A0A096MSS8_PAPAN Loading...

Carbonic anhydrase-related protein

Does not have a carbonic anhydrase catalytic activity.

AlphaFold DB (P35219), UniProt , Accession A0A096MSS8, Species PAPAN (Papio anubis, Olive baboon), Gene CA8, Length 290 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.8	Very low	38.9	Very low	247 Å²	247	149.2 Å²	149.2	100%	1.217	81%	0.809	S	S	*	*				0	136	0	-72.3	-175.1	-157.5	0	0	106.8
2	A	36.1	Very low	38.7	Very low	92 Å²	92	144.8 Å²	144.8	76%	0.76	81%	0.808	S	S	*	*			trans	-54	169	170.8	0	0	0	0	0	110.8
3	D	38.7	Very low	38.6	Very low	139 Å²	139	148 Å²	148	74%	0.743	81%	0.809	S	S	*	*			cis	176.5	175.5	37.4	-154.7	-12.1	0	0	0	108.8
4	L	41.5	Very low	38.4	Very low	134 Å²	134	145.9 Å²	145.9	70%	0.702	81%	0.806	S	S	*	*			trans	84.9	93.6	147.4	-64.7	155.3	0	0	0	120.7
5	S	37.4	Very low	38.3	Very low	91 Å²	91	148.9 Å²	148.9	64%	0.636	81%	0.811	S	S	*	*				24.3	127	119.7	61.9	0	0	0	0	120
6	F	44.5	Very low	38.2	Very low	215 Å²	215	152.3 Å²	152.3	94%	0.943	82%	0.816	S	S	*	*			trans	-140.1	133.4	142.7	-105.7	-88.9	0	0	0	110.4
7	I	36.1	Very low	38	Very low	135 Å²	135	153.9 Å²	153.9	69%	0.692	82%	0.818	S	S	*	*			trans	-90.7	140.2	177.8	-69.2	161.5	0	0	0	107.6
8	E	43.4	Very low	37.9	Very low	198 Å²	198	156 Å²	156	93%	0.925	82%	0.822	S	S	*	*			trans	-135.3	117.7	154.4	-91.6	-174.9	167.7	0	0	110
9	D	34.6	Very low	37.7	Very low	137 Å²	137	155.8 Å²	155.8	73%	0.733	82%	0.822	S	S	*	*			trans	-69.7	149.6	171.9	-71.7	-52.3	0	0	0	111.7
10	T	39.1	Very low	37.4	Very low	138 Å²	138	157.6 Å²	157.6	85%	0.847	83%	0.825	S	S	*	*			trans	-154.4	94.6	141.2	26.9	0	0	0	0	111.8
11	V	35.7	Very low	37.1	Very low	115 Å²	115	158.9 Å²	158.9	70%	0.697	83%	0.827	S	S	*	*			trans	37.5	105.5	133.2	-167	0	0	0	0	118.2
12	A	36.7	Very low	36.5	Very low	97 Å²	97	156.3 Å²	156.3	80%	0.802	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-83.2	131.2	157.8	0	0	0	0	0	110
13	F	37.4	Very low	36.3	Very low	186 Å²	186	160.7 Å²	160.7	82%	0.816	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-76.4	137.7	171.2	-71.2	-88.3	0	0	0	109.8
14	P	35.5	Very low	36	Very low	118 Å²	118	163.3 Å²	163.3	77%	0.766	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-75.5	136.9	176.6	31.2	-30.7	0	0	0	110.1	K16	P14-K16 PolarHBondContact O-N 3.08Å
15	E	37.8	Very low	36.2	Very low	191 Å²	191	166.2 Å²	166.2	89%	0.893	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-60.3	128	166.3	-70.9	175.1	158.3	0	0	108.5	E17	E15-E17 PolarHBondContact O-N 2.73Å
16	K	36.7	Very low	37.4	Very low	204 Å²	204	165 Å²	165	89%	0.887	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-73.5	117.1	170	-93.1	-177	167.7	-170.7	0	107.6	P14	P14-K16 PolarHBondContact O-N 3.08Å
17	E	35	Very low	38.9	Very low	180 Å²	180	159.1 Å²	159.1	84%	0.841	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-58.2	130.1	163.2	-69.3	177.5	153.2	0	0	108.6	E15 D19	E15-E17 PolarHBondContact O-N 2.73Å; E17-D19 PolarHBondContact O-N 2.79Å
18	E	36.2	Very low	41	Very low	191 Å²	191	160.6 Å²	160.6	89%	0.893	82%	0.822	S	S	*	*			trans	-76.3	111.9	170.7	-71.7	177.5	158	0	0	107.1	E20	E18-E20 PolarHBondContact O-N 3.2Å
19	D	33.1	Very low	43.2	Very low	153 Å²	153	153.3 Å²	153.3	82%	0.818	79%	0.786	S	S	*	*			trans	-67.1	111.8	172	-68.5	-46.6	0	0	0	108.5	E17 E21	E17-D19 PolarHBondContact O-N 2.79Å; D19-E21 PolarHBondContact O-N 2.76Å
20	E	32.5	Very low	45.7	Very low	190 Å²	190	147.7 Å²	147.7	89%	0.888	76%	0.76	S	S	*	*			trans	-68.5	103.4	166.7	-69.7	179	163.5	0	0	108	E18 E22	E18-E20 PolarHBondContact O-N 3.2Å; E20-E22 PolarHBondContact O-N 2.66Å; E20-E22 VanDerWaalsContact O-N 3.17Å
21	E	30.2	Very low	48	Very low	186 Å²	186	143.8 Å²	143.8	87%	0.869	73%	0.73	S	S	*	*			trans	-66.4	108.5	167.8	-74	-178.7	165.4	0	0	108.4	D19 E23	D19-E21 PolarHBondContact O-N 2.76Å; E21-E23 PolarHBondContact O-N 3.26Å
22	E	27.7	Very low	50.2	Low	193 Å²	193	144.7 Å²	144.7	90%	0.902	73%	0.727	S	S	*	*			trans	-59.7	104	167	-72.8	-176.8	162.4	0	0	108.4	E20 E24	E20-E22 PolarHBondContact O-N 2.66Å; E20-E22 VanDerWaalsContact O-N 3.17Å; E22-E24 PolarHBondContact O-N 3.38Å; E22-E24 VanDerWaalsContact O-N 3.16Å
23	E	31.7	Very low	51.9	Low	184 Å²	184	149.8 Å²	149.8	86%	0.86	73%	0.734	S	S	*	*			trans	-57.6	116.4	165.9	-74.6	-176.6	163.8	0	0	107.8	E21 E25	E21-E23 PolarHBondContact O-N 3.26Å; E23-E25 PolarHBondContact O-N 3.21Å
24	E	33.8	Very low	53.4	Low	194 Å²	194	144.4 Å²	144.4	91%	0.907	73%	0.731	S	S	*	*			trans	-53.9	109.6	169.1	-81.3	-170.8	155.7	0	0	108	E22 G26	E22-E24 PolarHBondContact O-N 3.38Å; E22-E24 VanDerWaalsContact O-N 3.16Å; E24-G26 VanDerWaalsContact C-N 3.32Å; E24-G26 PolarHBondContact O-N 3.21Å
25	E	45	Very low	55.3	Low	194 Å²	194	142 Å²	142	91%	0.907	71%	0.714	S	S	*	*			trans	-59.4	96.4	174.9	-77.7	-168.6	161.6	0	0	108.7	E23	E23-E25 PolarHBondContact O-N 3.21Å
26	G	62.3	Low	57.6	Low	66 Å²	66	139.1 Å²	139.1	68%	0.68	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-56.4	143.1	175	0	0	0	0	0	110.6	E24 E28	E24-G26 VanDerWaalsContact C-N 3.32Å; E24-G26 PolarHBondContact O-N 3.21Å; G26-E28 PolarHBondContact O-N 3.37Å; G26-E28 VanDerWaalsContact O-N 3.15Å
27	V	75.7	Confident	60.2	Low	91 Å²	91	130.5 Å²	130.5	55%	0.552	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-58.9	122.3	-178.1	-174.9	0	0	0	0	110.1	W29 V40 F41	V27-W29 PolarHBondContact O-N 3.28Å; V27-V40 HydrophobicContact CB-CG1 4.15Å; V27-V40 HydrophobicContact CG1-CG1 3.54Å; V27-V40 HydrophobicContact CG2-CG1 4.44Å; V27-F41 HydrophobicContact CB-CZ 4.09Å; V27-F41 HydrophobicContact CG1-CZ 4.45Å
28	E	81.1	Confident	62.9	Low	166 Å²	166	122.6 Å²	122.6	78%	0.776	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-63.3	134.3	-179.9	-171.6	170.4	-153	0	0	111	G26	G26-E28 PolarHBondContact O-N 3.37Å; G26-E28 VanDerWaalsContact O-N 3.15Å
