-L157 HydrophobicContact CG2-CD1 4.31Å; I70-L157 HydrophobicContact CG2-CD2 3.95Å; I70-L157 HydrophobicContact CG2-CG 4.03Å; L82-L157 HydrophobicContact CD1-CD2 3.87Å; L157-F247 WeakPolarHBondContact O-CD1 3.27Å; L157-F247 WeakPolarHBondContact O-CE1 3.35Å; L157-L270 HydrophobicContact CD2-CD1 4.22Å; L157-I277 HydrophobicContact CD1-CD1 4.21Å; L157-I277 HydrophobicContact CD1-CG2 3.69Å
158	P	89.1	Confident	84.1	Confident	17 Å²	17	53.8 Å²	53.8	11%	0.11	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-71.1	160	175.5	32.4	-32.3	0	0	0	109.1	A248 L249 L270	P158-A248 VanDerWaalsContact CD-O 3.22Å; P158-A248 WeakPolarHBondContact CD-O 3.47Å; P158-L249 HydrophobicContact CB-CD2 4.1Å; P158-L249 HydrophobicContact CG-CD2 4.48Å; P158-L270 HydrophobicContact CG-CB 3.93Å
159	G	84.1	Confident	83	Confident	48 Å²	48	56.2 Å²	56.2	50%	0.495	31%	0.309	S	S	.	.			trans	-70.4	-166.3	164.6	0	0	0	0	0	111.7	E161	G159-E161 PolarHBondContact O-N 2.84Å
160	D	78.5	Confident	82.4	Confident	135 Å²	135	54.9 Å²	54.9	72%	0.722	30%	0.295	S	S	*	.	S	Bend	trans	-66.6	-19.7	177.5	-62.7	-34.3	0	0	0	112.5
161	E	72.5	Confident	81.9	Confident	169 Å²	169	52.3 Å²	52.3	79%	0.79	28%	0.276	S	S	*	.	S	Bend	trans	-107.3	141.3	170	-63.6	-172.8	176.8	0	0	110.5	G159 P163	G159-E161 PolarHBondContact O-N 2.84Å; E161-P163 VanDerWaalsContact O-CD 3.28Å; E161-P163 WeakPolarHBondContact O-CD 3.3Å
162	T	68	Low	81.3	Confident	29 Å²	29	50.7 Å²	50.7	18%	0.178	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-70	121.2	171.9	-47.2	0	0	0	0	109	F202 L249 S271	T162-F202 HydrophobicContact CG2-CE1 4.32Å; T162-F202 HydrophobicContact CG2-CE2 3.36Å; T162-F202 HydrophobicContact CG2-CZ 3.2Å; T162-F202 WeakPolarHBondContact OG1-CE2 3.39Å; T162-F202 WeakPolarHBondContact OG1-CZ 3.47Å; T162-L249 HydrophobicContact CG2-CD1 3.91Å; T162-L249 HydrophobicContact CG2-CD2 4.29Å; T162-S271 PolarHBondContact OG1-OG 3.41Å
163	P	71.3	Confident	80.8	Confident	37 Å²	37	50.3 Å²	50.3	24%	0.24	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-61.1	150.8	178.5	24	-35.9	0	0	0	112.3	E161 V165 I242 L249	E161-P163 VanDerWaalsContact O-CD 3.28Å; E161-P163 WeakPolarHBondContact O-CD 3.3Å; P163-V165 PolarHBondContact O-N 3.32Å; P163-I242 HydrophobicContact CB-CD1 3.71Å; P163-I242 HydrophobicContact CB-CG2 4.33Å; P163-I242 HydrophobicContact CG-CD1 3.25Å; P163-L249 HydrophobicContact CG-CD2 4.12Å
164	K	73	Confident	80.2	Confident	168 Å²	168	50.5 Å²	50.5	73%	0.73	27%	0.271	S	S	*	.	P	Polyproline II helix	trans	-66.9	126.8	171.3	-71.8	-178	-177.6	173.7	0	109.1
165	V	70.5	Confident	79.3	Confident	20 Å²	20	51.1 Å²	51.1	12%	0.121	27%	0.273	C	S	.	.			trans	-94.4	111.6	174.4	-176.9	0	0	0	0	108.2	P163 N167 G168 F196 C240 I242 L249	P163-V165 PolarHBondContact O-N 3.32Å; V165-N167 VanDerWaalsContact C-N 3.26Å; V165-N167 PolarHBondContact O-N 3.33Å; V165-N167 VanDerWaalsContact O-N 3.12Å; V165-G168 PolarHBondContact O-N 2.96Å; V165-F196 HydrophobicContact CB-CE2 3.76Å; V165-F196 HydrophobicContact CB-CZ 4.1Å; V165-F196 HydrophobicContact CG1-CE2 4.4Å; V165-F196 HydrophobicContact CG2-CE2 3.66Å; V165-F196 HydrophobicContact CG2-CZ 3.49Å; V165-F196 VanDerWaalsContact CG2-CZ 3.49Å; V165-C240 HydrophobicContact CG1-CB 4.03Å; V165-C240 HydrophobicContact CG2-CB 3.94Å; V165-I242 HydrophobicContact CG2-CD1 4.15Å; V165-I242 HydrophobicContact CG2-CG1 4.43Å; V165-L249 HydrophobicContact CG2-CD1 3.89Å
166	E	65.9	Low	77.8	Confident	159 Å²	159	51.3 Å²	51.3	74%	0.743	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-39.5	-169.1	-68.1	-176.6	153.2	0	0	114
167	N	68.2	Low	76	Confident	117 Å²	117	53 Å²	53	63%	0.626	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-3.2	177.5	-64.5	-18.6	0	0	0	113.7	V165 E169	V165-N167 VanDerWaalsContact C-N 3.26Å; V165-N167 PolarHBondContact O-N 3.33Å; V165-N167 VanDerWaalsContact O-N 3.12Å; N167-E169 HydrophobicContact CB-CB 4.3Å; N167-E169 HydrophobicContact CB-CG 3.93Å; N167-E169 PolarHBondContact O-N 3.01Å
168	G	66.3	Low	73.8	Confident	12 Å²	12	51.3 Å²	51.3	12%	0.124	28%	0.278	C	S	.	.			trans	61.6	17.3	-170.2	0	0	0	0	0	114.3	V165 K194 C195	V165-G168 PolarHBondContact O-N 2.96Å; G168-K194 VanDerWaalsContact O-CA 3.28Å; G168-K194 WeakPolarHBondContact O-CA 2.87Å; G168-K194 PolarHBondContact O-N 3.07Å; G168-K194 VanDerWaalsContact O-N 3.11Å; G168-C195 PolarHBondContact O-N 3.35Å; G168-C195 VanDerWaalsContact O-N 3.13Å
169	E	72	Confident	71.7	Confident	70 Å²	70	53.2 Å²	53.2	33%	0.327	29%	0.285	S	S	.	.			trans	-95.6	126	-179.2	-66.3	-179.8	146.1	0	0	110	N167 L191	N167-E169 HydrophobicContact CB-CB 4.3Å; N167-E169 HydrophobicContact CB-CG 3.93Å; N167-E169 PolarHBondContact O-N 3.01Å; E169-L191 HydrophobicContact CB-CD1 3.93Å
170	C	80.6	Confident	69.6	Low	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	165.5	175.6	-57.8	0	0	0	0	109.3	L192 C195 L238 F239 C240	C170-L192 PolarHBondContact N-O 2.92Å; C170-L192 WeakPolarHBondContact O-CA 3.48Å; C170-L192 WeakPolarHBondContact O-CB 3.1Å; C170-L192 PolarHBondContact O-N 3.25Å; C170-C195 HydrophobicContact CB-CB 4.49Å; C170-L238 HydrophobicContact CB-CD1 3.81Å; C170-L238 HydrophobicContact CB-CG 4.15Å; C170-F239 CarbonylContact C-O 3.54Å; C170-F239 WeakPolarHBondContact CA-O 3.06Å; C170-F239 WeakPolarHBondContact CB-O 3.17Å; C170-C240 HydrophobicContact CB-CB 3.96Å; C170-C240 WeakPolarHBondContact CB-SG 3.3Å; C170-C240 WeakPolarHBondContact SG-CB 3.28Å; C170-C240 CovalentContact SG-SG 2.03Å; C170-C240 PolarHBondContact SG-SG 3.37Å
171	F	83.4	Confident	68.1	Low	6 Å²	6	55.2 Å²	55.2	3%	0.026	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	143	-178.3	-62.5	-98.8	0	0	0	109.1	P25 K27 V190 L191 F239 Y246	P25-F171 HydrophobicContact CB-CE1 4.45Å; K27-F171 HydrophobicContact CG-CZ 4.33Å; F171-V190 WeakPolarHBondContact CA-O 3.47Å; F171-L191 HydrophobicContact CD1-CD1 4.01Å; F171-L191 HydrophobicContact CD2-CD1 4.16Å; F171-L191 HydrophobicContact CE1-CB 4.39Å; F171-L191 HydrophobicContact CE1-CD1 3.65Å; F171-L191 HydrophobicContact CE2-CD1 3.78Å; F171-L191 HydrophobicContact CG-CD1 4.26Å; F171-L191 HydrophobicContact CZ-CD1 3.52Å; F171-F239 HydrophobicContact CB-CD1 4.14Å; F171-F239 HydrophobicContact CB-CD2 3.9Å; F171-F239 HydrophobicContact CB-CE1 3.65Å; F171-F239 HydrophobicContact CB-CE2 3.35Å; F171-F239 HydrophobicContact CB-CG 4.26Å; F171-F239 HydrophobicContact CB-CZ 3.21Å; F171-F239 HydrophobicContact CD2-CD2 4.35Å; F171-F239 HydrophobicContact CD2-CE2 4.05Å; F171-F239 HydrophobicContact CG-CD2 4.42Å; F171-F239 AromaticContact CG-CE2 3.79Å; F171-F239 HydrophobicContact CG-CE2 3.79Å; F171-F239 HydrophobicContact CG-CZ 4.04Å; F171-F239 PolarHBondContact N-O 3.01Å; F171-F239 WeakPolarHBondContact O-CD1 3.4Å; F171-F239 PolarHBondContact O-N 2.91Å; F171-Y246 AromaticContact CD2-CE1 3.98Å; F171-Y246 HydrophobicContact CD2-CE1 3.98Å; F171-Y246 AromaticContact CE2-CE1 3.75Å; F171-Y246 HydrophobicContact CE2-CE1 3.75Å; F171-Y246 HydrophobicContact CZ-CE1 4.47Å
172	A	83.8	Confident	66.9	Low	9 Å²	9	52.2 Å²	52.2	7%	0.074	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	148.5	160.3	0	0	0	0	0	108.1	D189 V190 L192	A172-D189 CarbonylContact O-C 3.4Å; A172-D189 WeakPolarHBondContact O-CA 3.41Å; A172-V190 HydrophobicContact CB-CG1 3.98Å; A172-V190 PolarHBondContact N-O 3.3Å; A172-V190 VanDerWaalsContact N-O 3.08Å; A172-V190 PolarHBondContact O-N 3.46Å; A172-L192 HydrophobicContact CB-CD1 3.72Å
173	A	85	Confident	66.3	Low	7 Å²	7	54.8 Å²	54.8	6%	0.058	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	153.1	-178.5	0	0	0	0	0	111.2	L48 M51 L187 Q188 D189 S236 F239	L48-A173 HydrophobicContact CD1-CB 3.45Å; L48-A173 VanDerWaalsContact CD1-CB 3.45Å; M51-A173 HydrophobicContact CE-CB 4.26Å; M51-A173 WeakPolarHBondContact CE-O 3.39Å; M51-A173 HydrophobicContact SD-CB 4.34Å; A173-L187 HydrophobicContact CB-CD1 4.47Å; A173-Q188 CarbonylContact C-O 3.47Å; A173-Q188 WeakPolarHBondContact CA-O 3.38Å; A173-Q188 VanDerWaalsContact CB-O 3.31Å; A173-Q188 WeakPolarHBondContact CB-O 3.43Å; A173-D189 HydrophobicContact CB-CB 4Å; A173-S236 WeakPolarHBondContact O-CB 3.48Å; A173-F239 HydrophobicContact CB-CE1 4.23Å
174	G	84.4	Confident	65.8	Low	4 Å²	4	53.5 Å²	53.5	4%	0.041	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.8	179.6	176.5	0	0	0	0	0	113.6	Q188 D233	G174-Q188 PolarHBondContact N-O 3.13Å; G174-Q188 PolarHBondContact O-N 3.21Å; G174-Q188 VanDerWaalsContact O-N 3.12Å; G174-D233 VanDerWaalsContact C-OD1 3.28Å; G174-D233 WeakPolarHBondContact CA-OD1 3.33Å
175	W	78.2	Confident	65.4	Low	14 Å²	14	46.8 Å²	46.8	5%	0.053	24%	0.242	C	C	.	.	S	Bend	trans	-103.7	20.5	-180	-64.6	-86.3	0	0	0	112.2	M51 M53 A106 H107 V109 L187 D233	M51-W175 HydrophobicContact CB-CH2 3.53Å; M51-W175 HydrophobicContact CB-CZ2 4.39Å; M51-W175 HydrophobicContact CB-CZ3 4.06Å; M51-W175 HydrophobicContact CE-CZ3 4.08Å; M53-W175 HydrophobicContact CB-CE3 4.06Å; M53-W175 HydrophobicContact CB-CH2 4.36Å; M53-W175 HydrophobicContact CB-CZ3 3.97Å; A106-W175 WeakPolarHBondContact O-CZ2 3.39Å; H107-W175 PolarHBondContact O-NE1 2.81Å; V109-W175 HydrophobicContact CG1-CD2 4.37Å; V109-W175 HydrophobicContact CG1-CG 4.05Å; W175-L187 HydrophobicContact CD2-CD1 3.73Å; W175-L187 HydrophobicContact CE3-CD1 4.01Å; W175-L187 HydrophobicContact CG-CD1 4.32Å; W175-L187 HydrophobicContact CH2-CD1 4.04Å; W175-L187 HydrophobicContact CZ2-CB 4.21Å; W175-L187 HydrophobicContact CZ2-CD1 3.71Å; W175-L187 HydrophobicContact CZ2-CD2 4.28Å; W175-L187 HydrophobicContact CZ2-CG 4.29Å; W175-L187 HydrophobicContact CZ3-CD1 4.16Å; W175-D233 PolarHBondContact N-OD1 2.8Å
176	G	67.8	Low	65.5	Low	6 Å²	6	46.1 Å²	46.1	6%	0.062	24%	0.238	C	C	.	.			trans	-67.4	-178.8	-170	0	0	0	0	0	116.2	T178 V184 S231 D233	G176-T178 PolarHBondContact O-N 3.45Å; G176-V184 WeakPolarHBondContact O-CG2 3.01Å; G176-S231 CarbonylContact C-O 3.6Å; G176-S231 WeakPolarHBondContact CA-O 3.16Å; G176-D233 WeakPolarHBondContact CA-OD1 3.32Å; G176-D233 PolarHBondContact N-OD1 2.77Å
177	T	57.7	Low	65.9	Low	37 Å²	37	38.7 Å²	38.7	23%	0.227	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-75.7	125.4	-179.5	-58.8	0	0	0	0	109.8	E181 S231	T177-E181 VanDerWaalsContact CG2-CA 3.44Å; T177-E181 HydrophobicContact CG2-CB 4.39Å; T177-S231 PolarHBondContact N-O 2.8Å
178	T	49.2	Very low	66.1	Low	13 Å²	13	33.5 Å²	33.5	8%	0.08	18%	0.175	C	C	.	.			trans	-79.8	171.1	173.8	60.1	0	0	0	0	111.4	I37 G176 R180 E181 L182 V184	I37-T178 HydrophobicContact CD1-CG2 4.07Å; I37-T178 HydrophobicContact CG1-CG2 3.68Å; G176-T178 PolarHBondContact O-N 3.45Å; T178-R180 PolarHBondContact O-N 2.83Å; T178-E181 WeakPolarHBondContact O-CA 3.15Å; T178-E181 PolarHBondContact O-N 3.25Å; T178-L182 PolarHBondContact N-O 3.06Å; T178-L182 PolarHBondContact OG1-O 3.1Å; T178-L182 VanDerWaalsContact OG1-O 3.06Å; T178-V184 HydrophobicContact CG2-CB 4.37Å; T178-V184 HydrophobicContact CG2-CG1 3.39Å; T178-V184 HydrophobicContact CG2-CG2 4.09Å