29	W	89.1	Confident	65.4	Low	46 Å²	46	119.8 Å²	119.8	17%	0.174	62%	0.619	C	S	.	*			trans	-140.7	163.5	178	63.8	-88.2	0	0	0	110.4	V27 Y31 W37 F41 H87 I224 P225	V27-W29 PolarHBondContact O-N 3.28Å; W29-Y31 HydrophobicContact CH2-CE2 4.25Å; W29-Y31 HydrophobicContact CZ3-CD2 4.42Å; W29-Y31 HydrophobicContact CZ3-CE1 4.37Å; W29-Y31 AromaticContact CZ3-CE2 3.76Å; W29-Y31 HydrophobicContact CZ3-CE2 3.76Å; W29-Y31 AromaticContact CZ3-CZ 3.73Å; W29-W37 HydrophobicContact CE3-CH2 4.39Å; W29-W37 AromaticContact CE3-CZ2 3.69Å; W29-W37 HydrophobicContact CE3-CZ2 3.69Å; W29-W37 HydrophobicContact CZ3-CH2 4.15Å; W29-W37 AromaticContact CZ3-CZ2 3.81Å; W29-W37 HydrophobicContact CZ3-CZ2 3.81Å; W29-F41 HydrophobicContact CB-CE2 4.1Å; W29-F41 HydrophobicContact CB-CZ 4.49Å; W29-H87 HydrophobicContact CH2-CB 4.03Å; W29-H87 AromaticContact CH2-CG 3.94Å; W29-H87 HydrophobicContact CZ2-CB 4.44Å; W29-H87 PolarHBondContact O-CE1 2.95Å; W29-I224 HydrophobicContact CH2-CB 3.65Å; W29-I224 HydrophobicContact CH2-CG2 3.47Å; W29-I224 VanDerWaalsContact CH2-CG2 3.47Å; W29-I224 HydrophobicContact CZ2-CB 3.93Å; W29-I224 HydrophobicContact CZ2-CD1 4.13Å; W29-I224 HydrophobicContact CZ2-CG2 4.19Å; W29-I224 HydrophobicContact CZ3-CB 4.33Å; W29-I224 HydrophobicContact CZ3-CG2 4.12Å; W29-P225 HydrophobicContact CB-CG 4.15Å; W29-P225 HydrophobicContact CD2-CB 4.34Å; W29-P225 HydrophobicContact CD2-CG 3.64Å; W29-P225 HydrophobicContact CE3-CG 3.98Å; W29-P225 HydrophobicContact CG-CB 4.21Å; W29-P225 HydrophobicContact CG-CG 3.69Å
30	G	87.2	Confident	68.2	Low	19 Å²	19	116.2 Å²	116.2	20%	0.196	60%	0.603	C	S	.	*			trans	-160.6	-174.4	179.8	0	0	0	0	0	112.9	W37	G30-W37 PolarHBondContact O-NE1 3.29Å
31	Y	88.6	Confident	71.1	Confident	55 Å²	55	108.7 Å²	108.7	22%	0.216	57%	0.567	C	S	.	*			trans	-105.1	18.4	-177.8	-63.9	-83.7	0	0	0	113.2	W29 W37 H87 I224 N273	W29-Y31 HydrophobicContact CH2-CE2 4.25Å; W29-Y31 HydrophobicContact CZ3-CD2 4.42Å; W29-Y31 HydrophobicContact CZ3-CE1 4.37Å; W29-Y31 AromaticContact CZ3-CE2 3.76Å; W29-Y31 HydrophobicContact CZ3-CE2 3.76Å; W29-Y31 AromaticContact CZ3-CZ 3.73Å; Y31-W37 HydrophobicContact CD1-CH2 4.26Å; Y31-W37 HydrophobicContact CD1-CZ2 4.09Å; Y31-W37 AromaticContact CE1-CH2 3.83Å; Y31-W37 HydrophobicContact CE1-CH2 3.83Å; Y31-W37 HydrophobicContact CE1-CZ2 4.03Å; Y31-H87 HydrophobicContact CE2-CB 4.25Å; Y31-I224 WeakPolarHBondContact OH-CG2 3.3Å; Y31-N273 HydrophobicContact CD2-CB 3.84Å; Y31-N273 HydrophobicContact CE2-CB 3.71Å; Y31-N273 HydrophobicContact CG-CB 4.4Å; Y31-N273 PolarHBondContact OH-O 3.2Å
32	E	80.6	Confident	74.1	Confident	134 Å²	134	104.4 Å²	104.4	63%	0.626	56%	0.555	S	S	*	*			trans	-64.2	149.6	178.5	-62.6	-178.5	174	0	0	111	G34 V35	E32-G34 PolarHBondContact O-N 2.81Å; E32-V35 HydrophobicContact CB-CG2 3.91Å; E32-V35 VanDerWaalsContact O-CG2 3.24Å; E32-V35 WeakPolarHBondContact O-CG2 3.42Å; E32-V35 PolarHBondContact O-N 3.3Å
33	E	72.9	Confident	77.3	Confident	205 Å²	205	98.9 Å²	98.9	96%	0.958	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	132.6	-178.7	-168.3	175.1	-172.1	0	0	110.6
34	G	69.6	Low	80.4	Confident	72 Å²	72	90.4 Å²	90.4	74%	0.742	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.2	2.5	-179.9	0	0	0	0	0	115.3	E32 E36	E32-G34 PolarHBondContact O-N 2.81Å; G34-E36 PolarHBondContact O-N 3.35Å
35	V	75.5	Confident	83.3	Confident	67 Å²	67	86.7 Å²	86.7	41%	0.406	48%	0.48	S	S	.	.			trans	-67.8	119.6	173.5	179.2	0	0	0	0	110.3	E32 W37	E32-V35 HydrophobicContact CB-CG2 3.91Å; E32-V35 VanDerWaalsContact O-CG2 3.24Å; E32-V35 WeakPolarHBondContact O-CG2 3.42Å; E32-V35 PolarHBondContact O-N 3.3Å; V35-W37 HydrophobicContact CG1-CG 4.4Å
36	E	85.8	Confident	85.7	Confident	131 Å²	131	78.8 Å²	78.8	61%	0.612	45%	0.451	S	S	*	.			trans	-99.9	82.9	176.4	-65.6	-173.6	170.5	0	0	110.4	G34 G38 L39	G34-E36 PolarHBondContact O-N 3.35Å; E36-G38 PolarHBondContact O-N 3.19Å; E36-L39 HydrophobicContact CB-CD1 3.95Å; E36-L39 HydrophobicContact CB-CG 3.91Å; E36-L39 PolarHBondContact O-N 3.36Å; E36-L39 WeakPolarHBondContact OE2-CD1 3.33Å
37	W	91.2	Very high	87.2	Confident	24 Å²	24	81.5 Å²	81.5	9%	0.091	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-53.6	-31.6	179.7	-65.8	-19.3	0	0	0	113	W29 G30 Y31 V35 L39 V40 F41 A44 T223 P225 R275	W29-W37 HydrophobicContact CE3-CH2 4.39Å; W29-W37 AromaticContact CE3-CZ2 3.69Å; W29-W37 HydrophobicContact CE3-CZ2 3.69Å; W29-W37 HydrophobicContact CZ3-CH2 4.15Å; W29-W37 AromaticContact CZ3-CZ2 3.81Å; W29-W37 HydrophobicContact CZ3-CZ2 3.81Å; G30-W37 PolarHBondContact O-NE1 3.29Å; Y31-W37 HydrophobicContact CD1-CH2 4.26Å; Y31-W37 HydrophobicContact CD1-CZ2 4.09Å; Y31-W37 AromaticContact CE1-CH2 3.83Å; Y31-W37 HydrophobicContact CE1-CH2 3.83Å; Y31-W37 HydrophobicContact CE1-CZ2 4.03Å; V35-W37 HydrophobicContact CG1-CG 4.4Å; W37-L39 PolarHBondContact O-N 3.22Å; W37-L39 VanDerWaalsContact O-N 3.13Å; W37-V40 PolarHBondContact O-N 3.04Å; W37-F41 HydrophobicContact CB-CD2 4.29Å; W37-F41 PolarHBondContact O-N 3.16Å; W37-A44 HydrophobicContact CB-CB 4.06Å; W37-T223 WeakPolarHBondContact CZ3-O 3.16Å; W37-P225 HydrophobicContact CD2-CG 3.95Å; W37-P225 HydrophobicContact CE3-CG 4.17Å; W37-P225 HydrophobicContact CG-CG 4.16Å; W37-R275 HydrophobicContact CE3-CG 4.33Å; W37-R275 HydrophobicContact CH2-CB 4.15Å; W37-R275 HydrophobicContact CH2-CG 4.08Å; W37-R275 HydrophobicContact CZ3-CB 4.06Å; W37-R275 HydrophobicContact CZ3-CG 3.61Å
38	G	90.7	Very high	88.2	Confident	13 Å²	13	81.3 Å²	81.3	13%	0.134	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-60.5	-18.7	178.1	0	0	0	0	0	115.8	E36 N45	E36-G38 PolarHBondContact O-N 3.19Å; G38-N45 WeakPolarHBondContact CA-ND2 3.19Å; G38-N45 PolarHBondContact O-ND2 3.15Å
39	L	90.3	Very high	89	Confident	133 Å²	133	73.5 Å²	73.5	70%	0.696	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-75.9	-29.4	174.9	-63.6	-177.8	0	0	0	112.6	E36 W37	E36-L39 HydrophobicContact CB-CD1 3.95Å; E36-L39 HydrophobicContact CB-CG 3.91Å; E36-L39 PolarHBondContact O-N 3.36Å; E36-L39 WeakPolarHBondContact OE2-CD1 3.33Å; W37-L39 PolarHBondContact O-N 3.22Å; W37-L39 VanDerWaalsContact O-N 3.13Å
40	V	90.8	Very high	89.5	Confident	78 Å²	78	71.3 Å²	71.3	47%	0.473	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-37.2	-174.3	178.9	0	0	0	0	111	V27 W37 P42	V27-V40 HydrophobicContact CB-CG1 4.15Å; V27-V40 HydrophobicContact CG1-CG1 3.54Å; V27-V40 HydrophobicContact CG2-CG1 4.44Å; W37-V40 PolarHBondContact O-N 3.04Å; V40-P42 WeakPolarHBondContact O-CD 3.45Å