179	E	45.9	Very low	66.2	Low	57 Å²	57	33 Å²	33	27%	0.266	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-18.6	177.4	-62.7	-171.4	160.5	0	0	114.2	V38 E181 L217	V38-E179 WeakPolarHBondContact CG2-OE1 3.28Å; E179-E181 PolarHBondContact O-N 2.73Å; E179-L217 HydrophobicContact CB-CD2 4.49Å
180	R	39.1	Very low	65.8	Low	173 Å²	173	30.9 Å²	30.9	65%	0.653	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.9	5.5	172.8	-64.5	-172.2	-179.4	-170.5	0.8	113.4	T178 L182	T178-R180 PolarHBondContact O-N 2.83Å; R180-L182 HydrophobicContact CB-CG 4.48Å; R180-L182 PolarHBondContact O-N 2.97Å; R180-L182 VanDerWaalsContact O-N 3.07Å
181	E	47.5	Very low	65	Low	53 Å²	53	32.1 Å²	32.1	25%	0.248	17%	0.168	C	C	.	.	S	Bend	trans	56.2	17.4	-171.7	-62.4	-174.1	-164.6	0	0	114.2	T177 T178 E179 R229	T177-E181 VanDerWaalsContact CG2-CA 3.44Å; T177-E181 HydrophobicContact CG2-CB 4.39Å; T178-E181 WeakPolarHBondContact O-CA 3.15Å; T178-E181 PolarHBondContact O-N 3.25Å; E179-E181 PolarHBondContact O-N 2.73Å; E181-R229 PolarHBondContact O-NH1 3.39Å; E181-R229 IonicContact OE2-NH2 3.76Å; E181-R229 PolarHBondContact OE2-NH2 2.84Å
182	L	47.7	Very low	63.9	Low	105 Å²	105	33 Å²	33	55%	0.55	17%	0.173	S	C	.	.	P	Polyproline II helix	trans	-99.4	125.5	176.5	-65.4	175.2	0	0	0	108.4	T178 R180 V184	T178-L182 PolarHBondContact N-O 3.06Å; T178-L182 PolarHBondContact OG1-O 3.1Å; T178-L182 VanDerWaalsContact OG1-O 3.06Å; R180-L182 HydrophobicContact CB-CG 4.48Å; R180-L182 PolarHBondContact O-N 2.97Å; R180-L182 VanDerWaalsContact O-N 3.07Å; L182-V184 PolarHBondContact O-N 3.13Å
183	P	54.7	Low	62.5	Low	84 Å²	84	37 Å²	37	55%	0.545	20%	0.198	S	C	.	.	B	Isolated β-bridge	trans	-56.9	139.3	164.1	24.7	-30.2	0	0	0	108.2
184	V	60.3	Low	60.9	Low	10 Å²	10	45 Å²	45	6%	0.061	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-98.1	127.4	177.7	-79	0	0	0	0	109.5	G176 T178 L182 A186 Q188	G176-V184 WeakPolarHBondContact O-CG2 3.01Å; T178-V184 HydrophobicContact CG2-CB 4.37Å; T178-V184 HydrophobicContact CG2-CG1 3.39Å; T178-V184 HydrophobicContact CG2-CG2 4.09Å; L182-V184 PolarHBondContact O-N 3.13Å; V184-A186 VanDerWaalsContact C-N 3.32Å; V184-Q188 HydrophobicContact CB-CG 4.3Å; V184-Q188 HydrophobicContact CG2-CG 3.64Å
185	S	66.1	Low	59.3	Low	27 Å²	27	45 Å²	45	19%	0.189	23%	0.231	C	C	.	.	S	Bend	trans	-68.7	-37.8	-179.9	-34.4	0	0	0	0	110.7	N108 V109 E110	N108-S185 CarbonylContact C-O 3.59Å; N108-S185 WeakPolarHBondContact CA-O 3.41Å; N108-S185 WeakPolarHBondContact OD1-CB 3.38Å; N108-S185 PolarHBondContact OD1-O 2.92Å; V109-S185 PolarHBondContact N-O 3.16Å; E110-S185 VanDerWaalsContact CD-CB 3.41Å; E110-S185 WeakPolarHBondContact OE1-CB 3.41Å; E110-S185 PolarHBondContact OE1-OG 3.2Å
186	A	72.3	Confident	57.8	Low	5 Å²	5	46.4 Å²	46.4	4%	0.041	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-87.6	136.5	176.5	0	0	0	0	0	112.3	E42 V184 Q188	E42-A186 HydrophobicContact CG-CB 4.04Å; E42-A186 WeakPolarHBondContact OE1-CB 3.25Å; V184-A186 VanDerWaalsContact C-N 3.32Å; A186-Q188 WeakPolarHBondContact O-CG 3.21Å; A186-Q188 PolarHBondContact O-N 2.03Å; A186-Q188 PolarHBondContact O-NE2 3.32Å
187	L	73.5	Confident	56.7	Low	4 Å²	4	56.3 Å²	56.3	2%	0.021	27%	0.273	C	S	.	.			trans	-57.1	134	176.9	-177.4	66.8	0	0	0	110.8	A43 L48 M51 H107 A173 W175	A43-L187 HydrophobicContact CB-CD2 4.3Å; A43-L187 HydrophobicContact CB-CG 4.26Å; A43-L187 PolarHBondContact N-O 3.35Å; L48-L187 HydrophobicContact CB-CD2 3.76Å; L48-L187 HydrophobicContact CD1-CD2 3.71Å; L48-L187 HydrophobicContact CD1-CG 4.32Å; L48-L187 HydrophobicContact CG-CD2 4.23Å; M51-L187 HydrophobicContact CB-CD2 4.29Å; M51-L187 HydrophobicContact CE-CD1 4.26Å; M51-L187 HydrophobicContact CG-CD1 4.49Å; M51-L187 HydrophobicContact CG-CD2 4.02Å; H107-L187 WeakPolarHBondContact O-CB 3.48Å; H107-L187 PolarHBondContact O-N 2.93Å; A173-L187 HydrophobicContact CB-CD1 4.47Å; W175-L187 HydrophobicContact CD2-CD1 3.73Å; W175-L187 HydrophobicContact CE3-CD1 4.01Å; W175-L187 HydrophobicContact CG-CD1 4.32Å; W175-L187 HydrophobicContact CH2-CD1 4.04Å; W175-L187 HydrophobicContact CZ2-CB 4.21Å; W175-L187 HydrophobicContact CZ2-CD1 3.71Å; W175-L187 HydrophobicContact CZ2-CD2 4.28Å; W175-L187 HydrophobicContact CZ2-CG 4.29Å; W175-L187 HydrophobicContact CZ3-CD1 4.16Å
188	Q	72	Confident	55.7	Low	8 Å²	8	64.8 Å²	64.8	4%	0.037	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	148.8	177.7	-52.2	-69.3	-63.8	0	0	110.2	I37 W41 A173 G174 V184 A186	I37-Q188 HydrophobicContact CD1-CB 3.11Å; I37-Q188 HydrophobicContact CD1-CG 3.27Å; W41-Q188 WeakPolarHBondContact O-CA 3.38Å; W41-Q188 PolarHBondContact O-OE1 3.11Å; A173-Q188 CarbonylContact C-O 3.47Å; A173-Q188 WeakPolarHBondContact CA-O 3.38Å; A173-Q188 VanDerWaalsContact CB-O 3.31Å; A173-Q188 WeakPolarHBondContact CB-O 3.43Å; G174-Q188 PolarHBondContact N-O 3.13Å; G174-Q188 PolarHBondContact O-N 3.21Å; G174-Q188 VanDerWaalsContact O-N 3.12Å; V184-Q188 HydrophobicContact CB-CG 4.3Å; V184-Q188 HydrophobicContact CG2-CG 3.64Å; A186-Q188 WeakPolarHBondContact O-CG 3.21Å; A186-Q188 PolarHBondContact O-N 2.03Å; A186-Q188 PolarHBondContact O-NE2 3.32Å
189	D	68.5	Low	55.2	Low	2 Å²	2	66.5 Å²	66.5	1%	0.011	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	153.4	176.6	66.3	-24.3	0	0	0	111.5	G40 W41 A43 L48 A172 A173	G40-D189 CarbonylContact C-O 3.55Å; G40-D189 WeakPolarHBondContact CA-O 3.42Å; W41-D189 PolarHBondContact N-O 3.44Å; W41-D189 PolarHBondContact NE1-OD1 3.03Å; W41-D189 PolarHBondContact NE1-OD2 3.21Å; W41-D189 PolarHBondContact O-N 3.42Å; W41-D189 VanDerWaalsContact O-OD1 3.11Å; A43-D189 VanDerWaalsContact CA-OD1 3.28Å; A43-D189 WeakPolarHBondContact CA-OD1 3.43Å; A43-D189 HydrophobicContact CB-CB 4.18Å; A43-D189 PolarHBondContact N-OD1 3.22Å; L48-D189 HydrophobicContact CD1-CB 3.84Å; A172-D189 CarbonylContact O-C 3.4Å; A172-D189 WeakPolarHBondContact O-CA 3.41Å; A173-D189 HydrophobicContact CB-CB 4Å
190	V	64.9	Low	54.9	Low	24 Å²	24	70 Å²	70	15%	0.145	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	129.3	176.1	57.5	0	0	0	0	109.3	N39 F171 A172 L192	N39-V190 HydrophobicContact CB-CG2 3.95Å; N39-V190 WeakPolarHBondContact O-CG2 3.11Å; F171-V190 WeakPolarHBondContact CA-O 3.47Å; A172-V190 HydrophobicContact CB-CG1 3.98Å; A172-V190 PolarHBondContact N-O 3.3Å; A172-V190 VanDerWaalsContact N-O 3.08Å; A172-V190 PolarHBondContact O-N 3.46Å; V190-L192 HydrophobicContact CG1-CD2 3.96Å; V190-L192 HydrophobicContact CG1-CG 4.19Å; V190-L192 HydrophobicContact CG2-CD2 3.9Å
191	L	63.3	Low	54.7	Low	26 Å²	26	69.9 Å²	69.9	14%	0.136	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	118.7	166	-174.3	67.9	0	0	0	108.7	K27 W41 E169 F171 P193	K27-L191 VanDerWaalsContact O-CD2 3.24Å; K27-L191 WeakPolarHBondContact O-CD2 3.44Å; W41-L191 HydrophobicContact CH2-CB 3.53Å; W41-L191 HydrophobicContact CZ2-CB 4.29Å; W41-L191 HydrophobicContact CZ3-CB 4.34Å; E169-L191 HydrophobicContact CB-CD1 3.93Å; F171-L191 HydrophobicContact CD1-CD1 4.01Å; F171-L191 HydrophobicContact CD2-CD1 4.16Å; F171-L191 HydrophobicContact CE1-CB 4.39Å; F171-L191 HydrophobicContact CE1-CD1 3.65Å; F171-L191 HydrophobicContact CE2-CD1 3.78Å; F171-L191 HydrophobicContact CG-CD1 4.26Å; F171-L191 HydrophobicContact CZ-CD1 3.52Å; L191-P193 VanDerWaalsContact O-CD 3.27Å; L191-P193 WeakPolarHBondContact O-CD 3.5Å
192	L	60.4	Low	54.5	Low	26 Å²	26	70 Å²	70	14%	0.136	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	106.2	-179.7	-62.1	174.2	0	0	0	108.9	C170 A172 V190 K194 C195 I210 L238	C170-L192 PolarHBondContact N-O 2.92Å; C170-L192 WeakPolarHBondContact O-CA 3.48Å; C170-L192 WeakPolarHBondContact O-CB 3.1Å; C170-L192 PolarHBondContact O-N 3.25Å; A172-L192 HydrophobicContact CB-CD1 3.72Å; V190-L192 HydrophobicContact CG1-CD2 3.96Å; V190-L192 HydrophobicContact CG1-CG 4.19Å; V190-L192 HydrophobicContact CG2-CD2 3.9Å; L192-K194 PolarHBondContact O-N 2.72Å; L192-C195 WeakPolarHBondContact CB-SG 3.39Å; L192-C195 PolarHBondContact O-SG 3.26Å; L192-C195 VanDerWaalsContact O-SG 3.33Å; L192-I210 HydrophobicContact CD1-CD1 3.6Å; L192-I210 HydrophobicContact CD1-CG2 4.33Å; L192-I210 HydrophobicContact CD2-CG2 4.22Å; L192-L238 HydrophobicContact CD1-CD1 3.85Å
193	P	53.3	Low	53.6	Low	92 Å²	92	67.5 Å²	67.5	60%	0.597	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	131.3	177.6	28.2	-32.8	0	0	0	109.9	L191	L191-P193 VanDerWaalsContact O-CD 3.27Å; L191-P193 WeakPolarHBondContact O-CD 3.5Å
194	K	52.6	Low	52.7	Low	174 Å²	174	70 Å²	70	76%	0.757	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	63.8	171.7	-56.7	178.1	-178.4	176	0	113	G168 L192 F196	G168-K194 VanDerWaalsContact O-CA 3.28Å; G168-K194 WeakPolarHBondContact O-CA 2.87Å; G168-K194 PolarHBondContact O-N 3.07Å; G168-K194 VanDerWaalsContact O-N 3.11Å; L192-K194 PolarHBondContact O-N 2.72Å; K194-F196 PolarHBondContact O-N 3.44Å; K194-F196 VanDerWaalsContact O-N 3.15Å
195	C	50.4	Low	51.5	Low	5 Å²	5	76.5 Å²	76.5	3%	0.034	39%	0.387	C	S	.	.			trans	-66.5	-12.4	176.4	-60.5	0	0	0	0	113.4	G168 C170 L192 F208 I210	G168-C195 PolarHBondContact O-N 3.35Å; G168-C195 VanDerWaalsContact O-N 3.13Å; C170-C195 HydrophobicContact CB-CB 4.49Å; L192-C195 WeakPolarHBondContact CB-SG 3.39Å; L192-C195 PolarHBondContact O-SG 3.26Å; L192-C195 VanDerWaalsContact O-SG 3.33Å; C195-F208 HydrophobicContact CB-CD1 4.16Å; C195-F208 HydrophobicContact CB-CE1 3.6Å; C195-F208 WeakPolarHBondContact O-CD1 3.45Å; C195-F208 VanDerWaalsContact O-CE1 3.32Å; C195-F208 WeakPolarHBondContact O-CE1 3.29Å; C195-I210 HydrophobicContact CB-CD1 4.47Å
196	F	47	Very low	50.3	Low	44 Å²	44	78.3 Å²	78.3	19%	0.193	40%	0.399	C	S	.	.	S	Bend	trans	-104	134.7	-177.1	-53.1	-89.8	0	0	0	110.5	V165 K194 F202 F208 L249	V165-F196 HydrophobicContact CB-CE2 3.76Å; V165-F196 HydrophobicContact CB-CZ 4.1Å; V165-F196 HydrophobicContact CG1-CE2 4.4Å; V165-F196 HydrophobicContact CG2-CE2 3.66Å; V165-F196 HydrophobicContact CG2-CZ 3.49Å; V165-F196 VanDerWaalsContact CG2-CZ 3.49Å; K194-F196 PolarHBondContact O-N 3.44Å; K194-F196 VanDerWaalsContact O-N 3.15Å; F196-F202 AromaticContact CD1-CE2 3.91Å; F196-F202 HydrophobicContact CD1-CE2 3.91Å; F196-F202 AromaticContact CD1-CZ 3.94Å; F196-F202 HydrophobicContact CD1-CZ 3.94Å; F196-F202 HydrophobicContact CE1-CE1 4.44Å; F196-F202 AromaticContact CE1-CE2 3.63Å; F196-F202 HydrophobicContact CE1-CE2 3.63Å; F196-F202 AromaticContact CE1-CZ 3.47Å; F196-F202 HydrophobicContact CE1-CZ 3.47Å; F196-F202 VanDerWaalsContact CE1-CZ 3.47Å; F196-F208 HydrophobicContact CD1-CE1 4.09Å; F196-F208 AromaticContact CD1-CZ 3.94Å; F196-F208 HydrophobicContact CD1-CZ 3.94Å; F196-F208 AromaticContact CE1-CE1 3.89Å; F196-F208 HydrophobicContact CE1-CE1 3.89Å; F196-F208 HydrophobicContact CE1-CE2 4.32Å; F196-F208 AromaticContact CE1-CZ 3.35Å; F196-F208 HydrophobicContact CE1-CZ 3.35Å; F196-F208 HydrophobicContact CZ-CE1 4.15Å; F196-F208 AromaticContact CZ-CZ 3.69Å; F196-F208 HydrophobicContact CZ-CZ 3.69Å; F196-L249 HydrophobicContact CZ-CD1 4.09Å
197	R	44.8	Very low	48.7	Very low	214 Å²	214	80.3 Å²	80.3	81%	0.808	41%	0.409	S	S	*	.			trans	-60.8	149.7	172	-161.7	174.8	157.3	131	-2	109.1	G199	R197-G199 CarbonylContact O-C 3.6Å; R197-G199 PolarHBondContact O-N 2.86Å
198	K	37.1	Very low	47.2	Very low	215 Å²	215	80.4 Å²	80.4	94%	0.935	41%	0.41	S	S	*	.	S	Bend	trans	-52	125.6	-179.8	-96.6	-174	175.1	-176.3	0	110.7
199	G	38.1	Very low	45.6	Very low	48 Å²	48	85.2 Å²	85.2	50%	0.495	43%	0.43	S	S	.	.	S	Bend	trans	92.6	116	-169.2	0	0	0	0	0	108.3	R197 E201	R197-G199 CarbonylContact O-C 3.6Å; R197-G199 PolarHBondContact O-N 2.86Å; G199-E201 PolarHBondContact O-N 3.25Å
200	N	39.2	Very low	44.3	Very low	130 Å²	130	86.3 Å²	86.3	70%	0.695	44%	0.436	S	S	*	.	S	Bend	trans	-58.2	9.5	-177.5	-67.6	-14.5	0	0	0	114.8	F202	N200-F202 PolarHBondContact O-N 3.29Å
201	E	34.7	Very low	42.9	Very low	172 Å²	172	95.8 Å²	95.8	80%	0.804	47%	0.469	S	S	*	.			trans	-79.5	106.4	169.6	-72.4	-177.9	160.3	0	0	109.4	G199 S203	G199-E201 PolarHBondContact O-N 3.25Å; E201-S203 PolarHBondContact O-N 3.26Å
202	F	42.7	Very low	41.6	Very low	54 Å²	54	96.1 Å²	96.1	24%	0.237	47%	0.473	C	S	.	.			trans	-46.5	123.7	153.7	-84	-96.6	0	0	0	108.4	T162 F196 N200 T204 F208 R269	T162-F202 HydrophobicContact CG2-CE1 4.32Å; T162-F202 HydrophobicContact CG2-CE2 3.36Å; T162-F202 HydrophobicContact CG2-CZ 3.2Å; T162-F202 WeakPolarHBondContact OG1-CE2 3.39Å; T162-F202 WeakPolarHBondContact OG1-CZ 3.47Å; F196-F202 AromaticContact CD1-CE2 3.91Å; F196-F202 HydrophobicContact CD1-CE2 3.91Å; F196-F202 AromaticContact CD1-CZ 3.94Å; F196-F202 HydrophobicContact CD1-CZ 3.94Å; F196-F202 HydrophobicContact CE1-CE1 4.44Å; F196-F202 AromaticContact CE1-CE2 3.63Å; F196-F202 HydrophobicContact CE1-CE2 3.63Å; F196-F202 AromaticContact CE1-CZ 3.47Å; F196-F202 HydrophobicContact CE1-CZ 3.47Å; F196-F202 VanDerWaalsContact CE1-CZ 3.47Å; N200-F202 PolarHBondContact O-N 3.29Å; F202-T204 PolarHBondContact O-N 3.13Å; F202-F208 AromaticContact CE1-CD2 3.79Å; F202-F208 HydrophobicContact CE1-CD2 3.79Å; F202-F208 AromaticContact CE1-CE2 3.3Å; F202-F208 HydrophobicContact CE1-CE2 3.3Å; F202-F208 AromaticContact CE1-CZ 3.92Å; F202-F208 HydrophobicContact CE1-CZ 3.92Å; F202-F208 HydrophobicContact CZ-CD2 4.46Å; F202-F208 AromaticContact CZ-CE2 3.55Å; F202-F208 HydrophobicContact CZ-CE2 3.55Å; F202-F208 AromaticContact CZ-CZ 3.82Å; F202-F208 HydrophobicContact CZ-CZ 3.82Å; F202-R269 HydrophobicContact CE1-CG 4.25Å
203	S	30.4	Very low	40.3	Very low	53 Å²	53	99.3 Å²	99.3	37%	0.371	49%	0.493	S	S	.	.			trans	-51.2	134.6	160.1	46	0	0	0	0	107.2	E201 K205 R269	E201-S203 PolarHBondContact O-N 3.26Å; S203-K205 CarbonylContact C-O 3.35Å; S203-K205 CarbonylContact O-C 3.56Å; S203-K205 PolarHBondContact O-N 3.11Å; S203-K205 PolarHBondContact OG-O 2.99Å; S203-R269 PolarHBondContact O-NH1 3.01Å
204	T	34.5	Very low	39	Very low	136 Å²	136	103.6 Å²	103.6	83%	0.834	50%	0.498	S	S	*	.	S	Bend	trans	-61.1	-13.9	179.8	44.5	0	0	0	0	112.6	F202	F202-T204 PolarHBondContact O-N 3.13Å
205	K	34.9	Very low	37.9	Very low	148 Å²	148	104.7 Å²	104.7	64%	0.643	50%	0.497	S	S	*	.	S	Bend	trans	-79.1	137	165.6	-65.9	-175.4	176.8	-175.6	0	110	S203 D207	S203-K205 CarbonylContact C-O 3.35Å; S203-K205 CarbonylContact O-C 3.56Å; S203-K205 PolarHBondContact O-N 3.11Å; S203-K205 PolarHBondContact OG-O 2.99Å; K205-D207 PolarHBondContact O-N 2.85Å
206	S	40.8	Very low	36.8	Very low	65 Å²	65	111.1 Å²	111.1	46%	0.455	54%	0.536	S	S	.	.	S	Bend	trans	-36.6	-0.1	174	41.2	0	0	0	0	118.7	F208	S206-F208 PolarHBondContact O-N 2.85Å
207	D	38.9	Very low	35.8	Very low	47 Å²	47	112 Å²	112	25%	0.251	54%	0.542	S	S	.	.			trans	-93.4	93.9	-160.6	-48.1	-22	0	0	0	110.3	K205 F209	K205-D207 PolarHBondContact O-N 2.85Å; D207-F209 HydrophobicContact CB-CD2 3.43Å; D207-F209 VanDerWaalsContact CB-CD2 3.43Å; D207-F209 HydrophobicContact CB-CE1 4.33Å; D207-F209 HydrophobicContact CB-CE2 3.09Å; D207-F209 HydrophobicContact CB-CG 4.2Å; D207-F209 HydrophobicContact CB-CZ 3.6Å; D207-F209 PolarHBondContact O-N 2.8Å; D207-F209 WeakPolarHBondContact OD2-CE2 3.43Å; D207-F209 WeakPolarHBondContact OD2-CZ 3.49Å
208	F	42.8	Very low	34.8	Very low	6 Å²	6	113.3 Å²	113.3	3%	0.026	55%	0.547	C	S	.	.			trans	-69.5	102.3	151.9	-115.1	-75.5	0	0	0	107	C195 F196 F202 S206 L238 L249 Y267	C195-F208 HydrophobicContact CB-CD1 4.16Å; C195-F208 HydrophobicContact CB-CE1 3.6Å; C195-F208 WeakPolarHBondContact O-CD1 3.45Å; C195-F208 VanDerWaalsContact O-CE1 3.32Å; C195-F208 WeakPolarHBondContact O-CE1 3.29Å; F196-F208 HydrophobicContact CD1-CE1 4.09Å; F196-F208 AromaticContact CD1-CZ 3.94Å; F196-F208 HydrophobicContact CD1-CZ 3.94Å; F196-F208 AromaticContact CE1-CE1 3.89Å; F196-F208 HydrophobicContact CE1-CE1 3.89Å; F196-F208 HydrophobicContact CE1-CE2 4.32Å; F196-F208 AromaticContact CE1-CZ 3.35Å; F196-F208 HydrophobicContact CE1-CZ 3.35Å; F196-F208 HydrophobicContact CZ-CE1 4.15Å; F196-F208 AromaticContact CZ-CZ 3.69Å; F196-F208 HydrophobicContact CZ-CZ 3.69Å; F202-F208 AromaticContact CE1-CD2 3.79Å; F202-F208 HydrophobicContact CE1-CD2 3.79Å; F202-F208 AromaticContact CE1-CE2 3.3Å; F202-F208 HydrophobicContact CE1-CE2 3.3Å; F202-F208 AromaticContact CE1-CZ 3.92Å; F202-F208 HydrophobicContact CE1-CZ 3.92Å; F202-F208 HydrophobicContact CZ-CD2 4.46Å; F202-F208 AromaticContact CZ-CE2 3.55Å; F202-F208 HydrophobicContact CZ-CE2 3.55Å; F202-F208 AromaticContact CZ-CZ 3.82Å; F202-F208 HydrophobicContact CZ-CZ 3.82Å; S206-F208 PolarHBondContact O-N 2.85Å; F208-L238 HydrophobicContact CD1-CD2 3.64Å; F208-L238 HydrophobicContact CD2-CD2 4.2Å; F208-L238 HydrophobicContact CE1-CD2 3.62Å; F208-L238 HydrophobicContact CE2-CD2 4.13Å; F208-L238 HydrophobicContact CG-CD2 3.94Å; F208-L238 HydrophobicContact CZ-CD2 3.85Å; F208-L249 HydrophobicContact CE2-CB 4.46Å; F208-Y267 HydrophobicContact CB-CD2 4.26Å
209	F	38.3	Very low	34.4	Very low	108 Å²	108	107.3 Å²	107.3	47%	0.474	53%	0.532	S	S	.	.			trans	-93.8	111.5	178.7	-80.3	-69.4	0	0	0	110.8	D207 P264	D207-F209 HydrophobicContact CB-CD2 3.43Å; D207-F209 VanDerWaalsContact CB-CD2 3.43Å; D207-F209 HydrophobicContact CB-CE1 4.33Å; D207-F209 HydrophobicContact CB-CE2 3.09Å; D207-F209 HydrophobicContact CB-CG 4.2Å; D207-F209 HydrophobicContact CB-CZ 3.6Å; D207-F209 PolarHBondContact O-N 2.8Å; D207-F209 WeakPolarHBondContact OD2-CE2 3.43Å; D207-F209 WeakPolarHBondContact OD2-CZ 3.49Å; F209-P264 HydrophobicContact CB-CB 4.47Å; F209-P264 HydrophobicContact CD1-CB 3.8Å; F209-P264 HydrophobicContact CD1-CG 3.44Å; F209-P264 VanDerWaalsContact CD1-CG 3.44Å; F209-P264 HydrophobicContact CE1-CG 3.87Å
210	I	42	Very low	33.9	Very low	25 Å²	25	110.9 Å²	110.9	13%	0.128	54%	0.539	C	S	.	.	B	Isolated β-bridge	trans	-112.5	109	174.5	-50.4	-171.4	0	0	0	109.6	L192 C195 P212 L238 P264 A265 Y267	L192-I210 HydrophobicContact CD1-CD1 3.6Å; L192-I210 HydrophobicContact CD1-CG2 4.33Å; L192-I210 HydrophobicContact CD2-CG2 4.22Å; C195-I210 HydrophobicContact CB-CD1 4.47Å; I210-P212 WeakPolarHBondContact O-CD 3.34Å; I210-L238 HydrophobicContact CD1-CD1 3.96Å; I210-L238 HydrophobicContact CD1-CD2 4.32Å; I210-P264 CarbonylContact O-C 3.56Å; I210-P264 WeakPolarHBondContact O-CA 3.18Å; I210-P264 WeakPolarHBondContact O-CB 3.21Å; I210-A265 PolarHBondContact N-O 3.05Å; I210-A265 PolarHBondContact O-N 3.12Å; I210-A265 VanDerWaalsContact O-N 3.09Å; I210-Y267 HydrophobicContact CD1-CD2 4.13Å; I210-Y267 HydrophobicContact CD1-CE2 3.55Å; I210-Y267 HydrophobicContact CG1-CE2 4.19Å
211	R	34	Very low	33.6	Very low	223 Å²	223	114.7 Å²	114.7	84%	0.842	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-71.9	121.7	176.9	-76.8	-173.8	167.6	-154	-3.7	110.9
212	P	36.7	Very low	33.5	Very low	34 Å²	34	113.2 Å²	113.2	22%	0.221	54%	0.541	C	S	.	.	P	Polyproline II helix	trans	-72.2	151.1	169	27.7	-31.8	0	0	0	111.4	I210 E261 V263	I210-P212 WeakPolarHBondContact O-CD 3.34Å; P212-E261 WeakPolarHBondContact CG-O 3.31Å; P212-V263 WeakPolarHBondContact CD-O 3.3Å; P212-V263 WeakPolarHBondContact CG-O 3.18Å
213	V	32.4	Very low	33.1	Very low	93 Å²	93	118.8 Å²	118.8	56%	0.564	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-92.6	123.1	178.3	178.8	0	0	0	0	108.9
214	R	26.1	Very low	33.2	Very low	181 Å²	181	126 Å²	126	68%	0.683	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-46.8	135.8	-177.2	-61	179.3	-179.8	-156.1	-0.6	114.6	N262	R214-N262 WeakPolarHBondContact CG-OD1 3.39Å; R214-N262 PolarHBondContact NE-ND2 3.49Å
215	R	31.1	Very low	33.2	Very low	198 Å²	198	127.7 Å²	127.7	75%	0.747	60%	0.596	S	S	*	*			trans	-173.3	169.7	138.6	-103.2	168.6	-144.9	-162.2	6.4	113.9	T260	R215-T260 WeakPolarHBondContact O-CB 3.35Å; R215-T260 WeakPolarHBondContact O-CG2 3.38Å
216	V	25.9	Very low	33.2	Very low	140 Å²	140	124.4 Å²	124.4	85%	0.848	60%	0.597	S	S	*	*			trans	-96.3	133.8	-152	175.9	0	0	0	0	113.8
217	L	26.8	Very low	32.8	Very low	62 Å²	62	124.9 Å²	124.9	33%	0.325	60%	0.597	S	S	.	*			trans	-78.4	152	178.7	-66.6	165	0	0	0	113.7	E179 N258 T260	E179-L217 HydrophobicContact CB-CD2 4.49Å; L217-N258 HydrophobicContact CD1-CB 4.31Å; L217-T260 HydrophobicContact CD1-CG2 3.92Å; L217-T260 HydrophobicContact CD2-CG2 3.75Å; L217-T260 HydrophobicContact CG-CG2 3.49Å; L217-T260 VanDerWaalsContact CG-CG2 3.49Å
218	R	24.2	Very low	32.6	Very low	241 Å²	241	125 Å²	125	91%	0.909	60%	0.597	S	S	*	*			trans	-128.4	110.8	161.2	-157.1	178.3	-179.7	-158.4	-0.9	108.1
219	S	28	Very low	32.2	Very low	89 Å²	89	131 Å²	131	62%	0.622	62%	0.62	S	S	*	*			trans	-66	134.7	-171.9	74.9	0	0	0	0	112.2
220	I	27.9	Very low	32.7	Very low	123 Å²	123	130.7 Å²	130.7	63%	0.631	62%	0.615	S	S	*	*			trans	-104.6	111.7	165.2	-62.8	177.5	0	0	0	107.3
221	R	32.2	Very low	33.6	Very low	210 Å²	210	131.5 Å²	131.5	79%	0.792	62%	0.623	S	S	*	*			trans	-74.4	153.6	170.5	-76.5	-176.3	176.9	-167.3	-1.1	110.2
222	D	34	Very low	35.3	Very low	142 Å²	142	121.1 Å²	121.1	76%	0.759	59%	0.586	S	S	*	*			trans	86.7	92.6	164.4	-58.1	-28	0	0	0	118
223	N	33.3	Very low	37.4	Very low	170 Å²	170	121.5 Å²	121.5	91%	0.909	59%	0.586	S	S	*	*				-160.7	131.4	122.4	-111.5	-23.7	0	0	0	113.2	Q225	N223-Q225 PolarHBondContact O-N 3.24Å
224	K	31.9	Very low	39.9	Very low	204 Å²	204	117.6 Å²	117.6	89%	0.887	56%	0.563	S	S	*	*			trans	-92.4	79.8	-171.1	-70.1	176	176.7	174.6	0	112.2
225	Q	34.5	Very low	42.9	Very low	173 Å²	173	109 Å²	109	81%	0.808	53%	0.53	S	S	*	.			trans	-137.1	123.3	146.2	-78.1	-174.5	19.3	0	0	106.7	N223 V227	N223-Q225 PolarHBondContact O-N 3.24Å; Q225-V227 PolarHBondContact O-N 3.01Å
226	A	34.8	Very low	45.7	Very low	78 Å²	78	99.7 Å²	99.7	65%	0.645	50%	0.495	S	S	*	.			trans	-73	66.8	-177.6	0	0	0	0	0	110.5	L228	A226-L228 PolarHBondContact O-N 2.83Å
227	V	33.4	Very low	48.9	Very low	76 Å²	76	93 Å²	93	46%	0.461	46%	0.455	S	S	.	.			trans	-61	116.1	151.1	-177.6	0	0	0	0	103.7	Q225 R229	Q225-V227 PolarHBondContact O-N 3.01Å; V227-R229 PolarHBondContact O-N 3Å
228	L	33.4	Very low	51.8	Low	50 Å²	50	90 Å²	90	26%	0.262	44%	0.44	S	S	.	.			trans	-61.7	96.9	164.7	-75.2	171	0	0	0	104.3	A226 W230	A226-L228 PolarHBondContact O-N 2.83Å; L228-W230 PolarHBondContact O-N 2.99Å
229	R	36.1	Very low	54.9	Low	132 Å²	132	78.6 Å²	78.6	50%	0.498	40%	0.396	S	S	.	.			trans	-75.9	68.4	-171.5	-172.4	142.9	67.3	166.1	9.6	108	E181 V227	E181-R229 PolarHBondContact O-NH1 3.39Å; E181-R229 IonicContact OE2-NH2 3.76Å; E181-R229 PolarHBondContact OE2-NH2 2.84Å; V227-R229 PolarHBondContact O-N 3Å