41	F	93.5	Very high	90	Very high	32 Å²	32	70.4 Å²	70.4	14%	0.14	38%	0.382	C	S	.	.			trans	-119	89.7	-179	-52.1	-77.6	0	0	0	108	V27 W29 W37 D43 A44 P225 P226	V27-F41 HydrophobicContact CB-CZ 4.09Å; V27-F41 HydrophobicContact CG1-CZ 4.45Å; W29-F41 HydrophobicContact CB-CE2 4.1Å; W29-F41 HydrophobicContact CB-CZ 4.49Å; W37-F41 HydrophobicContact CB-CD2 4.29Å; W37-F41 PolarHBondContact O-N 3.16Å; F41-D43 PolarHBondContact O-N 3.33Å; F41-D43 VanDerWaalsContact O-N 3.13Å; F41-A44 HydrophobicContact CB-CB 4.49Å; F41-A44 WeakPolarHBondContact O-CB 3.37Å; F41-A44 PolarHBondContact O-N 3.12Å; F41-P225 HydrophobicContact CD1-CB 3.89Å; F41-P225 HydrophobicContact CD2-CB 3.63Å; F41-P225 HydrophobicContact CD2-CG 3.73Å; F41-P225 HydrophobicContact CE1-CB 3.8Å; F41-P225 HydrophobicContact CE2-CB 3.53Å; F41-P225 HydrophobicContact CE2-CG 3.64Å; F41-P225 HydrophobicContact CG-CB 3.81Å; F41-P225 HydrophobicContact CG-CG 4.34Å; F41-P225 HydrophobicContact CZ-CB 3.61Å; F41-P225 HydrophobicContact CZ-CG 4.19Å; F41-P226 HydrophobicContact CD1-CB 4.17Å
42	P	93.9	Very high	90.5	Very high	95 Å²	95	67.8 Å²	67.8	62%	0.617	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-55.8	-33.2	-172.9	-29	36.3	0	0	0	114.4	V40 A44 N45	V40-P42 WeakPolarHBondContact O-CD 3.45Å; P42-A44 PolarHBondContact O-N 3.29Å; P42-A44 VanDerWaalsContact O-N 3.13Å; P42-N45 WeakPolarHBondContact O-CB 3.42Å; P42-N45 PolarHBondContact O-N 3.31Å
43	D	94.6	Very high	91.3	Very high	78 Å²	78	62.7 Å²	62.7	42%	0.417	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-54	-28.3	173.7	-78.9	13.2	0	0	0	112.4	F41 N45 G46 Q49 P226 S228	F41-D43 PolarHBondContact O-N 3.33Å; F41-D43 VanDerWaalsContact O-N 3.13Å; D43-N45 PolarHBondContact O-N 3.41Å; D43-N45 VanDerWaalsContact O-N 3.09Å; D43-G46 PolarHBondContact O-N 3.34Å; D43-Q49 VanDerWaalsContact O-CD 3.23Å; D43-Q49 PolarHBondContact O-NE2 3.18Å; D43-P226 WeakPolarHBondContact CB-O 3.47Å; D43-S228 WeakPolarHBondContact OD2-CA 3.46Å; D43-S228 PolarHBondContact OD2-OG 3.13Å
44	A	95.5	Very high	92.5	Very high	6 Å²	6	53 Å²	53	5%	0.05	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-63.9	-14.4	177.2	0	0	0	0	0	113.8	W37 F41 P42 C227 R275	W37-A44 HydrophobicContact CB-CB 4.06Å; F41-A44 HydrophobicContact CB-CB 4.49Å; F41-A44 WeakPolarHBondContact O-CB 3.37Å; F41-A44 PolarHBondContact O-N 3.12Å; P42-A44 PolarHBondContact O-N 3.29Å; P42-A44 VanDerWaalsContact O-N 3.13Å; A44-C227 HydrophobicContact CB-CB 3.75Å; A44-R275 PolarHBondContact O-NH2 2.95Å; A44-R275 VanDerWaalsContact O-NH2 3.14Å
45	N	94.7	Very high	93.8	Very high	116 Å²	116	51.5 Å²	51.5	62%	0.62	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-97.5	11.8	172.9	-61.5	-44.6	0	0	0	113.2	G38 P42 D43	G38-N45 WeakPolarHBondContact CA-ND2 3.19Å; G38-N45 PolarHBondContact O-ND2 3.15Å; P42-N45 WeakPolarHBondContact O-CB 3.42Å; P42-N45 PolarHBondContact O-N 3.31Å; D43-N45 PolarHBondContact O-N 3.41Å; D43-N45 VanDerWaalsContact O-N 3.09Å
46	G	95.4	Very high	94.5	Very high	28 Å²	28	50.5 Å²	50.5	29%	0.289	27%	0.274	S	S	.	.			trans	-65.1	167.9	177.9	0	0	0	0	0	113.9	D43 Q49 E229	D43-G46 PolarHBondContact O-N 3.34Å; G46-Q49 VanDerWaalsContact O-CG 3.23Å; G46-Q49 WeakPolarHBondContact O-CG 3.17Å; G46-E229 WeakPolarHBondContact CA-OE1 3.49Å
47	E	95.6	Very high	94.9	Very high	123 Å²	123	55.4 Å²	55.4	58%	0.575	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-19.9	-177.6	-68.8	-65.6	153.2	0	0	113	E229 S281	E47-E229 PolarHBondContact N-OE1 3.25Å; E47-S281 WeakPolarHBondContact O-CB 3.45Å; E47-S281 PolarHBondContact O-OG 2.88Å; E47-S281 PolarHBondContact OE2-OG 3.15Å
48	Y	96.6	Very high	95	Very high	86 Å²	86	60.4 Å²	60.4	34%	0.337	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	36.8	-175.2	-60.8	-103.9	0	0	0	110.8	G220 S221 E229 D282 R283	Y48-G220 CarbonylContact O-C 3.52Å; Y48-G220 WeakPolarHBondContact O-CA 3.33Å; Y48-S221 PolarHBondContact O-N 2.89Å; Y48-E229 WeakPolarHBondContact CA-OE1 3.44Å; Y48-E229 PolarHBondContact N-OE1 2.99Å; Y48-D282 PolarHBondContact OH-OD1 3.3Å; Y48-D282 PolarHBondContact OH-OD2 2.88Å; Y48-R283 VanDerWaalsContact CD1-CD 3.42Å; Y48-R283 HydrophobicContact CD1-CG 3.37Å; Y48-R283 HydrophobicContact CE1-CG 3.49Å; Y48-R283 VanDerWaalsContact CE1-CG 3.49Å; Y48-R283 HydrophobicContact CG-CG 4.38Å; Y48-R283 PolarHBondContact O-NH1 3.1Å; Y48-R283 VanDerWaalsContact O-NH1 3.16Å
49	Q	98	Very high	95.3	Very high	3 Å²	3	60.7 Å²	60.7	1%	0.014	31%	0.312	C	S	.	.			trans	-74.1	153.8	-177.8	-68.7	-68.3	-65.4	0	0	113.9	D43 G46 S221 C227 Q278 R283	D43-Q49 VanDerWaalsContact O-CD 3.23Å; D43-Q49 PolarHBondContact O-NE2 3.18Å; G46-Q49 VanDerWaalsContact O-CG 3.23Å; G46-Q49 WeakPolarHBondContact O-CG 3.17Å; Q49-S221 WeakPolarHBondContact CA-OG 3.22Å; Q49-S221 VanDerWaalsContact NE2-CB 3.34Å; Q49-S221 PolarHBondContact OE1-OG 3.48Å; Q49-C227 PolarHBondContact NE2-O 2.91Å; Q49-C227 VanDerWaalsContact OE1-CB 3.32Å; Q49-Q278 HydrophobicContact CB-CB 3.81Å; Q49-Q278 HydrophobicContact CB-CG 3.8Å; Q49-R283 VanDerWaalsContact O-CZ 3.27Å; Q49-R283 PolarHBondContact O-NH1 3.05Å; Q49-R283 PolarHBondContact O-NH2 3.35Å
50	S	98.5	Very high	95.7	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.309	C	S	.	.	S	Bend	trans	-122.1	157.7	176.9	-67.9	0	0	0	0	110.7	Y218 G220 S221 W233 R275	S50-Y218 WeakPolarHBondContact CB-OH 3.36Å; S50-Y218 PolarHBondContact OG-OH 3.16Å; S50-G220 WeakPolarHBondContact OG-CA 3.14Å; S50-S221 WeakPolarHBondContact CB-O 3.33Å; S50-S221 PolarHBondContact N-OG 3.34Å; S50-S221 PolarHBondContact OG-N 2.93Å; S50-S221 VanDerWaalsContact OG-N 3.07Å; S50-S221 PolarHBondContact OG-O 3.3Å; S50-W233 PolarHBondContact OG-NE1 2.93Å; S50-R275 WeakPolarHBondContact O-CD 3.44Å; S50-R275 PolarHBondContact O-NH1 2.89Å
51	P	98.5	Very high	96	Very high	0 Å²	0	63 Å²	63	0%	0	30%	0.304	C	S	.	.			cis	-78.6	175.7	-1.7	35.3	-39	0	0	0	112.1	E128 T223 R275 T277 Q278	P51-E128 VanDerWaalsContact CB-C 3.45Å; P51-E128 HydrophobicContact CB-CB 3.8Å; P51-E128 WeakPolarHBondContact CB-O 3.32Å; P51-E128 HydrophobicContact CG-CB 3.71Å; P51-E128 HydrophobicContact CG-CG 4.39Å; P51-E128 WeakPolarHBondContact CG-O 3.32Å; P51-T223 HydrophobicContact CB-CG2 4.3Å; P51-R275 VanDerWaalsContact CG-O 3.3Å; P51-R275 WeakPolarHBondContact CG-O 3.36Å; P51-T277 CarbonylContact O-C 3.59Å; P51-T277 WeakPolarHBondContact O-CA 3.49Å; P51-Q278 WeakPolarHBondContact O-CB 3.18Å; P51-Q278 PolarHBondContact O-N 3.47Å
52	I	98.5	Very high	96.2	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-125.3	161.5	176.1	60.4	167	0	0	0	112.2	H129 T130 Y218 L280 I285	I52-H129 PolarHBondContact N-CD2 2.85Å; I52-H129 PolarHBondContact O-CD2 3.43Å; I52-T130 PolarHBondContact O-N 3.07Å; I52-Y218 HydrophobicContact CD1-CD1 3.87Å; I52-Y218 HydrophobicContact CD1-CD2 3.94Å; I52-Y218 HydrophobicContact CD1-CE1 3.87Å; I52-Y218 HydrophobicContact CD1-CE2 4Å; I52-Y218 HydrophobicContact CD1-CG 3.91Å; I52-Y218 HydrophobicContact CG1-CD1 4.44Å; I52-Y218 HydrophobicContact CG1-CE1 3.93Å; I52-Y218 HydrophobicContact CG1-CE2 4.18Å; I52-Y218 HydrophobicContact CG2-CE2 4.19Å; I52-L280 HydrophobicContact CD1-CD1 3.67Å; I52-L280 HydrophobicContact CG2-CD1 4.43Å; I52-I285 HydrophobicContact CD1-CD1 3.53Å; I52-I285 HydrophobicContact CD1-CG1 3.95Å
53	N	98.3	Very high	96.3	Very high	27 Å²	27	61.7 Å²	61.7	14%	0.144	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	117.8	159.6	168.9	58.6	0	0	0	109.6	N55 T130 N132 F133 T277	N53-N55 PolarHBondContact O-N 2.98Å; N53-T130 WeakPolarHBondContact CA-OG1 3.16Å; N53-T130 WeakPolarHBondContact CB-OG1 3.31Å; N53-T130 PolarHBondContact OD1-OG1 2.59Å; N53-T130 VanDerWaalsContact OD1-OG1 3.08Å; N53-N132 PolarHBondContact OD1-N 2.74Å; N53-F133 HydrophobicContact CB-CD1 4.14Å; N53-F133 HydrophobicContact CB-CE1 4.01Å; N53-F133 VanDerWaalsContact ND2-CE1 3.26Å; N53-F133 WeakPolarHBondContact ND2-CE1 3.31Å; N53-F133 WeakPolarHBondContact ND2-CZ 3.11Å; N53-F133 WeakPolarHBondContact OD1-CA 3.44Å; N53-F133 PolarHBondContact OD1-N 2.74Å; N53-T277 HydrophobicContact CB-CG2 4.35Å
54	L	97.5	Very high	96.3	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	111.3	176	-169.5	147	0	0	0	110.3	S56 T130 V131 N132 W216 L235 I285	L54-S56 PolarHBondContact O-N 3.36Å; L54-T130 WeakPolarHBondContact CB-O 3.4Å; L54-T130 PolarHBondContact N-O 2.89Å; L54-V131 HydrophobicContact CB-CG2 4.47Å; L54-V131 HydrophobicContact CD2-CG1 4.23Å; L54-V131 CarbonylContact O-C 3.52Å; L54-V131 WeakPolarHBondContact O-CA 3.37Å; L54-N132 PolarHBondContact O-N 2.75Å; L54-W216 HydrophobicContact CD1-CB 3.6Å; L54-W216 HydrophobicContact CD1-CD2 3.41Å; L54-W216 VanDerWaalsContact CD1-CD2 3.41Å; L54-W216 HydrophobicContact CD1-CE3 3.66Å; L54-W216 HydrophobicContact CD1-CG 3.42Å; L54-W216 VanDerWaalsContact CD1-CG 3.42Å; L54-W216 HydrophobicContact CD1-CZ3 4.39Å; L54-W216 HydrophobicContact CD2-CD2 3.8Å; L54-W216 VanDerWaalsContact CD2-CE2 3.47Å; L54-W216 HydrophobicContact CD2-CE3 4.21Å; L54-W216 HydrophobicContact CD2-CG 4.28Å; L54-W216 HydrophobicContact CD2-CH2 4.05Å; L54-W216 HydrophobicContact CD2-CZ2 3.63Å; L54-W216 HydrophobicContact CD2-CZ3 4.31Å; L54-W216 HydrophobicContact CG-CD2 4.27Å; L54-W216 HydrophobicContact CG-CG 4.42Å; L54-L235 HydrophobicContact CD1-CD2 4.29Å; L54-I285 HydrophobicContact CB-CD1 4.3Å; L54-I285 HydrophobicContact CD1-CD1 4.28Å; L54-I285 HydrophobicContact CD1-CG2 3.93Å; L54-I285 HydrophobicContact CG-CD1 3.85Å; L54-I285 HydrophobicContact CG-CG2 4.32Å
55	N	95.7	Very high	96.4	Very high	42 Å²	42	60.5 Å²	60.5	23%	0.225	29%	0.294	C	S	.	.			trans	-84	103.3	167.5	-173.3	-13.5	0	0	0	109.8	N53 R57 E58 A59	N53-N55 PolarHBondContact O-N 2.98Å; N55-R57 PolarHBondContact O-N 2.85Å; N55-R57 PolarHBondContact OD1-N 3.49Å; N55-R57 VanDerWaalsContact OD1-N 3.17Å; N55-E58 HydrophobicContact CB-CB 4.16Å; N55-E58 HydrophobicContact CB-CG 4.27Å; N55-E58 WeakPolarHBondContact CB-OE2 3.3Å; N55-E58 PolarHBondContact ND2-OE1 3.34Å; N55-E58 PolarHBondContact ND2-OE2 3.06Å; N55-E58 PolarHBondContact O-N 3.28Å; N55-A59 PolarHBondContact O-N 2.9Å
56	S	91.8	Very high	96.4	Very high	45 Å²	45	57.8 Å²	57.8	32%	0.315	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-22.9	-175.6	57.3	0	0	0	0	114.1	L54 N132	L54-S56 PolarHBondContact O-N 3.36Å; S56-N132 PolarHBondContact N-OD1 2.7Å; S56-N132 VanDerWaalsContact OG-CG 3.31Å; S56-N132 PolarHBondContact OG-ND2 3Å; S56-N132 PolarHBondContact OG-OD1 3.03Å
57	R	92.8	Very high	96.4	Very high	235 Å²	235	62.9 Å²	62.9	89%	0.887	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-18.7	178.9	-63.6	-177.7	177.4	-176.2	-0.3	113.6	N55	N55-R57 PolarHBondContact O-N 2.85Å; N55-R57 PolarHBondContact OD1-N 3.49Å; N55-R57 VanDerWaalsContact OD1-N 3.17Å
58	E	94.8	Very high	96.3	Very high	128 Å²	128	60.8 Å²	60.8	60%	0.598	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-14.7	-179.7	-70.2	172.1	-179.1	0	0	112.3	N55 R60	N55-E58 HydrophobicContact CB-CB 4.16Å; N55-E58 HydrophobicContact CB-CG 4.27Å; N55-E58 WeakPolarHBondContact CB-OE2 3.3Å; N55-E58 PolarHBondContact ND2-OE1 3.34Å; N55-E58 PolarHBondContact ND2-OE2 3.06Å; N55-E58 PolarHBondContact O-N 3.28Å; E58-R60 PolarHBondContact O-N 3.5Å
59	A	96.6	Very high	96.2	Very high	20 Å²	20	65.4 Å²	65.4	17%	0.165	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-58.2	129.6	172.4	0	0	0	0	0	110.5	N55 I285 A287	N55-A59 PolarHBondContact O-N 2.9Å; A59-I285 WeakPolarHBondContact CA-O 3.49Å; A59-I285 HydrophobicContact CB-CB 4.46Å; A59-I285 HydrophobicContact CB-CG2 4.17Å; A59-A287 HydrophobicContact CB-CB 4.33Å
60	R	97.2	Very high	96.2	Very high	166 Å²	166	66.2 Å²	66.2	63%	0.626	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.5	122.1	-177.8	-61.3	-169.9	-173.1	169	1.8	109.9	E58 D62 V284 I285 R286 A287	E58-R60 PolarHBondContact O-N 3.5Å; R60-D62 PolarHBondContact O-N 3.14Å; R60-V284 HydrophobicContact CB-CG1 4.35Å; R60-V284 HydrophobicContact CG-CG1 4Å; R60-I285 PolarHBondContact N-O 2.91Å; R60-R286 CarbonylContact O-C 3.59Å; R60-R286 VanDerWaalsContact O-CA 3.26Å; R60-R286 WeakPolarHBondContact O-CA 2.81Å; R60-A287 PolarHBondContact O-N 3.06Å
61	Y	97.5	Very high	96.1	Very high	92 Å²	92	69 Å²	69	36%	0.361	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	125	170.7	175.8	-125.2	0	0	0	110.2	P63 A287 F289 Q290	Y61-P63 HydrophobicContact CE1-CB 3.97Å; Y61-P63 HydrophobicContact CE1-CG 4.27Å; Y61-A287 WeakPolarHBondContact CD2-O 3.38Å; Y61-F289 WeakPolarHBondContact CD2-O 3.48Å; Y61-Q290 HydrophobicContact CD1-CG 3.67Å; Y61-Q290 HydrophobicContact CD2-CG 4.06Å; Y61-Q290 HydrophobicContact CE1-CG 3.8Å; Y61-Q290 HydrophobicContact CE2-CG 4.17Å; Y61-Q290 HydrophobicContact CG-CG 3.79Å