230	W	48.7	Very low	57.8	Low	101 Å²	101	74.3 Å²	74.3	38%	0.383	37%	0.367	S	S	.	.			trans	-79.7	137.9	162.6	-66.1	-5.8	0	0	0	106.3	V63 I90 L228 G232	V63-W230 HydrophobicContact CG1-CE3 3.81Å; V63-W230 HydrophobicContact CG1-CZ3 4.35Å; I90-W230 HydrophobicContact CG1-CZ3 4.49Å; L228-W230 PolarHBondContact O-N 2.99Å; W230-G232 PolarHBondContact O-N 3.13Å
231	S	60.4	Low	60.8	Low	41 Å²	41	70.3 Å²	70.3	29%	0.287	35%	0.345	S	S	.	.			trans	-62.2	10	-154.9	51	0	0	0	0	115.9	G176 T177 D233	G176-S231 CarbonylContact C-O 3.6Å; G176-S231 WeakPolarHBondContact CA-O 3.16Å; T177-S231 PolarHBondContact N-O 2.8Å; S231-D233 PolarHBondContact O-N 2.67Å
232	G	69.8	Low	63.5	Low	6 Å²	6	61 Å²	61	6%	0.062	31%	0.311	C	S	.	.	S	Bend	trans	69.3	-27.4	178	0	0	0	0	0	114.2	C65 S66 W230	C65-G232 CarbonylContact C-O 3.43Å; C65-G232 WeakPolarHBondContact CA-O 3.28Å; S66-G232 WeakPolarHBondContact CB-O 3.33Å; S66-G232 PolarHBondContact N-O 2.64Å; S66-G232 VanDerWaalsContact N-O 3.13Å; S66-G232 PolarHBondContact OG-O 3.24Å; W230-G232 PolarHBondContact O-N 3.13Å
233	D	79.6	Confident	66	Low	42 Å²	42	62.5 Å²	62.5	23%	0.225	31%	0.313	C	S	.	.			trans	-84.1	-20.6	-176.6	-60.8	-31.9	0	0	0	112.7	G174 W175 G176 S231 G235 S236 L252	G174-D233 VanDerWaalsContact C-OD1 3.28Å; G174-D233 WeakPolarHBondContact CA-OD1 3.33Å; W175-D233 PolarHBondContact N-OD1 2.8Å; G176-D233 WeakPolarHBondContact CA-OD1 3.32Å; G176-D233 PolarHBondContact N-OD1 2.77Å; S231-D233 PolarHBondContact O-N 2.67Å; D233-G235 PolarHBondContact O-N 2.69Å; D233-S236 WeakPolarHBondContact O-CB 3.36Å; D233-S236 PolarHBondContact O-N 3.34Å; D233-S236 PolarHBondContact O-OG 2.8Å; D233-L252 HydrophobicContact CB-CD2 3.78Å; D233-L252 WeakPolarHBondContact O-CD2 3.43Å
234	S	85.2	Confident	68.7	Low	11 Å²	11	55.9 Å²	55.9	8%	0.077	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	131.1	176.3	-77.7	0	0	0	0	111.4	C65 S66 H86 S236	C65-S234 WeakPolarHBondContact CB-O 3.43Å; S66-S234 PolarHBondContact N-O 2.82Å; H86-S234 VanDerWaalsContact CE1-CB 3.45Å; H86-S234 WeakPolarHBondContact CE1-CB 3.32Å; H86-S234 PolarHBondContact CE1-OG 2.86Å; H86-S234 WeakPolarHBondContact NE2-CB 3.35Å; H86-S234 PolarHBondContact NE2-OG 2.99Å; S234-S236 VanDerWaalsContact C-N 3.32Å
235	G	90.5	Very high	71.6	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	-6.4	-174.9	0	0	0	0	0	115.5	S66 T83 D233 L252	S66-G235 CarbonylContact O-C 3.58Å; S66-G235 VanDerWaalsContact O-CA 3.29Å; S66-G235 WeakPolarHBondContact O-CA 3.22Å; T83-G235 WeakPolarHBondContact OG1-CA 3.3Å; D233-G235 PolarHBondContact O-N 2.69Å; G235-L252 PolarHBondContact N-O 3.02Å
236	S	90	Very high	74.4	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.014	22%	0.222	C	C	.	.			trans	-63.7	152	173.4	60.2	0	0	0	0	112.2	A173 D233 S234 L252	A173-S236 WeakPolarHBondContact O-CB 3.48Å; D233-S236 WeakPolarHBondContact O-CB 3.36Å; D233-S236 PolarHBondContact O-N 3.34Å; D233-S236 PolarHBondContact O-OG 2.8Å; S234-S236 VanDerWaalsContact C-N 3.32Å; S236-L252 PolarHBondContact O-N 2.85Å
237	P	92.7	Very high	77.3	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	141.7	176.9	29.7	-31.2	0	0	0	111.7	M51 F68 L155 F239 A248 G250	M51-P237 HydrophobicContact SD-CG 3.79Å; F68-P237 HydrophobicContact CB-CB 4.32Å; F68-P237 HydrophobicContact CB-CG 3.84Å; F68-P237 HydrophobicContact CD1-CB 3.54Å; F68-P237 HydrophobicContact CD1-CG 3.81Å; F68-P237 HydrophobicContact CD2-CB 4.34Å; F68-P237 HydrophobicContact CE1-CB 3.86Å; F68-P237 HydrophobicContact CG-CB 3.8Å; F68-P237 HydrophobicContact CG-CG 3.89Å; F68-P237 HydrophobicContact CZ-CB 4.38Å; L155-P237 HydrophobicContact CD1-CB 3.68Å; L155-P237 HydrophobicContact CD1-CG 3.73Å; P237-F239 HydrophobicContact CB-CB 4.45Å; P237-F239 HydrophobicContact CB-CD1 4.09Å; P237-F239 HydrophobicContact CG-CD1 3.84Å; P237-F239 HydrophobicContact CG-CE1 4.38Å; P237-A248 HydrophobicContact CB-CB 4.37Å; P237-G250 CarbonylContact C-O 3.49Å; P237-G250 WeakPolarHBondContact CA-O 3.5Å
238	L	86.7	Confident	80.2	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	115.7	148.5	-178.9	71.3	0	0	0	107.2	C170 L192 F208 I210 A248 L249 G250 Y267	C170-L238 HydrophobicContact CB-CD1 3.81Å; C170-L238 HydrophobicContact CB-CG 4.15Å; L192-L238 HydrophobicContact CD1-CD1 3.85Å; F208-L238 HydrophobicContact CD1-CD2 3.64Å; F208-L238 HydrophobicContact CD2-CD2 4.2Å; F208-L238 HydrophobicContact CE1-CD2 3.62Å; F208-L238 HydrophobicContact CE2-CD2 4.13Å; F208-L238 HydrophobicContact CG-CD2 3.94Å; F208-L238 HydrophobicContact CZ-CD2 3.85Å; I210-L238 HydrophobicContact CD1-CD1 3.96Å; I210-L238 HydrophobicContact CD1-CD2 4.32Å; L238-A248 CarbonylContact O-C 3.29Å; L238-L249 PolarHBondContact O-N 2.83Å; L238-G250 PolarHBondContact N-O 2.87Å; L238-G250 PolarHBondContact O-N 2.85Å; L238-Y267 HydrophobicContact CB-CD1 3.52Å; L238-Y267 HydrophobicContact CB-CE1 3.6Å; L238-Y267 HydrophobicContact CB-CG 4.13Å; L238-Y267 HydrophobicContact CD1-CE1 4.49Å; L238-Y267 HydrophobicContact CD2-CD2 4.49Å; L238-Y267 HydrophobicContact CD2-CG 4.37Å
239	F	90.5	Very high	82.8	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	144.1	-174.4	61.7	-81.1	0	0	0	112.7	L48 W50 L155 C170 F171 A173 P237 Y246 F247	L48-F239 HydrophobicContact CD1-CZ 4.43Å; L48-F239 HydrophobicContact CD2-CE2 3.86Å; L48-F239 HydrophobicContact CD2-CZ 3.54Å; W50-F239 AromaticContact CZ2-CD2 3.8Å; W50-F239 HydrophobicContact CZ2-CD2 3.8Å; W50-F239 AromaticContact CZ2-CE2 3.51Å; W50-F239 HydrophobicContact CZ2-CE2 3.51Å; W50-F239 HydrophobicContact CZ2-CZ 4.12Å; W50-F239 AromaticContact NE1-CZ 3.96Å; L155-F239 HydrophobicContact CD1-CB 3.96Å; L155-F239 HydrophobicContact CD1-CG 4.33Å; L155-F239 HydrophobicContact CD2-CB 3.98Å; L155-F239 HydrophobicContact CD2-CD2 4.37Å; L155-F239 HydrophobicContact CD2-CG 4.31Å; C170-F239 CarbonylContact C-O 3.54Å; C170-F239 WeakPolarHBondContact CA-O 3.06Å; C170-F239 WeakPolarHBondContact CB-O 3.17Å; F171-F239 HydrophobicContact CB-CD1 4.14Å; F171-F239 HydrophobicContact CB-CD2 3.9Å; F171-F239 HydrophobicContact CB-CE1 3.65Å; F171-F239 HydrophobicContact CB-CE2 3.35Å; F171-F239 HydrophobicContact CB-CG 4.26Å; F171-F239 HydrophobicContact CB-CZ 3.21Å; F171-F239 HydrophobicContact CD2-CD2 4.35Å; F171-F239 HydrophobicContact CD2-CE2 4.05Å; F171-F239 HydrophobicContact CG-CD2 4.42Å; F171-F239 AromaticContact CG-CE2 3.79Å; F171-F239 HydrophobicContact CG-CE2 3.79Å; F171-F239 HydrophobicContact CG-CZ 4.04Å; F171-F239 PolarHBondContact N-O 3.01Å; F171-F239 WeakPolarHBondContact O-CD1 3.4Å; F171-F239 PolarHBondContact O-N 2.91Å; A173-F239 HydrophobicContact CB-CE1 4.23Å; P237-F239 HydrophobicContact CB-CB 4.45Å; P237-F239 HydrophobicContact CB-CD1 4.09Å; P237-F239 HydrophobicContact CG-CD1 3.84Å; P237-F239 HydrophobicContact CG-CE1 4.38Å; F239-Y246 AromaticContact CD2-CD1 3.69Å; F239-Y246 HydrophobicContact CD2-CD1 3.69Å; F239-Y246 HydrophobicContact CD2-CE1 4.31Å; F239-Y246 HydrophobicContact CD2-CG 4.36Å; F239-Y246 HydrophobicContact CE2-CD1 4.1Å; F239-Y246 HydrophobicContact CE2-CE1 4.32Å; F239-F247 CarbonylContact C-O 3.54Å; F239-F247 WeakPolarHBondContact CA-O 3.3Å; F239-F247 WeakPolarHBondContact CB-O 3.14Å
240	C	88.4	Confident	85.2	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	146.5	-173.8	-35.6	0	0	0	0	110	V165 C170 I242 Y246 F247 L249	V165-C240 HydrophobicContact CG1-CB 4.03Å; V165-C240 HydrophobicContact CG2-CB 3.94Å; C170-C240 HydrophobicContact CB-CB 3.96Å; C170-C240 WeakPolarHBondContact CB-SG 3.3Å; C170-C240 WeakPolarHBondContact SG-CB 3.28Å; C170-C240 CovalentContact SG-SG 2.03Å; C170-C240 PolarHBondContact SG-SG 3.37Å; C240-I242 HydrophobicContact CB-CG1 4.46Å; C240-Y246 WeakPolarHBondContact O-CA 3.17Å; C240-F247 PolarHBondContact N-O 3.31Å; C240-F247 PolarHBondContact O-N 2.89Å; C240-L249 HydrophobicContact CB-CD1 4.2Å; C240-L249 WeakPolarHBondContact SG-CD1 3.44Å
241	E	90.4	Very high	86.9	Confident	39 Å²	39	23.9 Å²	23.9	18%	0.182	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	126.2	172.2	-168.7	178.5	-165.1	0	0	109.2	R24 K27 R245 Y246	R24-E241 IonicContact NH1-OE1 2.95Å; R24-E241 PolarHBondContact NH1-OE1 3.17Å; K27-E241 WeakPolarHBondContact CE-OE2 3.41Å; K27-E241 IonicContact NZ-OE2 3.73Å; K27-E241 PolarHBondContact NZ-OE2 2.81Å; E241-R245 CarbonylContact C-O 3.57Å; E241-R245 WeakPolarHBondContact CA-O 3.43Å; E241-Y246 HydrophobicContact CB-CD1 4.01Å; E241-Y246 HydrophobicContact CB-CE1 3.72Å; E241-Y246 HydrophobicContact CG-CE1 4.37Å
242	I	88.9	Confident	88	Confident	14 Å²	14	22.9 Å²	22.9	7%	0.072	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	118.3	-177.3	-51.1	-179.3	0	0	0	106.4	P163 V165 C240 G244 R245 F247	P163-I242 HydrophobicContact CB-CD1 3.71Å; P163-I242 HydrophobicContact CB-CG2 4.33Å; P163-I242 HydrophobicContact CG-CD1 3.25Å; V165-I242 HydrophobicContact CG2-CD1 4.15Å; V165-I242 HydrophobicContact CG2-CG1 4.43Å; C240-I242 HydrophobicContact CB-CG1 4.46Å; I242-G244 PolarHBondContact O-N 3.39Å; I242-G244 VanDerWaalsContact O-N 3.07Å; I242-R245 PolarHBondContact N-O 3Å; I242-R245 PolarHBondContact O-N 2.86Å; I242-F247 HydrophobicContact CB-CD2 3.94Å; I242-F247 HydrophobicContact CB-CE2 4.17Å; I242-F247 HydrophobicContact CD1-CB 4.22Å; I242-F247 HydrophobicContact CD1-CD2 4.12Å; I242-F247 HydrophobicContact CD1-CG 4.31Å; I242-F247 HydrophobicContact CG1-CD2 4.21Å
243	E	87.5	Confident	88.3	Confident	174 Å²	174	22.8 Å²	22.8	81%	0.813	11%	0.114	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	37.1	-179.2	-60.2	178.2	-176.7	0	0	113
244	G	88.9	Confident	87.9	Confident	31 Å²	31	24.7 Å²	24.7	32%	0.32	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.3	6.7	178	0	0	0	0	0	116.2	I242	I242-G244 PolarHBondContact O-N 3.39Å; I242-G244 VanDerWaalsContact O-N 3.07Å
245	R	92.7	Very high	86.5	Confident	93 Å²	93	25.6 Å²	25.6	35%	0.351	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	148.9	174.7	-62.1	-176.7	177	-149	-6.4	111.7	S17 G19 I20 E241 I242 F247	S17-R245 PolarHBondContact OG-NH2 3.1Å; G19-R245 WeakPolarHBondContact O-CA 3.42Å; I20-R245 HydrophobicContact CD1-CG 4.24Å; I20-R245 HydrophobicContact CG1-CG 3.96Å; E241-R245 CarbonylContact C-O 3.57Å; E241-R245 WeakPolarHBondContact CA-O 3.43Å; I242-R245 PolarHBondContact N-O 3Å; I242-R245 PolarHBondContact O-N 2.86Å; R245-F247 HydrophobicContact CB-CD2 4.43Å; R245-F247 HydrophobicContact CB-CE2 3.88Å