62	D	97.4	Very high	96	Very high	31 Å²	31	69.7 Å²	69.7	17%	0.166	34%	0.34	C	S	.	.			trans	-123.7	100.4	176.1	-178.2	-1.9	0	0	0	109.3	R60 S64 L65 R286 A287	R60-D62 PolarHBondContact O-N 3.14Å; D62-S64 PolarHBondContact O-N 3.34Å; D62-S64 WeakPolarHBondContact OD1-CB 3.48Å; D62-S64 PolarHBondContact OD1-N 3.16Å; D62-S64 PolarHBondContact OD1-OG 3.33Å; D62-S64 PolarHBondContact OD2-OG 2.96Å; D62-L65 HydrophobicContact CB-CD1 3.96Å; D62-L65 HydrophobicContact CB-CG 4.09Å; D62-L65 WeakPolarHBondContact O-CB 3.42Å; D62-L65 PolarHBondContact O-N 3.09Å; D62-R286 HydrophobicContact CB-CB 4.01Å; D62-R286 HydrophobicContact CB-CG 4.45Å; D62-R286 WeakPolarHBondContact OD2-CD 3.32Å; D62-R286 IonicContact OD2-CZ 3.68Å; D62-R286 IonicContact OD2-NE 3.89Å; D62-R286 IonicContact OD2-NH1 3.19Å; D62-R286 PolarHBondContact OD2-NH1 2.85Å; D62-A287 PolarHBondContact N-O 2.98Å
63	P	96.1	Very high	95.9	Very high	69 Å²	69	74.5 Å²	74.5	45%	0.448	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-65.8	-21.4	-179.2	26.3	-33.8	0	0	0	113.3	Y61 L65 L66	Y61-P63 HydrophobicContact CE1-CB 3.97Å; Y61-P63 HydrophobicContact CE1-CG 4.27Å; P63-L65 PolarHBondContact O-N 3.18Å; P63-L66 WeakPolarHBondContact O-CB 3.37Å; P63-L66 PolarHBondContact O-N 3.5Å
64	S	96.2	Very high	95.8	Very high	57 Å²	57	73.7 Å²	73.7	40%	0.399	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-64.4	-23.2	-179.8	70.9	0	0	0	0	112.6	D62 L66 D67	D62-S64 PolarHBondContact O-N 3.34Å; D62-S64 WeakPolarHBondContact OD1-CB 3.48Å; D62-S64 PolarHBondContact OD1-N 3.16Å; D62-S64 PolarHBondContact OD1-OG 3.33Å; D62-S64 PolarHBondContact OD2-OG 2.96Å; S64-L66 PolarHBondContact O-N 2.82Å; S64-D67 WeakPolarHBondContact O-CB 3.3Å; S64-D67 PolarHBondContact O-N 3.45Å; S64-D67 VanDerWaalsContact O-N 3.13Å
65	L	96.8	Very high	95.7	Very high	2 Å²	2	77 Å²	77	1%	0.01	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-60.8	-15.8	172.1	-65	175.5	0	0	0	113.2	D62 P63 P103 Y215 V217 R286 A288	D62-L65 HydrophobicContact CB-CD1 3.96Å; D62-L65 HydrophobicContact CB-CG 4.09Å; D62-L65 WeakPolarHBondContact O-CB 3.42Å; D62-L65 PolarHBondContact O-N 3.09Å; P63-L65 PolarHBondContact O-N 3.18Å; L65-P103 HydrophobicContact CD2-CB 3.8Å; L65-Y215 HydrophobicContact CD1-CE2 4.27Å; L65-Y215 PolarHBondContact O-OH 2.7Å; L65-V217 HydrophobicContact CD1-CG1 3.74Å; L65-V217 HydrophobicContact CD2-CG1 3.94Å; L65-R286 HydrophobicContact CD1-CB 4.17Å; L65-A288 HydrophobicContact CB-CB 4.06Å; L65-A288 HydrophobicContact CD1-CB 4.09Å
66	L	94.7	Very high	95.7	Very high	59 Å²	59	77.7 Å²	77.7	31%	0.309	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-103.8	-7	-178.9	-56.8	176.9	0	0	0	113.3	P63 S64 A288	P63-L66 WeakPolarHBondContact O-CB 3.37Å; P63-L66 PolarHBondContact O-N 3.5Å; S64-L66 PolarHBondContact O-N 2.82Å; L66-A288 HydrophobicContact CD2-CB 4.1Å
67	D	94.5	Very high	95.8	Very high	136 Å²	136	75.5 Å²	75.5	73%	0.727	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-45.8	179.1	-71.6	-18.8	0	0	0	110.8	S64	S64-D67 WeakPolarHBondContact O-CB 3.3Å; S64-D67 PolarHBondContact O-N 3.45Å; S64-D67 VanDerWaalsContact O-N 3.13Å
68	V	94.8	Very high	95.8	Very high	78 Å²	78	73.5 Å²	73.5	47%	0.473	36%	0.364	S	S	.	.	S	Bend	trans	-121.5	104.4	164.5	-177.9	0	0	0	0	106.6	G102	V68-G102 WeakPolarHBondContact O-CA 3.22Å; V68-G102 PolarHBondContact O-N 3.04Å
69	R	94.4	Very high	95.7	Very high	183 Å²	183	72 Å²	72	69%	0.691	36%	0.361	S	S	*	.			trans	-61	145.8	-177.2	-67.4	-177.8	176.3	-123.9	-2.4	111.4	S71	R69-S71 PolarHBondContact O-N 3.46Å
70	L	97.1	Very high	95.6	Very high	21 Å²	21	71.1 Å²	71.1	11%	0.11	35%	0.353	C	S	.	.			trans	-55.7	123.8	170	-170.9	71.9	0	0	0	110.1	L99 L104 Y215 I234 F236	L70-L99 HydrophobicContact CD1-CD1 3.71Å; L70-L99 HydrophobicContact CD1-CD2 4.35Å; L70-L99 HydrophobicContact CD1-CG 4.12Å; L70-L99 HydrophobicContact CG-CD1 3.95Å; L70-L104 HydrophobicContact CD1-CD1 4.5Å; L70-Y215 HydrophobicContact CB-CE1 3.84Å; L70-Y215 HydrophobicContact CD2-CD1 4.22Å; L70-Y215 HydrophobicContact CD2-CE1 4.13Å; L70-I234 HydrophobicContact CD1-CD1 3.78Å; L70-I234 HydrophobicContact CD2-CD1 4.34Å; L70-I234 HydrophobicContact CD2-CG2 3.69Å; L70-F236 HydrophobicContact CD2-CE1 4.49Å; L70-F236 HydrophobicContact CD2-CZ 4.02Å
71	S	96.3	Very high	95.6	Very high	59 Å²	59	66.1 Å²	66.1	41%	0.413	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	86.3	-171.4	-179	0	0	0	0	110.8	R69 N73 S100	R69-S71 PolarHBondContact O-N 3.46Å; S71-N73 PolarHBondContact O-N 3.31Å; S71-S100 PolarHBondContact N-O 2.94Å; S71-S100 PolarHBondContact O-N 3.17Å
72	P	96.8	Very high	95.6	Very high	13 Å²	13	61.8 Å²	61.8	8%	0.084	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	120.3	165.8	-14	29.1	0	0	0	109.9	Y74 L99 L207	P72-Y74 HydrophobicContact CB-CD2 4.22Å; P72-Y74 HydrophobicContact CB-CE1 4.08Å; P72-Y74 HydrophobicContact CB-CE2 3.73Å; P72-L99 HydrophobicContact CB-CD1 3.97Å; P72-L99 HydrophobicContact CG-CD1 3.7Å; P72-L207 HydrophobicContact CB-CD1 3.53Å; P72-L207 HydrophobicContact CG-CD1 3.79Å; P72-L207 HydrophobicContact CG-CD2 4.41Å
73	N	96.2	Very high	95.7	Very high	102 Å²	102	61.5 Å²	61.5	55%	0.545	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	83.7	172.8	-179.7	26.8	0	0	0	108.8	S71 V98	S71-N73 PolarHBondContact O-N 3.31Å; N73-V98 CarbonylContact C-O 3.47Å; N73-V98 HydrophobicContact CB-CG2 4.2Å; N73-V98 PolarHBondContact N-O 2.91Å; N73-V98 PolarHBondContact O-N 3.26Å
74	Y	96.9	Very high	95.8	Very high	9 Å²	9	58.2 Å²	58.2	4%	0.035	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-99.8	138.5	-176.7	-50.9	-38.2	0	0	0	112.2	P72 L112 L142 H144 I166 P203 N204 L207	P72-Y74 HydrophobicContact CB-CD2 4.22Å; P72-Y74 HydrophobicContact CB-CE1 4.08Å; P72-Y74 HydrophobicContact CB-CE2 3.73Å; Y74-L112 HydrophobicContact CD1-CD2 4.15Å; Y74-L112 HydrophobicContact CE1-CB 4.29Å; Y74-L112 HydrophobicContact CE1-CD2 4.05Å; Y74-L112 HydrophobicContact CE2-CD2 4.43Å; Y74-L112 HydrophobicContact CG-CD2 4.36Å; Y74-L142 HydrophobicContact CE2-CD2 3.63Å; Y74-H144 AromaticContact CE1-NE2 3.46Å; Y74-H144 WeakPolarHBondContact CE1-NE2 3.5Å; Y74-H144 AromaticContact CZ-NE2 3.43Å; Y74-H144 PolarHBondContact OH-CE1 3.23Å; Y74-H144 PolarHBondContact OH-NE2 3.19Å; Y74-I166 WeakPolarHBondContact OH-CD1 3.26Å; Y74-P203 VanDerWaalsContact CB-CG 3.43Å; Y74-P203 HydrophobicContact CD2-CB 3.93Å; Y74-P203 HydrophobicContact CD2-CG 4.08Å; Y74-P203 HydrophobicContact CG-CB 4.32Å; Y74-P203 HydrophobicContact CG-CG 4.02Å; Y74-N204 PolarHBondContact O-ND2 2.98Å; Y74-L207 HydrophobicContact CD2-CD1 3.98Å; Y74-L207 HydrophobicContact CE2-CD1 3.73Å; Y74-L207 HydrophobicContact CE2-CD2 4.13Å; Y74-L207 HydrophobicContact CE2-CG 4.13Å
75	V	96.2	Very high	95.8	Very high	71 Å²	71	57 Å²	57	43%	0.43	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-92.5	143.8	175.6	-178.9	0	0	0	0	108.4	C77 K96 S97	V75-C77 PolarHBondContact O-N 3.29Å; V75-C77 VanDerWaalsContact O-N 3.15Å; V75-K96 WeakPolarHBondContact CG2-O 3.46Å; V75-S97 PolarHBondContact N-OG 3.01Å; V75-S97 PolarHBondContact O-OG 2.6Å
76	V	95.4	Very high	95.8	Very high	55 Å²	55	57.1 Å²	57.1	33%	0.333	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-60.7	119.5	172.4	178.1	0	0	0	0	108.7	R78 C200 N202	V76-R78 PolarHBondContact O-N 3.14Å; V76-C200 WeakPolarHBondContact CG1-SG 3.45Å; V76-N202 HydrophobicContact CG2-CB 4.07Å
77	C	93.7	Very high	95.9	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	120.4	176.4	-168.7	0	0	0	0	109.5	V75 C80 L93 K94 C200 F201	V75-C77 PolarHBondContact O-N 3.29Å; V75-C77 VanDerWaalsContact O-N 3.15Å; C77-C80 HydrophobicContact CB-CB 4.01Å; C77-C80 VanDerWaalsContact SG-CB 3.54Å; C77-C80 PolarHBondContact SG-SG 3.26Å; C77-L93 HydrophobicContact CB-CD2 4.43Å; C77-L93 HydrophobicContact CB-CG 4.24Å; C77-K94 PolarHBondContact SG-N 3.4Å; C77-C200 WeakPolarHBondContact O-CA 3.37Å; C77-F201 HydrophobicContact CB-CB 4.48Å; C77-F201 PolarHBondContact N-O 2.82Å; C77-F201 PolarHBondContact O-N 3.01Å
78	R	93.3	Very high	96	Very high	192 Å²	192	49.5 Å²	49.5	73%	0.725	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.3	141.6	167.9	-60.3	-176.4	-175.2	-169.9	1.2	108.5	V76 C80	V76-R78 PolarHBondContact O-N 3.14Å; R78-C80 VanDerWaalsContact C-N 3.28Å; R78-C80 PolarHBondContact O-N 2.9Å
79	D	92.7	Very high	96.2	Very high	98 Å²	98	45.8 Å²	45.8	52%	0.524	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	51.6	48.8	-179.3	-54.7	-42	0	0	0	112.6	K94 T197 I198 P199	D79-K94 PolarHBondContact O-NZ 3.46Å; D79-T197 VanDerWaalsContact C-CG2 3.42Å; D79-T197 VanDerWaalsContact CA-CG2 3.45Å; D79-T197 HydrophobicContact CB-CG2 3.74Å; D79-I198 CarbonylContact C-O 3.46Å; D79-I198 WeakPolarHBondContact CA-O 3.41Å; D79-P199 PolarHBondContact N-O 2.86Å
80	C	93.8	Very high	96.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	130.9	-179.5	-156.9	0	0	0	0	109.5	C77 R78 V91 I92 T197 I198 F201	C77-C80 HydrophobicContact CB-CB 4.01Å; C77-C80 VanDerWaalsContact SG-CB 3.54Å; C77-C80 PolarHBondContact SG-SG 3.26Å; R78-C80 VanDerWaalsContact C-N 3.28Å; R78-C80 PolarHBondContact O-N 2.9Å; C80-V91 WeakPolarHBondContact SG-CG1 3.41Å; C80-I92 PolarHBondContact SG-O 3.33Å; C80-T197 CarbonylContact O-C 3.59Å; C80-T197 VanDerWaalsContact O-CA 3.32Å; C80-T197 WeakPolarHBondContact O-CA 3.35Å; C80-I198 HydrophobicContact CB-CD1 4.39Å; C80-I198 HydrophobicContact CB-CG1 3.8Å; C80-I198 PolarHBondContact N-O 2.87Å; C80-I198 PolarHBondContact O-N 2.88Å; C80-F201 HydrophobicContact CB-CB 3.95Å
81	E	96.8	Very high	96.4	Very high	62 Å²	62	37.8 Å²	37.8	29%	0.29	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	132.1	177.3	-174.9	162.3	6.2	0	0	110.4	V91 I92 S195	E81-V91 WeakPolarHBondContact O-CA 3.42Å; E81-I92 PolarHBondContact O-N 2.89Å; E81-S195 VanDerWaalsContact OE2-CB 3.26Å; E81-S195 WeakPolarHBondContact OE2-CB 3.29Å; E81-S195 PolarHBondContact OE2-OG 2.93Å
82	V	98	Very high	96.3	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	123.6	174.7	-169.7	0	0	0	0	108.4	I89 Q90 V91 V182 I185 I189 S195 K196 I198	V82-I89 HydrophobicContact CG1-CG2 3.55Å; V82-Q90 CarbonylContact C-O 3.54Å; V82-Q90 VanDerWaalsContact CA-O 3.3Å; V82-Q90 WeakPolarHBondContact CA-O 3.36Å; V82-V91 HydrophobicContact CG1-CG2 4.08Å; V82-V91 HydrophobicContact CG2-CG1 4.49Å; V82-V91 HydrophobicContact CG2-CG2 4.17Å; V82-V182 HydrophobicContact CG1-CG1 4.27Å; V82-I185 HydrophobicContact CB-CD1 3.99Å; V82-I185 HydrophobicContact CG1-CD1 3.91Å; V82-I185 HydrophobicContact CG2-CD1 4.45Å; V82-I189 HydrophobicContact CB-CD1 4.27Å; V82-I189 HydrophobicContact CG1-CD1 3.67Å; V82-S195 CarbonylContact O-C 3.13Å; V82-S195 WeakPolarHBondContact O-CA 3.42Å; V82-K196 PolarHBondContact N-O 2.93Å; V82-K196 PolarHBondContact O-N 3.18Å; V82-I198 HydrophobicContact CG2-CD1 3.74Å; V82-I198 HydrophobicContact CG2-CG1 3.94Å; V82-I198 HydrophobicContact CG2-CG2 4.23Å
83	T	98.4	Very high	96	Very high	26 Å²	26	37 Å²	37	16%	0.16	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	137.4	-172.7	-57.7	0	0	0	0	110.5	I89 Q90 S195	T83-I89 CarbonylContact O-C 3.48Å; T83-I89 WeakPolarHBondContact O-CA 3.33Å; T83-Q90 PolarHBondContact N-O 3.12Å; T83-Q90 PolarHBondContact O-N 3.24Å; T83-S195 WeakPolarHBondContact OG1-CB 3.31Å
84	N	98.5	Very high	95.5	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	104.7	159.9	176.8	-4.2	0	0	0	107.9	G86 I89 I189 Q190 Y191 K192 G193 K194 R254	N84-G86 VanDerWaalsContact C-N 3.26Å; N84-G86 PolarHBondContact O-N 3.49Å; N84-G86 WeakPolarHBondContact OD1-CA 3.26Å; N84-G86 PolarHBondContact OD1-N 3.44Å; N84-I89 HydrophobicContact CB-CD1 3.83Å; N84-I189 WeakPolarHBondContact CB-O 3.5Å; N84-I189 PolarHBondContact ND2-O 3.33Å; N84-Q190 PolarHBondContact ND2-O 3.43Å; N84-Y191 VanDerWaalsContact ND2-C 3.34Å; N84-K192 CarbonylContact O-C 3.58Å; N84-G193 PolarHBondContact O-N 3.46Å; N84-K194 PolarHBondContact N-O 3.2Å; N84-R254 PolarHBondContact ND2-O 3.39Å
85	D	96.7	Very high	95	Very high	32 Å²	32	39.2 Å²	39.2	17%	0.171	19%	0.193	C	C	.	.			trans	-83.6	-2.5	-179.6	69.6	-3.6	0	0	0	112.8	H87 T88 Q90 K192	D85-H87 WeakPolarHBondContact OD1-CA 3.43Å; D85-H87 PolarHBondContact OD1-N 2.81Å; D85-T88 PolarHBondContact N-O 3.45Å; D85-T88 PolarHBondContact OD1-N 2.86Å; D85-T88 VanDerWaalsContact OD1-O 3.1Å; D85-Q90 VanDerWaalsContact OD2-CD 3.31Å; D85-Q90 PolarHBondContact OD2-NE2 3.07Å; D85-K192 WeakPolarHBondContact O-CE 3.46Å
86	G	96.4	Very high	94.9	Very high	3 Å²	3	41.2 Å²	41.2	3%	0.031	20%	0.195	C	C	.	.	S	Bend	trans	93	-10.9	-175	0	0	0	0	0	114.7	N84	N84-G86 VanDerWaalsContact C-N 3.26Å; N84-G86 PolarHBondContact O-N 3.49Å; N84-G86 WeakPolarHBondContact OD1-CA 3.26Å; N84-G86 PolarHBondContact OD1-N 3.44Å