246	Y	94.4	Very high	84.2	Confident	2 Å²	2	26.7 Å²	26.7	1%	0.008	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	125.8	176.6	-70	-83.4	0	0	0	112.5	G19 P21 P25 W50 C156 F171 F239 C240 E241	G19-Y246 VanDerWaalsContact CA-O 3.24Å; G19-Y246 WeakPolarHBondContact CA-O 3.26Å; G19-Y246 WeakPolarHBondContact O-CD2 3.27Å; G19-Y246 PolarHBondContact O-N 2.68Å; P21-Y246 HydrophobicContact CG-CD2 4.25Å; P21-Y246 HydrophobicContact CG-CE2 4.14Å; P25-Y246 WeakPolarHBondContact CD-OH 3.43Å; P25-Y246 HydrophobicContact CG-CE1 4.44Å; P25-Y246 HydrophobicContact CG-CE2 4.17Å; W50-Y246 HydrophobicContact CH2-CD1 4.48Å; W50-Y246 AromaticContact CH2-CD2 3.69Å; W50-Y246 HydrophobicContact CH2-CD2 3.69Å; W50-Y246 HydrophobicContact CH2-CE2 4.33Å; W50-Y246 AromaticContact CH2-CG 3.77Å; W50-Y246 HydrophobicContact CH2-CG 3.77Å; W50-Y246 HydrophobicContact CZ2-CG 4.31Å; W50-Y246 HydrophobicContact CZ3-CD2 4.35Å; C156-Y246 PolarHBondContact N-O 3.14Å; C156-Y246 VanDerWaalsContact N-O 3.08Å; F171-Y246 AromaticContact CD2-CE1 3.98Å; F171-Y246 HydrophobicContact CD2-CE1 3.98Å; F171-Y246 AromaticContact CE2-CE1 3.75Å; F171-Y246 HydrophobicContact CE2-CE1 3.75Å; F171-Y246 HydrophobicContact CZ-CE1 4.47Å; F239-Y246 AromaticContact CD2-CD1 3.69Å; F239-Y246 HydrophobicContact CD2-CD1 3.69Å; F239-Y246 HydrophobicContact CD2-CE1 4.31Å; F239-Y246 HydrophobicContact CD2-CG 4.36Å; F239-Y246 HydrophobicContact CE2-CD1 4.1Å; F239-Y246 HydrophobicContact CE2-CE1 4.32Å; C240-Y246 WeakPolarHBondContact O-CA 3.17Å; E241-Y246 HydrophobicContact CB-CD1 4.01Å; E241-Y246 HydrophobicContact CB-CE1 3.72Å; E241-Y246 HydrophobicContact CG-CE1 4.37Å
247	F	94.4	Very high	81.8	Confident	44 Å²	44	33.5 Å²	33.5	19%	0.193	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	134.1	177.6	-73.1	-101.3	0	0	0	110.8	C156 L157 F239 C240 I242 R245 L249	C156-F247 HydrophobicContact CB-CD1 3.35Å; C156-F247 HydrophobicContact CB-CD2 4.19Å; C156-F247 HydrophobicContact CB-CE1 3.39Å; C156-F247 HydrophobicContact CB-CE2 4.23Å; C156-F247 HydrophobicContact CB-CG 3.76Å; C156-F247 HydrophobicContact CB-CZ 3.85Å; C156-F247 CarbonylContact O-C 3.52Å; C156-F247 VanDerWaalsContact O-CA 3.32Å; C156-F247 WeakPolarHBondContact O-CA 3.37Å; L157-F247 WeakPolarHBondContact O-CD1 3.27Å; L157-F247 WeakPolarHBondContact O-CE1 3.35Å; F239-F247 CarbonylContact C-O 3.54Å; F239-F247 WeakPolarHBondContact CA-O 3.3Å; F239-F247 WeakPolarHBondContact CB-O 3.14Å; C240-F247 PolarHBondContact N-O 3.31Å; C240-F247 PolarHBondContact O-N 2.89Å; I242-F247 HydrophobicContact CB-CD2 3.94Å; I242-F247 HydrophobicContact CB-CE2 4.17Å; I242-F247 HydrophobicContact CD1-CB 4.22Å; I242-F247 HydrophobicContact CD1-CD2 4.12Å; I242-F247 HydrophobicContact CD1-CG 4.31Å; I242-F247 HydrophobicContact CG1-CD2 4.21Å; R245-F247 HydrophobicContact CB-CD2 4.43Å; R245-F247 HydrophobicContact CB-CE2 3.88Å; F247-L249 HydrophobicContact CB-CD2 3.97Å; F247-L249 PolarHBondContact O-N 2.65Å
248	A	94.1	Very high	79.1	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	114.1	168.2	0	0	0	0	0	109.1	F68 L155 C156 P158 P237 L238 L270	F68-A248 HydrophobicContact CD2-CB 4.1Å; F68-A248 HydrophobicContact CE2-CB 3.48Å; F68-A248 VanDerWaalsContact CE2-CB 3.48Å; F68-A248 HydrophobicContact CZ-CB 3.92Å; L155-A248 HydrophobicContact CB-CB 4.11Å; L155-A248 HydrophobicContact CD1-CB 3.85Å; C156-A248 PolarHBondContact O-N 2.88Å; P158-A248 VanDerWaalsContact CD-O 3.22Å; P158-A248 WeakPolarHBondContact CD-O 3.47Å; P237-A248 HydrophobicContact CB-CB 4.37Å; L238-A248 CarbonylContact O-C 3.29Å; A248-L270 HydrophobicContact CB-CD1 3.58Å; A248-L270 WeakPolarHBondContact O-CD1 3.45Å
249	L	88.5	Confident	76.8	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-22.1	178.7	-58.1	-165.3	0	0	0	113.2	P158 T162 P163 V165 F196 F208 L238 C240 F247 L270	P158-L249 HydrophobicContact CB-CD2 4.1Å; P158-L249 HydrophobicContact CG-CD2 4.48Å; T162-L249 HydrophobicContact CG2-CD1 3.91Å; T162-L249 HydrophobicContact CG2-CD2 4.29Å; P163-L249 HydrophobicContact CG-CD2 4.12Å; V165-L249 HydrophobicContact CG2-CD1 3.89Å; F196-L249 HydrophobicContact CZ-CD1 4.09Å; F208-L249 HydrophobicContact CE2-CB 4.46Å; L238-L249 PolarHBondContact O-N 2.83Å; C240-L249 HydrophobicContact CB-CD1 4.2Å; C240-L249 WeakPolarHBondContact SG-CD1 3.44Å; F247-L249 HydrophobicContact CB-CD2 3.97Å; F247-L249 PolarHBondContact O-N 2.65Å; L249-L270 PolarHBondContact O-N 3.47Å
250	G	86	Confident	74.2	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	168.5	174.8	0	0	0	0	0	114.2	P237 L238 T268	P237-G250 CarbonylContact C-O 3.49Å; P237-G250 WeakPolarHBondContact CA-O 3.5Å; L238-G250 PolarHBondContact N-O 2.87Å; L238-G250 PolarHBondContact O-N 2.85Å; G250-T268 CarbonylContact C-O 3.58Å; G250-T268 WeakPolarHBondContact CA-O 3.5Å
251	I	85.9	Confident	71.9	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	127.5	175.5	-51.7	-173.4	0	0	0	108.1	F68 L82 A84 I137 S253 Y267 T268 L270	F68-I251 HydrophobicContact CE1-CD1 4.32Å; F68-I251 HydrophobicContact CE1-CG1 3.94Å; F68-I251 HydrophobicContact CZ-CD1 4.33Å; F68-I251 HydrophobicContact CZ-CG1 4.05Å; L82-I251 HydrophobicContact CB-CD1 4.34Å; A84-I251 HydrophobicContact CB-CG2 4.28Å; I137-I251 HydrophobicContact CB-CD1 4.27Å; I137-I251 HydrophobicContact CD1-CD1 3.83Å; I137-I251 HydrophobicContact CG1-CD1 3.63Å; I251-S253 PolarHBondContact O-N 2.84Å; I251-S253 VanDerWaalsContact O-N 3.12Å; I251-Y267 CarbonylContact O-C 3.6Å; I251-Y267 WeakPolarHBondContact O-CA 3.24Å; I251-T268 PolarHBondContact N-O 3.29Å; I251-T268 PolarHBondContact O-N 3.11Å; I251-L270 HydrophobicContact CD1-CD2 3.94Å; I251-L270 HydrophobicContact CG1-CD1 4.29Å; I251-L270 HydrophobicContact CG1-CD2 3.97Å; I251-L270 HydrophobicContact CG1-CG 4.14Å
252	L	82.1	Confident	69.9	Low	20 Å²	20	48.7 Å²	48.7	11%	0.105	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	116.1	178.5	-179.1	56.9	0	0	0	109.9	D233 G235 S236 A265 Y267	D233-L252 HydrophobicContact CB-CD2 3.78Å; D233-L252 WeakPolarHBondContact O-CD2 3.43Å; G235-L252 PolarHBondContact N-O 3.02Å; S236-L252 PolarHBondContact O-N 2.85Å; L252-A265 HydrophobicContact CD1-CB 4.13Å; L252-Y267 VanDerWaalsContact CA-CD1 3.48Å; L252-Y267 HydrophobicContact CB-CD1 3.98Å; L252-Y267 HydrophobicContact CB-CE1 3.64Å; L252-Y267 HydrophobicContact CD1-CD1 4.43Å; L252-Y267 HydrophobicContact CD1-CE1 3.96Å; L252-Y267 HydrophobicContact CD1-CE2 4.09Å; L252-Y267 HydrophobicContact CG-CE1 4.33Å; L252-Y267 VanDerWaalsContact N-CD1 3.32Å
253	S	78	Confident	68	Low	5 Å²	5	51 Å²	51	4%	0.035	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	-70	180	173.7	0	0	0	0	109.9	H86 D136 I251 T266	H86-S253 PolarHBondContact CE1-O 2.8Å; D136-S253 WeakPolarHBondContact CB-OG 3.3Å; D136-S253 VanDerWaalsContact OD2-CA 3.26Å; D136-S253 WeakPolarHBondContact OD2-CA 3.35Å; D136-S253 WeakPolarHBondContact OD2-CB 3.4Å; D136-S253 PolarHBondContact OD2-OG 3.21Å; I251-S253 PolarHBondContact O-N 2.84Å; I251-S253 VanDerWaalsContact O-N 3.12Å; S253-T266 PolarHBondContact N-O 3.23Å
254	H	69.4	Low	66.6	Low	81 Å²	81	44.3 Å²	44.3	38%	0.375	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	156.3	177.4	67.3	75.1	0	0	0	110.4	T266	H254-T266 VanDerWaalsContact CE1-CB 3.42Å; H254-T266 WeakPolarHBondContact CE1-CB 3.36Å; H254-T266 PolarHBondContact CE1-OG1 3.08Å; H254-T266 PolarHBondContact O-N 2.8Å
255	G	57.4	Low	65.6	Low	30 Å²	30	43.9 Å²	43.9	31%	0.309	24%	0.242	S	C	.	.			trans	-163.9	-177.6	176.1	0	0	0	0	0	109.3	I257	G255-I257 PolarHBondContact O-N 3.04Å; G255-I257 VanDerWaalsContact O-N 3.14Å
256	A	42.4	Very low	64.6	Low	24 Å²	24	40.3 Å²	40.3	20%	0.198	23%	0.23	C	C	.	.			trans	-51.7	124.7	174.7	0	0	0	0	0	110.2	N258 E261 V263	A256-N258 WeakPolarHBondContact CB-O 3.43Å; A256-N258 PolarHBondContact O-N 3.38Å; A256-N258 VanDerWaalsContact O-N 3.15Å; A256-E261 HydrophobicContact CB-CB 4.09Å; A256-V263 HydrophobicContact CB-CB 3.98Å
257	I	38.7	Very low	63.9	Low	145 Å²	145	40.7 Å²	40.7	74%	0.744	23%	0.232	S	C	*	.	S	Bend	trans	-55.9	-32.6	176.1	-66.3	160.2	0	0	0	109.7	G255	G255-I257 PolarHBondContact O-N 3.04Å; G255-I257 VanDerWaalsContact O-N 3.14Å
258	N	36.4	Very low	63.4	Low	62 Å²	62	39.1 Å²	39.1	33%	0.332	23%	0.226	S	C	.	.	S	Bend	trans	-122.8	132	170.8	-65.5	-21.9	0	0	0	108.9	L217 A256 T260 E261	L217-N258 HydrophobicContact CD1-CB 4.31Å; A256-N258 WeakPolarHBondContact CB-O 3.43Å; A256-N258 PolarHBondContact O-N 3.38Å; A256-N258 VanDerWaalsContact O-N 3.15Å; N258-T260 WeakPolarHBondContact CB-OG1 3.33Å; N258-T260 PolarHBondContact O-N 2.62Å; N258-E261 PolarHBondContact O-N 2.77Å; N258-E261 VanDerWaalsContact O-N 3.12Å
259	C	37.6	Very low	63	Low	72 Å²	72	41.4 Å²	41.4	49%	0.486	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-2.7	178.4	-54.5	0	0	0	0	115
260	T	35.9	Very low	63	Low	34 Å²	34	41.4 Å²	41.4	21%	0.209	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-24.8	-179.3	60.1	0	0	0	0	113.9	R215 L217 N258	R215-T260 WeakPolarHBondContact O-CB 3.35Å; R215-T260 WeakPolarHBondContact O-CG2 3.38Å; L217-T260 HydrophobicContact CD1-CG2 3.92Å; L217-T260 HydrophobicContact CD2-CG2 3.75Å; L217-T260 HydrophobicContact CG-CG2 3.49Å; L217-T260 VanDerWaalsContact CG-CG2 3.49Å; N258-T260 WeakPolarHBondContact CB-OG1 3.33Å; N258-T260 PolarHBondContact O-N 2.62Å
261	E	40.7	Very low	63	Low	100 Å²	100	42 Å²	42	47%	0.467	24%	0.239	S	C	.	.	S	Bend	trans	-79.1	134.2	175.9	-58.1	-175.5	172.3	0	0	108.7	P212 A256 N258 V263	P212-E261 WeakPolarHBondContact CG-O 3.31Å; A256-E261 HydrophobicContact CB-CB 4.09Å; N258-E261 PolarHBondContact O-N 2.77Å; N258-E261 VanDerWaalsContact O-N 3.12Å; E261-V263 HydrophobicContact CB-CB 4.4Å; E261-V263 HydrophobicContact CB-CG2 3.97Å; E261-V263 PolarHBondContact O-N 2.86Å
262	N	48.5	Very low	62.9	Low	89 Å²	89	44.9 Å²	44.9	48%	0.476	26%	0.263	S	S	.	.			trans	-68.9	29	174.4	-68.8	-50.6	0	0	0	112.3	R214	R214-N262 WeakPolarHBondContact CG-OD1 3.39Å; R214-N262 PolarHBondContact NE-ND2 3.49Å
263	V	49.2	Very low	63.2	Low	64 Å²	64	45.2 Å²	45.2	39%	0.388	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-84.5	119	176.2	178.2	0	0	0	0	106.9	P212 A256 E261	P212-V263 WeakPolarHBondContact CD-O 3.3Å; P212-V263 WeakPolarHBondContact CG-O 3.18Å; A256-V263 HydrophobicContact CB-CB 3.98Å; E261-V263 HydrophobicContact CB-CB 4.4Å; E261-V263 HydrophobicContact CB-CG2 3.97Å; E261-V263 PolarHBondContact O-N 2.86Å
264	P	57.3	Low	63.6	Low	33 Å²	33	45.6 Å²	45.6	21%	0.214	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-64.6	147	-179.2	26.6	-32.9	0	0	0	111.4	F209 I210	F209-P264 HydrophobicContact CB-CB 4.47Å; F209-P264 HydrophobicContact CD1-CB 3.8Å; F209-P264 HydrophobicContact CD1-CG 3.44Å; F209-P264 VanDerWaalsContact CD1-CG 3.44Å; F209-P264 HydrophobicContact CE1-CG 3.87Å; I210-P264 CarbonylContact O-C 3.56Å; I210-P264 WeakPolarHBondContact O-CA 3.18Å; I210-P264 WeakPolarHBondContact O-CB 3.21Å
265	A	67.7	Low	64.4	Low	21 Å²	21	50 Å²	50	17%	0.174	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	-73.9	139.2	164.6	0	0	0	0	0	109.4	I210 L252 Y267	I210-A265 PolarHBondContact N-O 3.05Å; I210-A265 PolarHBondContact O-N 3.12Å; I210-A265 VanDerWaalsContact O-N 3.09Å; L252-A265 HydrophobicContact CD1-CB 4.13Å; A265-Y267 HydrophobicContact CB-CE2 3.82Å
266	T	72.3	Confident	65.9	Low	18 Å²	18	50 Å²	50	11%	0.11	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	134.9	178.7	-61.2	0	0	0	0	109.6	S253 H254	S253-T266 PolarHBondContact N-O 3.23Å; H254-T266 VanDerWaalsContact CE1-CB 3.42Å; H254-T266 WeakPolarHBondContact CE1-CB 3.36Å; H254-T266 PolarHBondContact CE1-OG1 3.08Å; H254-T266 PolarHBondContact O-N 2.8Å