87	H	96.4	Very high	94.9	Very high	34 Å²	34	38.6 Å²	38.6	16%	0.157	18%	0.18	C	C	.	.	S	Bend	trans	-117.1	-25.9	178.2	-56.7	-61.5	0	0	0	112.5	W29 Y31 D85 N273	W29-H87 HydrophobicContact CH2-CB 4.03Å; W29-H87 AromaticContact CH2-CG 3.94Å; W29-H87 HydrophobicContact CZ2-CB 4.44Å; W29-H87 PolarHBondContact O-CE1 2.95Å; Y31-H87 HydrophobicContact CE2-CB 4.25Å; D85-H87 WeakPolarHBondContact OD1-CA 3.43Å; D85-H87 PolarHBondContact OD1-N 2.81Å; H87-N273 WeakPolarHBondContact O-CB 3.29Å; H87-N273 PolarHBondContact O-ND2 3.22Å
88	T	98	Very high	95.1	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.006	18%	0.184	C	C	.	.	S	Bend	trans	-162.5	-179.1	-178.6	-171.2	0	0	0	0	111	D85 Q90 R116 F117	D85-T88 PolarHBondContact N-O 3.45Å; D85-T88 PolarHBondContact OD1-N 2.86Å; D85-T88 VanDerWaalsContact OD1-O 3.1Å; T88-Q90 HydrophobicContact CG2-CG 3.69Å; T88-R116 HydrophobicContact CG2-CG 3.8Å; T88-F117 PolarHBondContact OG1-N 3.18Å; T88-F117 PolarHBondContact OG1-O 3.39Å
89	I	98.4	Very high	95.4	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	126.6	157.7	-66.7	-55.7	0	0	0	107.6	V82 T83 N84 V91 F117 W119 V182 L186 I189 F250 L253	V82-I89 HydrophobicContact CG1-CG2 3.55Å; T83-I89 CarbonylContact O-C 3.48Å; T83-I89 WeakPolarHBondContact O-CA 3.33Å; N84-I89 HydrophobicContact CB-CD1 3.83Å; I89-V91 HydrophobicContact CG2-CG2 4.42Å; I89-F117 HydrophobicContact CB-CD2 4.04Å; I89-F117 HydrophobicContact CG2-CD2 4.13Å; I89-F117 HydrophobicContact CG2-CE2 4.2Å; I89-F117 VanDerWaalsContact O-CD2 3.31Å; I89-F117 WeakPolarHBondContact O-CD2 3.26Å; I89-W119 HydrophobicContact CG1-CH2 4.14Å; I89-V182 HydrophobicContact CG2-CG1 4.32Å; I89-L186 HydrophobicContact CD1-CD2 3.89Å; I89-L186 HydrophobicContact CG1-CD2 3.85Å; I89-L186 HydrophobicContact CG2-CD2 4.4Å; I89-I189 HydrophobicContact CD1-CD1 3.89Å; I89-F250 HydrophobicContact CB-CE1 4.25Å; I89-F250 HydrophobicContact CG1-CD1 4.2Å; I89-F250 HydrophobicContact CG1-CE1 4.07Å; I89-L253 HydrophobicContact CD1-CD1 3.43Å; I89-L253 VanDerWaalsContact CD1-CD1 3.43Å; I89-L253 HydrophobicContact CD1-CD2 4.07Å; I89-L253 HydrophobicContact CD1-CG 4.38Å; I89-L253 HydrophobicContact CG1-CD1 3.36Å
90	Q	97.4	Very high	95.6	Very high	37 Å²	37	27.3 Å²	27.3	17%	0.173	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	133	172.8	-62.4	-176.4	-14.2	0	0	109.2	V82 T83 D85 T88	V82-Q90 CarbonylContact C-O 3.54Å; V82-Q90 VanDerWaalsContact CA-O 3.3Å; V82-Q90 WeakPolarHBondContact CA-O 3.36Å; T83-Q90 PolarHBondContact N-O 3.12Å; T83-Q90 PolarHBondContact O-N 3.24Å; D85-Q90 VanDerWaalsContact OD2-CD 3.31Å; D85-Q90 PolarHBondContact OD2-NE2 3.07Å; T88-Q90 HydrophobicContact CG2-CG 3.69Å
91	V	97.5	Very high	95.8	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	108.4	170.4	-179	0	0	0	0	107.5	C80 E81 V82 I89 E114 V115 F117 V182 F201	C80-V91 WeakPolarHBondContact SG-CG1 3.41Å; E81-V91 WeakPolarHBondContact O-CA 3.42Å; V82-V91 HydrophobicContact CG1-CG2 4.08Å; V82-V91 HydrophobicContact CG2-CG1 4.49Å; V82-V91 HydrophobicContact CG2-CG2 4.17Å; I89-V91 HydrophobicContact CG2-CG2 4.42Å; V91-E114 WeakPolarHBondContact O-CA 3.28Å; V91-V115 HydrophobicContact CB-CB 4.14Å; V91-V115 PolarHBondContact N-O 3.41Å; V91-V115 PolarHBondContact O-N 2.99Å; V91-F117 HydrophobicContact CG2-CE2 3.89Å; V91-F117 HydrophobicContact CG2-CZ 4.44Å; V91-V182 HydrophobicContact CG2-CG2 4.2Å; V91-F201 HydrophobicContact CG1-CD1 3.79Å; V91-F201 HydrophobicContact CG1-CE1 3.86Å; V91-F201 HydrophobicContact CG1-CG 4.3Å; V91-F201 HydrophobicContact CG1-CZ 4.43Å
92	I	95.1	Very high	95.8	Very high	41 Å²	41	25.6 Å²	25.6	21%	0.21	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	123.8	-178.1	-56.6	-57.7	0	0	0	109.8	C80 E81 E114	C80-I92 PolarHBondContact SG-O 3.33Å; E81-I92 PolarHBondContact O-N 2.89Å; I92-E114 HydrophobicContact CD1-CB 3.71Å
93	L	89.3	Confident	95.8	Very high	15 Å²	15	26.7 Å²	26.7	8%	0.079	14%	0.143	C	C	.	.			trans	-91.7	123.2	179.9	-73.5	85	0	0	0	110.7	C77 L112 Y113 V115 P203	C77-L93 HydrophobicContact CB-CD2 4.43Å; C77-L93 HydrophobicContact CB-CG 4.24Å; L93-L112 HydrophobicContact CD1-CD2 4.09Å; L93-L112 HydrophobicContact CD1-CG 4.09Å; L93-L112 HydrophobicContact CD2-CD2 3.56Å; L93-L112 HydrophobicContact CD2-CG 4.1Å; L93-L112 HydrophobicContact CG-CD2 4.44Å; L93-Y113 PolarHBondContact N-O 3.05Å; L93-V115 HydrophobicContact CD1-CG2 4Å; L93-P203 HydrophobicContact CD2-CB 4.05Å; L93-P203 HydrophobicContact CD2-CG 3.67Å
94	K	85.7	Confident	95.8	Very high	128 Å²	128	26 Å²	26	56%	0.557	14%	0.139	S	C	*	.			trans	-90.3	-3.5	176.5	-63	-179.4	-179.3	168.8	0	113.5	C77 D79	C77-K94 PolarHBondContact SG-N 3.4Å; D79-K94 PolarHBondContact O-NZ 3.46Å
95	S	88.1	Confident	95.7	Very high	29 Å²	29	27.4 Å²	27.4	20%	0.203	15%	0.148	C	C	.	.	S	Bend	trans	-109.7	122.6	-177.1	-60	0	0	0	0	109.8	S97	S95-S97 PolarHBondContact O-N 2.76Å; S95-S97 PolarHBondContact O-OG 3Å
96	K	92.6	Very high	95.7	Very high	112 Å²	112	34.2 Å²	34.2	49%	0.487	18%	0.178	S	C	.	.			trans	-52.3	109.1	178.9	-176.4	170.5	-175	-167.6	0	110.2	V75 V98 E109 E111	V75-K96 WeakPolarHBondContact CG2-O 3.46Å; K96-V98 HydrophobicContact CG-CG1 4.09Å; K96-E109 IonicContact NZ-OE2 2.89Å; K96-E109 PolarHBondContact NZ-OE2 3.19Å; K96-E111 HydrophobicContact CG-CG 4.47Å
97	S	97	Very high	95.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.213	C	C	.	.			trans	-127.5	122.2	-175.7	-69.8	0	0	0	0	106.7	V75 S95 E111 L112	V75-S97 PolarHBondContact N-OG 3.01Å; V75-S97 PolarHBondContact O-OG 2.6Å; S95-S97 PolarHBondContact O-N 2.76Å; S95-S97 PolarHBondContact O-OG 3Å; S97-E111 CarbonylContact O-C 3.31Å; S97-E111 WeakPolarHBondContact O-CA 3.41Å; S97-L112 WeakPolarHBondContact O-CB 3.2Å; S97-L112 PolarHBondContact O-N 3.31Å
98	V	97.6	Very high	95.7	Very high	14 Å²	14	37.9 Å²	37.9	9%	0.085	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	147.4	-167.4	-62.7	0	0	0	0	112.4	N73 K96 E109 F110	N73-V98 CarbonylContact C-O 3.47Å; N73-V98 HydrophobicContact CB-CG2 4.2Å; N73-V98 PolarHBondContact N-O 2.91Å; N73-V98 PolarHBondContact O-N 3.26Å; K96-V98 HydrophobicContact CG-CG1 4.09Å; V98-E109 HydrophobicContact CB-CB 4.4Å; V98-E109 HydrophobicContact CG1-CB 4.22Å; V98-F110 CarbonylContact C-O 3.41Å; V98-F110 WeakPolarHBondContact CA-O 3.1Å