267	Y	79.5	Confident	68.1	Low	11 Å²	11	49.1 Å²	49.1	4%	0.043	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	137.5	179.4	-65.6	-103.9	0	0	0	111.2	F208 I210 L238 I251 L252 A265 R269	F208-Y267 HydrophobicContact CB-CD2 4.26Å; I210-Y267 HydrophobicContact CD1-CD2 4.13Å; I210-Y267 HydrophobicContact CD1-CE2 3.55Å; I210-Y267 HydrophobicContact CG1-CE2 4.19Å; L238-Y267 HydrophobicContact CB-CD1 3.52Å; L238-Y267 HydrophobicContact CB-CE1 3.6Å; L238-Y267 HydrophobicContact CB-CG 4.13Å; L238-Y267 HydrophobicContact CD1-CE1 4.49Å; L238-Y267 HydrophobicContact CD2-CD2 4.49Å; L238-Y267 HydrophobicContact CD2-CG 4.37Å; I251-Y267 CarbonylContact O-C 3.6Å; I251-Y267 WeakPolarHBondContact O-CA 3.24Å; L252-Y267 VanDerWaalsContact CA-CD1 3.48Å; L252-Y267 HydrophobicContact CB-CD1 3.98Å; L252-Y267 HydrophobicContact CB-CE1 3.64Å; L252-Y267 HydrophobicContact CD1-CD1 4.43Å; L252-Y267 HydrophobicContact CD1-CE1 3.96Å; L252-Y267 HydrophobicContact CD1-CE2 4.09Å; L252-Y267 HydrophobicContact CG-CE1 4.33Å; L252-Y267 VanDerWaalsContact N-CD1 3.32Å; A265-Y267 HydrophobicContact CB-CE2 3.82Å; Y267-R269 PolarHBondContact O-N 2.75Å
268	T	84.6	Confident	70.6	Confident	11 Å²	11	47.3 Å²	47.3	7%	0.067	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	113.1	169.7	-56.7	0	0	0	0	109	D136 I137 G250 I251 L270 Y273	D136-T268 PolarHBondContact O-OG1 3.04Å; I137-T268 HydrophobicContact CB-CG2 4.15Å; G250-T268 CarbonylContact C-O 3.58Å; G250-T268 WeakPolarHBondContact CA-O 3.5Å; I251-T268 PolarHBondContact N-O 3.29Å; I251-T268 PolarHBondContact O-N 3.11Å; T268-L270 PolarHBondContact O-N 3.37Å; T268-Y273 HydrophobicContact CG2-CD2 4.11Å; T268-Y273 HydrophobicContact CG2-CE2 3.45Å; T268-Y273 VanDerWaalsContact CG2-CE2 3.45Å
269	R	85	Confident	73	Confident	48 Å²	48	47.1 Å²	47.1	18%	0.181	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	109.6	-177.2	179.1	177.8	67.5	-167.6	-3.4	112.2	F202 S203 Y267 S271 A272 Y273	F202-R269 HydrophobicContact CE1-CG 4.25Å; S203-R269 PolarHBondContact O-NH1 3.01Å; Y267-R269 PolarHBondContact O-N 2.75Å; R269-S271 WeakPolarHBondContact CG-OG 3.46Å; R269-S271 PolarHBondContact O-N 3.07Å; R269-A272 WeakPolarHBondContact O-CB 3.48Å; R269-A272 PolarHBondContact O-N 3.33Å; R269-A272 VanDerWaalsContact O-N 3.16Å; R269-Y273 VanDerWaalsContact O-CD2 3.24Å; R269-Y273 WeakPolarHBondContact O-CD2 2.96Å
270	L	87.7	Confident	75.4	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.005	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-65	-32.8	-172	-79.2	166.5	0	0	0	114.9	F68 L82 I137 L157 P158 A248 L249 I251 T268 A272 Y273 I277	F68-L270 HydrophobicContact CE2-CD1 4.45Å; F68-L270 HydrophobicContact CZ-CD1 3.95Å; L82-L270 HydrophobicContact CD1-CD2 4.05Å; I137-L270 HydrophobicContact CD1-CD2 3.86Å; L157-L270 HydrophobicContact CD2-CD1 4.22Å; P158-L270 HydrophobicContact CG-CB 3.93Å; A248-L270 HydrophobicContact CB-CD1 3.58Å; A248-L270 WeakPolarHBondContact O-CD1 3.45Å; L249-L270 PolarHBondContact O-N 3.47Å; I251-L270 HydrophobicContact CD1-CD2 3.94Å; I251-L270 HydrophobicContact CG1-CD1 4.29Å; I251-L270 HydrophobicContact CG1-CD2 3.97Å; I251-L270 HydrophobicContact CG1-CG 4.14Å; T268-L270 PolarHBondContact O-N 3.37Å; L270-A272 PolarHBondContact O-N 3.48Å; L270-Y273 PolarHBondContact O-N 2.79Å; L270-I277 HydrophobicContact CD2-CD1 4.13Å
271	S	85.8	Confident	78	Confident	13 Å²	13	43.1 Å²	43.1	9%	0.091	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-60.6	-24.9	176.8	49.8	0	0	0	0	113.1	T162 R269 Y273	T162-S271 PolarHBondContact OG1-OG 3.41Å; R269-S271 WeakPolarHBondContact CG-OG 3.46Å; R269-S271 PolarHBondContact O-N 3.07Å; S271-Y273 PolarHBondContact O-N 3.46Å
272	A	84.8	Confident	80.2	Confident	61 Å²	61	41 Å²	41	50%	0.504	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-75.9	-7.4	175.4	0	0	0	0	0	113.9	R269 L270	R269-A272 WeakPolarHBondContact O-CB 3.48Å; R269-A272 PolarHBondContact O-N 3.33Å; R269-A272 VanDerWaalsContact O-N 3.16Å; L270-A272 PolarHBondContact O-N 3.48Å
273	Y	87.8	Confident	81.8	Confident	27 Å²	27	41.5 Å²	41.5	11%	0.106	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-118.8	11.4	-173.2	-65.9	-97.4	0	0	0	113.4	H126 N135 I137 T268 R269 L270 S271 Q275 W276 I277	H126-Y273 AromaticContact CD2-CE1 3.67Å; N135-Y273 WeakPolarHBondContact CA-OH 3.34Å; N135-Y273 HydrophobicContact CB-CE1 4.42Å; N135-Y273 PolarHBondContact OD1-OH 2.86Å; N135-Y273 VanDerWaalsContact OD1-OH 3.13Å; I137-Y273 HydrophobicContact CD1-CD1 4.41Å; I137-Y273 HydrophobicContact CD1-CG 4.18Å; I137-Y273 HydrophobicContact CG2-CD1 3.69Å; I137-Y273 HydrophobicContact CG2-CE1 3.57Å; I137-Y273 HydrophobicContact CG2-CG 4.41Å; T268-Y273 HydrophobicContact CG2-CD2 4.11Å; T268-Y273 HydrophobicContact CG2-CE2 3.45Å; T268-Y273 VanDerWaalsContact CG2-CE2 3.45Å; R269-Y273 VanDerWaalsContact O-CD2 3.24Å; R269-Y273 WeakPolarHBondContact O-CD2 2.96Å; L270-Y273 PolarHBondContact O-N 2.79Å; S271-Y273 PolarHBondContact O-N 3.46Å; Y273-Q275 VanDerWaalsContact C-N 3.33Å; Y273-Q275 PolarHBondContact O-N 3.23Å; Y273-W276 CarbonylContact O-C 3.54Å; Y273-W276 PolarHBondContact O-N 3.2Å; Y273-I277 WeakPolarHBondContact O-CG1 2.96Å; Y273-I277 PolarHBondContact O-N 3.44Å
274	G	87.3	Confident	83.5	Confident	13 Å²	13	38.5 Å²	38.5	13%	0.134	22%	0.215	C	C	.	.	H	α-helix	trans	-51.5	-47.1	-177.3	0	0	0	0	0	113.6	W276 I277 N278	G274-W276 PolarHBondContact O-N 2.66Å; G274-I277 PolarHBondContact O-N 2.89Å; G274-N278 PolarHBondContact O-N 2.84Å; G274-N278 PolarHBondContact O-ND2 3.3Å
275	Q	86	Confident	84.8	Confident	172 Å²	172	43.7 Å²	43.7	80%	0.804	23%	0.231	S	C	*	.	H	α-helix	trans	-62.5	-43	175.9	-172.1	-178.1	10.2	0	0	112.6	Y273 S279	Y273-Q275 VanDerWaalsContact C-N 3.33Å; Y273-Q275 PolarHBondContact O-N 3.23Å; Q275-S279 WeakPolarHBondContact O-CB 3.39Å; Q275-S279 PolarHBondContact O-N 2.94Å
276	W	88.2	Confident	85.6	Confident	31 Å²	31	51 Å²	51	12%	0.117	26%	0.259	C	S	.	.	H	α-helix	trans	-66.8	-40.6	178.8	174.4	80.7	0	0	0	111.6	L82 H126 I137 M139 Y273 G274 S279 S280	L82-W276 HydrophobicContact CD2-CZ3 4.44Å; H126-W276 HydrophobicContact CB-CD2 4.1Å; H126-W276 HydrophobicContact CB-CG 4.23Å; H126-W276 HydrophobicContact CB-CZ2 4.15Å; H126-W276 AromaticContact CE1-CD1 3.82Å; H126-W276 AromaticContact CG-CD1 3.67Å; H126-W276 AromaticContact CG-NE1 3.79Å; H126-W276 AromaticContact ND1-CD1 3.05Å; H126-W276 AromaticContact ND1-CG 3.71Å; H126-W276 AromaticContact ND1-NE1 3.44Å; H126-W276 PolarHBondContact ND1-NE1 3Å; I137-W276 HydrophobicContact CB-CZ3 4.46Å; I137-W276 HydrophobicContact CD1-CE3 3.93Å; I137-W276 HydrophobicContact CD1-CH2 4.33Å; I137-W276 HydrophobicContact CD1-CZ3 3.46Å; I137-W276 VanDerWaalsContact CD1-CZ3 3.46Å; I137-W276 HydrophobicContact CG1-CE3 4.31Å; I137-W276 HydrophobicContact CG1-CH2 3.86Å; I137-W276 HydrophobicContact CG1-CZ3 3.5Å; I137-W276 VanDerWaalsContact CG1-CZ3 3.5Å; I137-W276 HydrophobicContact CG2-CE3 4.41Å; I137-W276 HydrophobicContact CG2-CH2 4.32Å; I137-W276 HydrophobicContact CG2-CZ3 4.18Å; M139-W276 HydrophobicContact CB-CH2 3.79Å; M139-W276 HydrophobicContact CB-CZ3 4.38Å; M139-W276 HydrophobicContact CE-CZ3 4.45Å; Y273-W276 CarbonylContact O-C 3.54Å; Y273-W276 PolarHBondContact O-N 3.2Å; G274-W276 PolarHBondContact O-N 2.66Å; W276-S279 PolarHBondContact O-N 2.88Å; W276-S280 PolarHBondContact NE1-OG 2.9Å; W276-S280 WeakPolarHBondContact O-CB 3.48Å; W276-S280 PolarHBondContact O-N 2.91Å; W276-S280 PolarHBondContact O-OG 3.15Å
277	I	90	Very high	86	Confident	6 Å²	6	51.1 Å²	51.1	3%	0.031	26%	0.262	C	S	.	.	H	α-helix	trans	-58.8	-53.6	176.1	-72.6	162.2	0	0	0	109.7	M139 L157 L270 Y273 G274 S279 S280 L281	M139-I277 HydrophobicContact CE-CB 4.2Å; M139-I277 HydrophobicContact CE-CG1 4.34Å; M139-I277 HydrophobicContact CE-CG2 3.82Å; L157-I277 HydrophobicContact CD1-CD1 4.21Å; L157-I277 HydrophobicContact CD1-CG2 3.69Å; L270-I277 HydrophobicContact CD2-CD1 4.13Å; Y273-I277 WeakPolarHBondContact O-CG1 2.96Å; Y273-I277 PolarHBondContact O-N 3.44Å; G274-I277 PolarHBondContact O-N 2.89Å; I277-S279 VanDerWaalsContact C-N 3.34Å; I277-S279 PolarHBondContact O-N 2.92Å; I277-S280 PolarHBondContact O-N 3.47Å; I277-S280 VanDerWaalsContact O-N 3.15Å; I277-L281 HydrophobicContact CG2-CD1 4.25Å; I277-L281 WeakPolarHBondContact O-CG 3.36Å; I277-L281 PolarHBondContact O-N 2.87Å
278	N	90.4	Very high	86.1	Confident	107 Å²	107	54.2 Å²	54.2	57%	0.572	28%	0.283	S	S	*	.	H	α-helix	trans	-61	-43	-178.5	-75	-26.6	0	0	0	112.3	G274 S282	G274-N278 PolarHBondContact O-N 2.84Å; G274-N278 PolarHBondContact O-ND2 3.3Å; N278-S282 PolarHBondContact O-N 2.96Å
279	S	87.7	Confident	85.9	Confident	57 Å²	57	59 Å²	59	40%	0.399	30%	0.3	S	S	.	.	H	α-helix	trans	-63.2	-43.4	175.4	-176	0	0	0	0	111.8	Q275 W276 I277 S282 Q283	Q275-S279 WeakPolarHBondContact O-CB 3.39Å; Q275-S279 PolarHBondContact O-N 2.94Å; W276-S279 PolarHBondContact O-N 2.88Å; I277-S279 VanDerWaalsContact C-N 3.34Å; I277-S279 PolarHBondContact O-N 2.92Å; S279-S282 WeakPolarHBondContact O-CB 3.4Å; S279-S282 PolarHBondContact O-N 2.95Å; S279-Q283 WeakPolarHBondContact O-CG 3.15Å; S279-Q283 PolarHBondContact O-N 2.7Å; S279-Q283 PolarHBondContact O-NE2 2.86Å; S279-Q283 PolarHBondContact OG-NE2 3.12Å
280	S	86.9	Confident	85.8	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-65.5	-40	-179.3	-64.4	0	0	0	0	112.3	W276 I277 S282 Q283 L284	W276-S280 PolarHBondContact NE1-OG 2.9Å; W276-S280 WeakPolarHBondContact O-CB 3.48Å; W276-S280 PolarHBondContact O-N 2.91Å; W276-S280 PolarHBondContact O-OG 3.15Å; I277-S280 PolarHBondContact O-N 3.47Å; I277-S280 VanDerWaalsContact O-N 3.15Å; S280-S282 VanDerWaalsContact C-N 3.31Å; S280-S282 PolarHBondContact O-N 2.03Å; S280-Q283 PolarHBondContact O-N 2.8Å; S280-L284 WeakPolarHBondContact O-CB 3.45Å; S280-L284 WeakPolarHBondContact O-CG 3.06Å; S280-L284 PolarHBondContact O-N 3.44Å
281	L	90.6	Very high	85.7	Confident	23 Å²	23	58.3 Å²	58.3	12%	0.12	30%	0.299	C	S	.	.	H	α-helix	trans	-57.1	-44.9	173	-73.8	172.5	0	0	0	111.6	I70 N72 I80 M139 I277 R285	I70-L281 HydrophobicContact CD1-CD2 4.48Å; N72-L281 HydrophobicContact CB-CD2 3.92Å; I80-L281 HydrophobicContact CB-CD2 4.46Å; I80-L281 HydrophobicContact CD1-CD2 4.27Å; I80-L281 HydrophobicContact CG1-CD2 3.78Å; I80-L281 HydrophobicContact CG2-CD2 4.2Å; M139-L281 HydrophobicContact CE-CD2 4.25Å; M139-L281 HydrophobicContact CE-CG 4.05Å; M139-L281 HydrophobicContact SD-CD2 3.81Å; M139-L281 HydrophobicContact SD-CG 4Å; I277-L281 HydrophobicContact CG2-CD1 4.25Å; I277-L281 WeakPolarHBondContact O-CG 3.36Å; I277-L281 PolarHBondContact O-N 2.87Å; L281-R285 WeakPolarHBondContact O-CG 3.3Å; L281-R285 PolarHBondContact O-N 3.46Å
282	S	86.4	Confident	85.6	Confident	54 Å²	54	63.2 Å²	63.2	38%	0.378	32%	0.321	S	S	.	.	H	α-helix	trans	-65.5	-41.9	177.5	-175.4	0	0	0	0	112.5	N278 S279 S280	N278-S282 PolarHBondContact O-N 2.96Å; S279-S282 WeakPolarHBondContact O-CB 3.4Å; S279-S282 PolarHBondContact O-N 2.95Å; S280-S282 VanDerWaalsContact C-N 3.31Å; S280-S282 PolarHBondContact O-N 2.03Å
283	Q	83.3	Confident	85.1	Confident	100 Å²	100	62.4 Å²	62.4	47%	0.467	31%	0.307	S	S	.	.	H	α-helix	trans	-67.5	-47.8	179.4	-72.4	178.4	75.9	0	0	111.9	L124 S279 S280 R285 K286 A287	L124-Q283 HydrophobicContact CD1-CB 3.77Å; S279-Q283 WeakPolarHBondContact O-CG 3.15Å; S279-Q283 PolarHBondContact O-N 2.7Å; S279-Q283 PolarHBondContact O-NE2 2.86Å; S279-Q283 PolarHBondContact OG-NE2 3.12Å; S280-Q283 PolarHBondContact O-N 2.8Å; Q283-R285 PolarHBondContact O-N 3.29Å; Q283-K286 PolarHBondContact O-N 3.4Å; Q283-A287 PolarHBondContact O-N 3.17Å
284	L	84.7	Confident	84.4	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-62.8	-29.1	179.9	-75.8	174.2	0	0	0	113	I80 T122 L124 M139 R141 S280 K286 A287	I80-L284 HydrophobicContact CD1-CD1 4.27Å; T122-L284 HydrophobicContact CG2-CD2 3.64Å; L124-L284 HydrophobicContact CD1-CD2 4.15Å; L124-L284 HydrophobicContact CD1-CG 3.81Å; L124-L284 HydrophobicContact CG-CD2 3.84Å; L124-L284 HydrophobicContact CG-CG 4.03Å; M139-L284 HydrophobicContact CB-CD1 4.06Å; M139-L284 HydrophobicContact CG-CD1 3.51Å; M139-L284 HydrophobicContact SD-CD1 3.57Å; M139-L284 VanDerWaalsContact SD-CD1 3.57Å; R141-L284 HydrophobicContact CB-CB 4.4Å; R141-L284 HydrophobicContact CB-CD1 4.32Å; R141-L284 HydrophobicContact CB-CD2 4.22Å; R141-L284 WeakPolarHBondContact CD-O 3.36Å; R141-L284 PolarHBondContact NH1-O 3.18Å; S280-L284 WeakPolarHBondContact O-CB 3.45Å; S280-L284 WeakPolarHBondContact O-CG 3.06Å; S280-L284 PolarHBondContact O-N 3.44Å; L284-K286 VanDerWaalsContact C-N 3.26Å; L284-K286 PolarHBondContact O-N 2.96Å; L284-A287 PolarHBondContact O-N 3.49Å
285	R	85.2	Confident	83.3	Confident	142 Å²	142	68.4 Å²	68.4	54%	0.536	34%	0.337	S	S	.	.	H	α-helix	trans	-58.4	-39.4	173	-80.2	174.8	-176.9	164	-0.5	112.4	N72 R141 L281 Q283	N72-R285 PolarHBondContact O-NH2 2.87Å; R141-R285 PolarHBondContact NH1-O 3.44Å; L281-R285 WeakPolarHBondContact O-CG 3.3Å; L281-R285 PolarHBondContact O-N 3.46Å; Q283-R285 PolarHBondContact O-N 3.29Å
286	K	84.5	Confident	81.8	Confident	176 Å²	176	64 Å²	64	77%	0.765	34%	0.338	S	S	*	.	H	α-helix	trans	-95.5	-7.8	-176.2	-57.6	176.4	-172.9	177.1	0	113.3	Q283 L284	Q283-K286 PolarHBondContact O-N 3.4Å; L284-K286 VanDerWaalsContact C-N 3.26Å; L284-K286 PolarHBondContact O-N 2.96Å
287	A	80.6	Confident	79.7	Confident	20 Å²	20	69 Å²	69	17%	0.165	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-67.9	146.4	-174.7	0	0	0	0	0	112.6	R121 T122 Q283 L284	R121-A287 PolarHBondContact NH2-O 2.93Å; T122-A287 HydrophobicContact CG2-CB 3.78Å; Q283-A287 PolarHBondContact O-N 3.17Å; L284-A287 PolarHBondContact O-N 3.49Å
288	P	79.7	Confident	77.5	Confident	76 Å²	76	71.9 Å²	71.9	49%	0.494	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-62.5	157.8	177.4	27.5	-34.8	0	0	0	111.5	Q290	P288-Q290 HydrophobicContact CG-CG 4.47Å
289	Y	81	Confident	75	Confident	111 Å²	111	71.7 Å²	71.7	44%	0.435	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-81.5	118.4	175.4	-168.2	-89	0	0	0	109.1	R121 N143 T291	R121-Y289 HydrophobicContact CG-CD2 3.6Å; R121-Y289 HydrophobicContact CG-CE2 4.12Å; R121-Y289 HydrophobicContact CG-CG 4.23Å; N143-Y289 HydrophobicContact CB-CE2 4.08Å; Y289-T291 HydrophobicContact CE1-CG2 4.31Å; Y289-T291 WeakPolarHBondContact CE1-OG1 3.5Å; Y289-T291 VanDerWaalsContact CZ-CB 3.45Å; Y289-T291 WeakPolarHBondContact OH-CB 3.44Å; Y289-T291 PolarHBondContact OH-OG1 3.18Å
290	Q	84.3	Confident	73.1	Confident	34 Å²	34	74.9 Å²	74.9	16%	0.159	41%	0.407	C	S	.	.			trans	-121.5	15.6	-176.3	-64.6	-174	-31.3	0	0	112.6	P97 R121 T122 P288 E292 H293	P97-Q290 HydrophobicContact CB-CB 4.36Å; P97-Q290 HydrophobicContact CG-CB 3.92Å; R121-Q290 CarbonylContact O-C 3.47Å; R121-Q290 VanDerWaalsContact O-CA 3.31Å; R121-Q290 WeakPolarHBondContact O-CA 3.42Å; R121-Q290 WeakPolarHBondContact O-CB 3.37Å; R121-Q290 PolarHBondContact O-N 2.95Å; T122-Q290 PolarHBondContact OG1-OE1 3.35Å; P288-Q290 HydrophobicContact CG-CG 4.47Å; Q290-E292 PolarHBondContact O-N 3.08Å; Q290-E292 VanDerWaalsContact O-N 3.12Å; Q290-H293 HydrophobicContact CB-CB 4.35Å; Q290-H293 VanDerWaalsContact O-CB 3.31Å; Q290-H293 WeakPolarHBondContact O-CB 3.47Å; Q290-H293 PolarHBondContact O-N 3.14Å
291	T	84	Confident	71	Confident	0 Å²	0	83.1 Å²	83.1	0%	0	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-26.8	-177.6	-57.3	0	0	0	0	113.9	G98 R119 A120 R121 N143 Y289	G98-T291 WeakPolarHBondContact CA-O 3.49Å; R119-T291 HydrophobicContact CB-CG2 3.62Å; R119-T291 HydrophobicContact CG-CG2 4.32Å; R119-T291 PolarHBondContact NH2-O 3.26Å; A120-T291 VanDerWaalsContact O-CA 3.27Å; A120-T291 WeakPolarHBondContact O-CA 3.07Å; A120-T291 VanDerWaalsContact O-CB 3.3Å; A120-T291 WeakPolarHBondContact O-CB 3.33Å; A120-T291 WeakPolarHBondContact O-CG2 3.41Å; A120-T291 PolarHBondContact O-OG1 3.13Å; R121-T291 VanDerWaalsContact CA-OG1 3.29Å; R121-T291 WeakPolarHBondContact CA-OG1 3.44Å; R121-T291 PolarHBondContact O-N 2.84Å; N143-T291 HydrophobicContact CB-CG2 4.24Å; Y289-T291 HydrophobicContact CE1-CG2 4.31Å; Y289-T291 WeakPolarHBondContact CE1-OG1 3.5Å; Y289-T291 VanDerWaalsContact CZ-CB 3.45Å; Y289-T291 WeakPolarHBondContact OH-CB 3.44Å; Y289-T291 PolarHBondContact OH-OG1 3.18Å
292	E	83.9	Confident	69.1	Low	116 Å²	116	83.6 Å²	83.6	54%	0.542	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-2.4	177	-53.2	-47.4	144.1	0	0	113.3	R119 Q290 T294	R119-E292 IonicContact CZ-OE2 3.34Å; R119-E292 VanDerWaalsContact NH1-CD 3.31Å; R119-E292 IonicContact NH1-OE1 3.91Å; R119-E292 PolarHBondContact NH1-OE1 3.14Å; R119-E292 IonicContact NH1-OE2 3.01Å; R119-E292 PolarHBondContact NH1-OE2 2.56Å; R119-E292 IonicContact NH2-OE2 3.25Å; Q290-E292 PolarHBondContact O-N 3.08Å; Q290-E292 VanDerWaalsContact O-N 3.12Å; E292-T294 PolarHBondContact O-N 3.11Å
293	H	74.9	Confident	67.4	Low	45 Å²	45	84.2 Å²	84.2	21%	0.208	45%	0.449	C	S	.	.			trans	-72.2	114.8	176.3	-73.4	-127.8	0	0	0	109.4	P96 G98 Q290 Q297	P96-H293 WeakPolarHBondContact CB-O 3.26Å; G98-H293 WeakPolarHBondContact CA-O 2.75Å; G98-H293 PolarHBondContact N-O 3.25Å; Q290-H293 HydrophobicContact CB-CB 4.35Å; Q290-H293 VanDerWaalsContact O-CB 3.31Å; Q290-H293 WeakPolarHBondContact O-CB 3.47Å; Q290-H293 PolarHBondContact O-N 3.14Å; H293-Q297 PolarHBondContact ND1-O 3.02Å
294	T	73.6	Confident	66.2	Low	65 Å²	65	88 Å²	88	40%	0.399	46%	0.464	S	S	.	.			trans	-117.3	174.3	172.2	57.8	0	0	0	0	109.6	E292 G296 Q297	E292-T294 PolarHBondContact O-N 3.11Å; T294-G296 PolarHBondContact O-N 2.99Å; T294-G296 VanDerWaalsContact O-N 3.13Å; T294-Q297 PolarHBondContact O-N 3.18Å
295	Q	63.7	Low	64.9	Low	101 Å²	101	95.9 Å²	95.9	47%	0.472	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	122.9	-179.4	-86.5	-175	-21.6	0	0	110.3	P96	P96-Q295 HydrophobicContact CG-CG 4.33Å
296	G	54.5	Low	63.6	Low	80 Å²	80	90.6 Å²	90.6	83%	0.825	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	120	-13.6	-175.4	0	0	0	0	0	115.3	T294	T294-G296 PolarHBondContact O-N 2.99Å; T294-G296 VanDerWaalsContact O-N 3.13Å
297	Q	43.1	Very low	62.4	Low	134 Å²	134	89.1 Å²	89.1	63%	0.626	47%	0.467	S	S	*	.			trans	-135.1	40.3	-179.6	-66.6	-172.3	-15.6	0	0	113.8	H293 T294 T299	H293-Q297 PolarHBondContact ND1-O 3.02Å; T294-Q297 PolarHBondContact O-N 3.18Å; Q297-T299 PolarHBondContact O-N 2.95Å
298	G	44.3	Very low	61.3	Low	67 Å²	67	91.4 Å²	91.4	69%	0.691	48%	0.475	S	S	*	.			trans	-81.6	88.3	176.1	0	0	0	0	0	112.2	I300	G298-I300 PolarHBondContact O-N 3.32Å
299	T	39.2	Very low	59.7	Low	104 Å²	104	91.7 Å²	91.7	64%	0.638	48%	0.477	S	S	*	.			trans	-83.6	104.7	159.6	52.1	0	0	0	0	108.3	Q297 F301	Q297-T299 PolarHBondContact O-N 2.95Å; T299-F301 PolarHBondContact O-N 3.02Å
300	I	47.1	Very low	57.8	Low	123 Å²	123	90.1 Å²	90.1	63%	0.631	50%	0.495	S	S	*	.			trans	-68.2	111.4	167.4	-57.1	177.6	0	0	0	106.7	G298 I302	G298-I300 PolarHBondContact O-N 3.32Å; I300-I302 HydrophobicContact CG2-CD1 4.05Å; I300-I302 HydrophobicContact CG2-CG1 3.57Å; I300-I302 PolarHBondContact O-N 3.24Å; I300-I302 VanDerWaalsContact O-N 3.12Å
301	F	43.1	Very low	55.7	Low	173 Å²	173	94.3 Å²	94.3	76%	0.759	52%	0.516	S	S	*	.			trans	-78.3	97.1	172.7	-172.6	-93.2	0	0	0	108.6	T299	T299-F301 PolarHBondContact O-N 3.02Å
302	I	50.5	Low	53.5	Low	33 Å²	33	102.7 Å²	102.7	17%	0.169	56%	0.56	C	S	.	*			trans	-97.5	124.6	167.2	-53.2	-164.2	0	0	0	107.1	I300 K304 T306 L326 I327	I300-I302 HydrophobicContact CG2-CD1 4.05Å; I300-I302 HydrophobicContact CG2-CG1 3.57Å; I300-I302 PolarHBondContact O-N 3.24Å; I300-I302 VanDerWaalsContact O-N 3.12Å; I302-K304 PolarHBondContact O-N 2.76Å; I302-T306 VanDerWaalsContact CG2-OG1 3.25Å; I302-T306 WeakPolarHBondContact CG2-OG1 3.34Å; I302-L326 HydrophobicContact CD1-CD2 4.26Å; I302-L326 HydrophobicContact CD1-CG 4.49Å; I302-L326 HydrophobicContact CG2-CD2 3.91Å; I302-I327 HydrophobicContact CD1-CD1 3.9Å; I302-I327 HydrophobicContact CD1-CG1 3.3Å; I302-I327 HydrophobicContact CG1-CD1 4.43Å; I302-I327 HydrophobicContact CG1-CG1 4.31Å
303	P	50	Low	51.5	Low	67 Å²	67	105.5 Å²	105.5	44%	0.435	57%	0.566	S	S	.	*			trans	-47.2	136	169.3	-23.2	29.9	0	0	0	109.2	R305 T306	P303-R305 CarbonylContact O-C 3.53Å; P303-R305 PolarHBondContact O-N 3.26Å; P303-T306 WeakPolarHBondContact CD-OG1 3.46Å; P303-T306 PolarHBondContact O-OG1 3.15Å; P303-T306 VanDerWaalsContact O-OG1 3.1Å
304	K	57.8	Low	49.6	Very low	180 Å²	180	108.7 Å²	108.7	78%	0.783	59%	0.593	S	S	*	*	S	Bend	trans	-42.5	-36	-179.7	-83.8	-172.1	176.2	-177.5	0	112.2	I302 E322 G323	I302-K304 PolarHBondContact O-N 2.76Å; K304-E322 VanDerWaalsContact O-CA 3.31Å; K304-E322 WeakPolarHBondContact O-CA 3.4Å; K304-G323 PolarHBondContact O-N 3.25Å
305	R	58.7	Low	47.9	Very low	167 Å²	167	109.7 Å²	109.7	63%	0.63	62%	0.617	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-126.9	117.6	175.1	-79.3	-176.6	-174.9	-165.4	1.6	110	P303 F320 T321	P303-R305 CarbonylContact O-C 3.53Å; P303-R305 PolarHBondContact O-N 3.26Å; R305-F320 HydrophobicContact CB-CB 3.68Å; R305-F320 HydrophobicContact CB-CD1 4.03Å; R305-F320 HydrophobicContact CB-CG 4.08Å; R305-F320 HydrophobicContact CG-CB 3.9Å; R305-T321 WeakPolarHBondContact CA-O 3.17Å
306	T	57.9	Low	47.3	Very low	31 Å²	31	107.2 Å²	107.2	19%	0.19	62%	0.618	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.8	135.2	-178.9	-61.9	0	0	0	0	109.9	I302 P303 T321 L326	I302-T306 VanDerWaalsContact CG2-OG1 3.25Å; I302-T306 WeakPolarHBondContact CG2-OG1 3.34Å; P303-T306 WeakPolarHBondContact CD-OG1 3.46Å; P303-T306 PolarHBondContact O-OG1 3.15Å; P303-T306 VanDerWaalsContact O-OG1 3.1Å; T306-T321 PolarHBondContact N-O 3.09Å; T306-T321 PolarHBondContact O-N 2.77Å; T306-L326 HydrophobicContact CG2-CD2 3.69Å
307	R	58.7	Low	47	Very low	145 Å²	145	112.6 Å²	112.6	55%	0.547	62%	0.622	S	S	.	*			trans	-79.4	134	177.8	-168.1	-174.4	-81.8	171.9	-1.9	108.8	P309 Q318	R307-P309 WeakPolarHBondContact O-CD 3.4Å; R307-Q318 VanDerWaalsContact NH2-CD 3.3Å
308	L	56.9	Low	47.4	Very low	67 Å²	67	112 Å²	112	35%	0.351	62%	0.619	S	S	.	*			trans	-91.6	103.2	173.4	-76.6	167.4	0	0	0	109.6	M311 T321 L326	L308-M311 HydrophobicContact CD1-SD 4.48Å; L308-T321 HydrophobicContact CD1-CG2 4.34Å; L308-T321 HydrophobicContact CG-CG2 4.44Å; L308-L326 HydrophobicContact CD2-CD1 3.41Å; L308-L326 VanDerWaalsContact CD2-CD1 3.41Å; L308-L326 HydrophobicContact CG-CD1 4.3Å
309	P	46.3	Very low	48	Very low	82 Å²	82	116.9 Å²	116.9	53%	0.532	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.6	136.8	173.6	27.1	-29.6	0	0	0	110.6	F127 R307	F127-P309 HydrophobicContact CD2-CG 4.05Å; F127-P309 HydrophobicContact CE1-CG 4.03Å; F127-P309 HydrophobicContact CE2-CB 4.41Å; F127-P309 HydrophobicContact CE2-CG 3.13Å; F127-P309 HydrophobicContact CZ-CG 3.11Å; R307-P309 WeakPolarHBondContact O-CD 3.4Å
310	G	41.9	Very low	49.1	Very low	78 Å²	78	116.8 Å²	116.8	80%	0.804	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	106.7	-7.3	176.9	0	0	0	0	0	115.9	L312	G310-L312 PolarHBondContact O-N 2.61Å; G310-L312 VanDerWaalsContact O-N 3.14Å
311	M	40.3	Very low	49.7	Very low	122 Å²	122	112.4 Å²	112.4	60%	0.601	59%	0.594	S	S	*	*			trans	-73.4	104.1	164.5	-99.8	172.2	59.5	0	0	109	L308 W313	L308-M311 HydrophobicContact CD1-SD 4.48Å; M311-W313 PolarHBondContact O-N 2.87Å
312	L	37.5	Very low	50.4	Low	177 Å²	177	109.2 Å²	109.2	93%	0.927	58%	0.581	S	S	*	*			trans	-58.9	101.1	166.2	-73.6	160.4	0	0	0	107.7	G310	G310-L312 PolarHBondContact O-N 2.61Å; G310-L312 VanDerWaalsContact O-N 3.14Å
313	W	41.8	Very low	50.7	Low	174 Å²	174	108 Å²	108	66%	0.659	58%	0.577	S	S	*	*			trans	-129.6	118.6	179.1	-136.3	75.9	0	0	0	111.3	M311	M311-W313 PolarHBondContact O-N 2.87Å
314	S	35.8	Very low	51	Low	113 Å²	113	108.4 Å²	108.4	79%	0.79	58%	0.581	S	S	*	*			trans	-86.5	109.1	178.6	56.5	0	0	0	0	110.2
315	G	36.7	Very low	50.7	Low	86 Å²	86	102.5 Å²	102.5	89%	0.887	56%	0.563	S	S	*	*	S	Bend	trans	81	46.9	146.6	0	0	0	0	0	119.6
316	G	50.5	Low	50.6	Low	49 Å²	49	95.3 Å²	95.3	51%	0.505	54%	0.537	S	S	.	.	S	Bend	trans	-156.3	178	166	0	0	0	0	0	114.3	Q318	G316-Q318 PolarHBondContact O-N 3.49Å
317	Q	48.4	Very low	50.1	Low	192 Å²	192	97 Å²	97	90%	0.897	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-60.3	127.8	-179.7	-73.4	-159.9	-22.4	0	0	110.7	E319	Q317-E319 PolarHBondContact O-N 2.64Å
318	Q	53	Low	49.5	Very low	122 Å²	122	91.8 Å²	91.8	57%	0.57	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-57.1	118.1	-174.1	-87.3	171.2	-13.4	0	0	112.5	R307 G316 F320	R307-Q318 VanDerWaalsContact NH2-CD 3.3Å; G316-Q318 PolarHBondContact O-N 3.49Å; Q318-F320 HydrophobicContact CB-CE2 4.49Å; Q318-F320 WeakPolarHBondContact O-CD2 3.09Å
319	E	55.4	Low	49.1	Very low	170 Å²	170	94.2 Å²	94.2	79%	0.794	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-79.8	124.8	171.7	-73.5	-170.1	160.7	0	0	111	Q317	Q317-E319 PolarHBondContact O-N 2.64Å
320	F	62.3	Low	49.2	Very low	101 Å²	101	96.2 Å²	96.2	44%	0.443	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-95.4	136	169.6	-66.4	-97.5	0	0	0	108.6	R305 Q318	R305-F320 HydrophobicContact CB-CB 3.68Å; R305-F320 HydrophobicContact CB-CD1 4.03Å; R305-F320 HydrophobicContact CB-CG 4.08Å; R305-F320 HydrophobicContact CG-CB 3.9Å; Q318-F320 HydrophobicContact CB-CE2 4.49Å; Q318-F320 WeakPolarHBondContact O-CD2 3.09Å
321	T	61.4	Low	49.3	Very low	31 Å²	31	96.4 Å²	96.4	19%	0.19	54%	0.539	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	143.4	173.4	-149.8	0	0	0	0	110.4	R305 T306 L308 L326	R305-T321 WeakPolarHBondContact CA-O 3.17Å; T306-T321 PolarHBondContact N-O 3.09Å; T306-T321 PolarHBondContact O-N 2.77Å; L308-T321 HydrophobicContact CD1-CG2 4.34Å; L308-T321 HydrophobicContact CG-CG2 4.44Å; T321-L326 HydrophobicContact CG2-CB 3.75Å; T321-L326 HydrophobicContact CG2-CD1 4.16Å; T321-L326 HydrophobicContact CG2-CG 4.41Å
322	E	56.8	Low	48.9	Very low	106 Å²	106	93 Å²	93	50%	0.495	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	138	170.9	-86.1	-114.3	142.7	0	0	110.3	K304 S324 S325 L326	K304-E322 VanDerWaalsContact O-CA 3.31Å; K304-E322 WeakPolarHBondContact O-CA 3.4Å; E322-S324 PolarHBondContact O-N 3.29Å; E322-S324 VanDerWaalsContact O-N 3.15Å; E322-S325 WeakPolarHBondContact O-CB 3.09Å; E322-S325 PolarHBondContact O-N 2.78Å; E322-L326 PolarHBondContact O-N 3.42Å
323	G	56.8	Low	48.4	Very low	8 Å²	8	93.6 Å²	93.6	8%	0.082	53%	0.526	C	S	.	.	H	α-helix	trans	-56.5	-33.8	-177.8	0	0	0	0	0	113.6	K304 L326 I327	K304-G323 PolarHBondContact O-N 3.25Å; G323-L326 WeakPolarHBondContact O-CB 3.5Å; G323-L326 PolarHBondContact O-N 2.75Å; G323-I327 WeakPolarHBondContact O-CG1 3.32Å; G323-I327 PolarHBondContact O-N 3.16Å
324	S	55.9	Low	47.8	Very low	75 Å²	75	93.6 Å²	93.6	52%	0.524	53%	0.534	S	S	.	.	H	α-helix	trans	-64.7	-42.6	175.1	57.8	0	0	0	0	112.7	E322 L326 I327 A328	E322-S324 PolarHBondContact O-N 3.29Å; E322-S324 VanDerWaalsContact O-N 3.15Å; S324-L326 VanDerWaalsContact C-N 3.33Å; S324-I327 PolarHBondContact O-N 2.89Å; S324-A328 PolarHBondContact O-N 3.1Å; S324-A328 VanDerWaalsContact O-N 3.07Å
325	S	51.2	Low	47.5	Very low	57 Å²	57	97.9 Å²	97.9	40%	0.399	54%	0.538	S	S	.	.	H	α-helix	trans	-66.3	-35.9	174.6	-61.3	0	0	0	0	111.8	E322 A328 L329	E322-S325 WeakPolarHBondContact O-CB 3.09Å; E322-S325 PolarHBondContact O-N 2.78Å; S325-A328 PolarHBondContact O-N 3.14Å; S325-L329 PolarHBondContact O-N 3.15Å
326	L	57.4	Low	47.1	Very low	15 Å²	15	105 Å²	105	8%	0.079	54%	0.538	C	S	.	.	H	α-helix	trans	-63.8	-43.7	174	-173.1	61.9	0	0	0	111.6	I302 T306 L308 T321 E322 G323 S324 A328 L329 L330	I302-L326 HydrophobicContact CD1-CD2 4.26Å; I302-L326 HydrophobicContact CD1-CG 4.49Å; I302-L326 HydrophobicContact CG2-CD2 3.91Å; T306-L326 HydrophobicContact CG2-CD2 3.69Å; L308-L326 HydrophobicContact CD2-CD1 3.41Å; L308-L326 VanDerWaalsContact CD2-CD1 3.41Å; L308-L326 HydrophobicContact CG-CD1 4.3Å; T321-L326 HydrophobicContact CG2-CB 3.75Å; T321-L326 HydrophobicContact CG2-CD1 4.16Å; T321-L326 HydrophobicContact CG2-CG 4.41Å; E322-L326 PolarHBondContact O-N 3.42Å; G323-L326 WeakPolarHBondContact O-CB 3.5Å; G323-L326 PolarHBondContact O-N 2.75Å; S324-L326 VanDerWaalsContact C-N 3.33Å; L326-A328 VanDerWaalsContact C-N 3.31Å; L326-A328 PolarHBondContact O-N 2.75Å; L326-L329 PolarHBondContact O-N 3.23Å; L326-L330 HydrophobicContact CD1-CD1 4.36Å; L326-L330 HydrophobicContact CD1-CG 4.35Å; L326-L330 HydrophobicContact CG-CD1 3.99Å; L326-L330 HydrophobicContact CG-CG 4.39Å; L326-L330 WeakPolarHBondContact O-CB 3.03Å; L326-L330 VanDerWaalsContact O-CG 3.3Å; L326-L330 WeakPolarHBondContact O-CG 3.45Å; L326-L330 PolarHBondContact O-N 2.98Å
327	I	47.4	Very low	46.2	Very low	66 Å²	66	114.3 Å²	114.3	34%	0.338	56%	0.558	S	S	.	*	H	α-helix	trans	-58.1	-47.9	174.4	-66	167.6	0	0	0	109.6	I302 G323 S324 L329 L330 S331	I302-I327 HydrophobicContact CD1-CD1 3.9Å; I302-I327 HydrophobicContact CD1-CG1 3.3Å; I302-I327 HydrophobicContact CG1-CD1 4.43Å; I302-I327 HydrophobicContact CG1-CG1 4.31Å; G323-I327 WeakPolarHBondContact O-CG1 3.32Å; G323-I327 PolarHBondContact O-N 3.16Å; S324-I327 PolarHBondContact O-N 2.89Å; I327-L329 VanDerWaalsContact C-N 3.33Å; I327-L329 PolarHBondContact O-N 2.76Å; I327-L330 PolarHBondContact O-N 3.07Å; I327-S331 VanDerWaalsContact O-CB 3.3Å; I327-S331 WeakPolarHBondContact O-CB 3.05Å; I327-S331 PolarHBondContact O-N 2.81Å; I327-S331 PolarHBondContact O-OG 3.33Å; I327-S331 VanDerWaalsContact O-OG 3.11Å
328	A	45.5	Very low	45.7	Very low	37 Å²	37	111.6 Å²	111.6	31%	0.306	56%	0.555	S	S	.	*	H	α-helix	trans	-59.9	-42	179.9	0	0	0	0	0	112.7	S324 S325 L326 G332 Y333	S324-A328 PolarHBondContact O-N 3.1Å; S324-A328 VanDerWaalsContact O-N 3.07Å; S325-A328 PolarHBondContact O-N 3.14Å; L326-A328 VanDerWaalsContact C-N 3.31Å; L326-A328 PolarHBondContact O-N 2.75Å; A328-G332 PolarHBondContact O-N 2.78Å; A328-Y333 PolarHBondContact O-N 3.06Å
329	L	48	Very low	45.3	Very low	118 Å²	118	114.2 Å²	114.2	62%	0.618	60%	0.597	S	S	*	*	H	α-helix	trans	-62.1	-46.5	174.6	-88.1	156.8	0	0	0	112.2	S325 L326 I327	S325-L329 PolarHBondContact O-N 3.15Å; L326-L329 PolarHBondContact O-N 3.23Å; I327-L329 VanDerWaalsContact C-N 3.33Å; I327-L329 PolarHBondContact O-N 2.76Å
330	L	48.9	Very low	44.8	Very low	124 Å²	124	111.5 Å²	111.5	65%	0.649	59%	0.587	S	S	*	*	H	α-helix	trans	-70.3	-35.8	-178.9	-69.6	174.3	0	0	0	112.5	L326 I327 G332	L326-L330 HydrophobicContact CD1-CD1 4.36Å; L326-L330 HydrophobicContact CD1-CG 4.35Å; L326-L330 HydrophobicContact CG-CD1 3.99Å; L326-L330 HydrophobicContact CG-CG 4.39Å; L326-L330 WeakPolarHBondContact O-CB 3.03Å; L326-L330 VanDerWaalsContact O-CG 3.3Å; L326-L330 WeakPolarHBondContact O-CG 3.45Å; L326-L330 PolarHBondContact O-N 2.98Å; I327-L330 PolarHBondContact O-N 3.07Å; L330-G332 VanDerWaalsContact C-N 3.33Å
331	S	44.1	Very low	43.9	Very low	81 Å²	81	112 Å²	112	57%	0.566	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	3.5	-178.3	-57.1	0	0	0	0	113.7	I327 Y333	I327-S331 VanDerWaalsContact O-CB 3.3Å; I327-S331 WeakPolarHBondContact O-CB 3.05Å; I327-S331 PolarHBondContact O-N 2.81Å; I327-S331 PolarHBondContact O-OG 3.33Å; I327-S331 VanDerWaalsContact O-OG 3.11Å; S331-Y333 PolarHBondContact O-N 2.97Å; S331-Y333 VanDerWaalsContact O-N 3.14Å
332	G	32.4	Very low	43	Very low	50 Å²	50	116.5 Å²	116.5	52%	0.515	62%	0.617	S	S	.	*	T	Hydrogen-bonded Turn	trans	61	21.3	-178.3	0	0	0	0	0	114	A328 L330 H334	A328-G332 PolarHBondContact O-N 2.78Å; L330-G332 VanDerWaalsContact C-N 3.33Å; G332-H334 PolarHBondContact O-N 2.74Å
333	Y	26.8	Very low	42.1	Very low	190 Å²	190	117.1 Å²	117.1	75%	0.745	63%	0.625	S	S	*	*			trans	-84.4	99.5	-173	-142.1	-91.7	0	0	0	109.9	A328 S331 K335	A328-Y333 PolarHBondContact O-N 3.06Å; S331-Y333 PolarHBondContact O-N 2.97Å; S331-Y333 VanDerWaalsContact O-N 3.14Å; Y333-K335 PolarHBondContact O-N 3.12Å; Y333-K335 VanDerWaalsContact O-N 3.11Å
334	H	29.3	Very low	41.2	Very low	175 Å²	175	123.9 Å²	123.9	81%	0.81	66%	0.658	S	S	*	*			trans	-68.7	106.5	175.5	-67.7	-69.2	0	0	0	110.1	G332 R336	G332-H334 PolarHBondContact O-N 2.74Å; H334-R336 PolarHBondContact O-N 3.41Å
335	K	29.6	Very low	40.3	Very low	203 Å²	203	127.2 Å²	127.2	88%	0.883	67%	0.667	S	S	*	*			trans	-57.6	109.4	172.4	-158.7	177.7	-172.5	-179.3	0	108.2	Y333 R337	Y333-K335 PolarHBondContact O-N 3.12Å; Y333-K335 VanDerWaalsContact O-N 3.11Å; K335-R337 PolarHBondContact O-N 3.38Å
336	R	28.1	Very low	39.5	Very low	236 Å²	236	132.2 Å²	132.2	89%	0.891	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-52.7	127.4	171.3	-103.8	-176.3	177.4	-175.8	-0.5	107.8	H334 T338	H334-R336 PolarHBondContact O-N 3.41Å; R336-T338 PolarHBondContact O-N 2.95Å; R336-T338 VanDerWaalsContact O-N 3.14Å
337	R	30.9	Very low	38.1	Very low	244 Å²	244	141.2 Å²	141.2	92%	0.921	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-53.4	121.5	168.8	-98.7	-178.2	169.9	175.4	-3.6	107.5	K335	K335-R337 PolarHBondContact O-N 3.38Å
338	T	39.1	Very low	37.3	Very low	135 Å²	135	147.5 Å²	147.5	83%	0.828	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-57.6	138.3	161.2	43	0	0	0	0	107.8	R336	R336-T338 PolarHBondContact O-N 2.95Å; R336-T338 VanDerWaalsContact O-N 3.14Å
339	A	45.1	Very low	36.6	Very low	177 Å²	177	157.5 Å²	157.5	100%	1.463	81%	0.808	S	S	*	*			trans	-42.7	0	-169.8	0	0	0	0	0	115.2

Retrieved 339 of 339 residues in 238.1 ms (Link to these results)

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