99	L	98.3	Very high	95.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	136.8	170.2	-177.9	66.7	0	0	0	108.9	L70 P72 L104 F110 I166 I234	L70-L99 HydrophobicContact CD1-CD1 3.71Å; L70-L99 HydrophobicContact CD1-CD2 4.35Å; L70-L99 HydrophobicContact CD1-CG 4.12Å; L70-L99 HydrophobicContact CG-CD1 3.95Å; P72-L99 HydrophobicContact CB-CD1 3.97Å; P72-L99 HydrophobicContact CG-CD1 3.7Å; L99-L104 HydrophobicContact CB-CD1 4.48Å; L99-L104 HydrophobicContact CD2-CD1 3.91Å; L99-L104 HydrophobicContact CG-CD1 3.75Å; L99-F110 HydrophobicContact CB-CB 4.28Å; L99-F110 PolarHBondContact N-O 3.26Å; L99-F110 PolarHBondContact O-N 3.12Å; L99-I166 HydrophobicContact CD1-CD1 3.89Å; L99-I166 HydrophobicContact CD2-CD1 3.77Å; L99-I166 HydrophobicContact CD2-CG1 3.92Å; L99-I166 HydrophobicContact CG-CD1 4.47Å; L99-I234 HydrophobicContact CD2-CD1 4.15Å
100	S	98.2	Very high	95.8	Very high	40 Å²	40	41.4 Å²	41.4	28%	0.28	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	169.5	175	62.3	0	0	0	0	111.3	S71	S71-S100 PolarHBondContact N-O 2.94Å; S71-S100 PolarHBondContact O-N 3.17Å
101	G	97.4	Very high	95.8	Very high	10 Å²	10	42 Å²	42	10%	0.103	23%	0.233	C	C	.	.	S	Bend	trans	72.9	-164.6	178.8	0	0	0	0	0	114.1	L104	G101-L104 WeakPolarHBondContact O-CB 3.16Å; G101-L104 WeakPolarHBondContact O-CG 3.48Å; G101-L104 PolarHBondContact O-N 3.5Å; G101-L104 VanDerWaalsContact O-N 3.16Å
102	G	97.2	Very high	95.8	Very high	15 Å²	15	42 Å²	42	16%	0.155	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	-123.1	-174	0	0	0	0	0	110.9	V68 L104 Y215	V68-G102 WeakPolarHBondContact O-CA 3.22Å; V68-G102 PolarHBondContact O-N 3.04Å; G102-L104 VanDerWaalsContact C-N 3.3Å; G102-Y215 WeakPolarHBondContact CA-OH 3.11Å
103	P	97.6	Very high	95.9	Very high	24 Å²	24	44.5 Å²	44.5	16%	0.156	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-5.7	178.2	35.1	-34.8	0	0	0	114.2	L65 V217 T232 I234	L65-P103 HydrophobicContact CD2-CB 3.8Å; P103-V217 HydrophobicContact CB-CB 4.32Å; P103-V217 HydrophobicContact CB-CG1 4.33Å; P103-V217 HydrophobicContact CB-CG2 3.62Å; P103-V217 HydrophobicContact CG-CB 4.28Å; P103-V217 HydrophobicContact CG-CG2 3.71Å; P103-T232 HydrophobicContact CB-CG2 4.28Å; P103-T232 HydrophobicContact CG-CG2 4.03Å; P103-I234 HydrophobicContact CG-CD1 3.85Å; P103-I234 HydrophobicContact CG-CG1 3.87Å
104	L	98.2	Very high	96.2	Very high	11 Å²	11	44 Å²	44	6%	0.058	24%	0.238	C	C	.	.	S	Bend	trans	-77.6	150.2	-173.2	-55.6	175.4	0	0	0	111.4	L70 L99 G101 G102 Q106 F110 A164 T232 I234	L70-L104 HydrophobicContact CD1-CD1 4.5Å; L99-L104 HydrophobicContact CB-CD1 4.48Å; L99-L104 HydrophobicContact CD2-CD1 3.91Å; L99-L104 HydrophobicContact CG-CD1 3.75Å; G101-L104 WeakPolarHBondContact O-CB 3.16Å; G101-L104 WeakPolarHBondContact O-CG 3.48Å; G101-L104 PolarHBondContact O-N 3.5Å; G101-L104 VanDerWaalsContact O-N 3.16Å; G102-L104 VanDerWaalsContact C-N 3.3Å; L104-Q106 PolarHBondContact O-N 2.93Å; L104-F110 HydrophobicContact CB-CD2 4.28Å; L104-F110 HydrophobicContact CB-CE2 3.94Å; L104-F110 HydrophobicContact CD1-CB 4.47Å; L104-F110 HydrophobicContact CD1-CD2 3.77Å; L104-F110 HydrophobicContact CD1-CE2 4.21Å; L104-F110 HydrophobicContact CD1-CG 4.18Å; L104-F110 HydrophobicContact CD2-CD2 4.21Å; L104-F110 HydrophobicContact CD2-CE1 4.32Å; L104-F110 HydrophobicContact CD2-CE2 3.96Å; L104-F110 HydrophobicContact CD2-CZ 4Å; L104-F110 HydrophobicContact CG-CD2 4.31Å; L104-F110 HydrophobicContact CG-CE2 4.25Å; L104-A164 HydrophobicContact CD2-CB 3.63Å; L104-T232 HydrophobicContact CD2-CG2 4.35Å; L104-I234 HydrophobicContact CD2-CD1 4.48Å
105	P	97.3	Very high	96.8	Very high	29 Å²	29	38 Å²	38	19%	0.188	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-52.6	135.3	176.8	-27.6	34.7	0	0	0	112.9	G107 H108 H161	P105-G107 PolarHBondContact O-N 2.97Å; P105-H108 HydrophobicContact CB-CB 4.27Å; P105-H108 WeakPolarHBondContact O-CB 3.37Å; P105-H108 PolarHBondContact O-N 2.78Å; P105-H108 VanDerWaalsContact O-N 3.15Å; P105-H161 HydrophobicContact CG-CB 4.02Å
106	Q	95.5	Very high	97.3	Very high	175 Å²	175	37.4 Å²	37.4	82%	0.818	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	128.2	-176.3	-172.6	177.5	24.6	0	0	111.1	L104 H108	L104-Q106 PolarHBondContact O-N 2.93Å; Q106-H108 VanDerWaalsContact C-N 3.32Å
107	G	96	Very high	97.6	Very high	73 Å²	73	32.1 Å²	32.1	75%	0.753	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.8	0	179.1	0	0	0	0	0	115	P105	P105-G107 PolarHBondContact O-N 2.97Å
108	H	98.1	Very high	97.6	Very high	41 Å²	41	32.1 Å²	32.1	19%	0.19	18%	0.182	C	C	.	.			trans	-88.8	142.2	175.5	-68.8	-134.7	0	0	0	111.2	P105 Q106 F110 N146	P105-H108 HydrophobicContact CB-CB 4.27Å; P105-H108 WeakPolarHBondContact O-CB 3.37Å; P105-H108 PolarHBondContact O-N 2.78Å; P105-H108 VanDerWaalsContact O-N 3.15Å; Q106-H108 VanDerWaalsContact C-N 3.32Å; H108-F110 HydrophobicContact CB-CD2 4.38Å; H108-F110 HydrophobicContact CB-CE2 3.92Å; H108-N146 PolarHBondContact ND1-ND2 3.15Å; H108-N146 PolarHBondContact ND1-OD1 2.97Å
109	E	98.2	Very high	97.7	Very high	76 Å²	76	31.4 Å²	31.4	36%	0.355	18%	0.178	S	C	.	.			trans	-104.2	124.1	170.2	-64.5	-167.8	148.9	0	0	110.2	K96 V98 S147 T148	K96-E109 IonicContact NZ-OE2 2.89Å; K96-E109 PolarHBondContact NZ-OE2 3.19Å; V98-E109 HydrophobicContact CB-CB 4.4Å; V98-E109 HydrophobicContact CG1-CB 4.22Å; E109-S147 PolarHBondContact O-N 2.87Å; E109-S147 VanDerWaalsContact O-N 3.1Å; E109-S147 PolarHBondContact O-OG 3.5Å; E109-T148 PolarHBondContact N-OG1 3.19Å
110	F	98.6	Very high	97.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	110.5	172.5	-75	-108	0	0	0	109.1	V98 L99 L104 H108 H144 W145 N146 H161 A164	V98-F110 CarbonylContact C-O 3.41Å; V98-F110 WeakPolarHBondContact CA-O 3.1Å; L99-F110 HydrophobicContact CB-CB 4.28Å; L99-F110 PolarHBondContact N-O 3.26Å; L99-F110 PolarHBondContact O-N 3.12Å; L104-F110 HydrophobicContact CB-CD2 4.28Å; L104-F110 HydrophobicContact CB-CE2 3.94Å; L104-F110 HydrophobicContact CD1-CB 4.47Å; L104-F110 HydrophobicContact CD1-CD2 3.77Å; L104-F110 HydrophobicContact CD1-CE2 4.21Å; L104-F110 HydrophobicContact CD1-CG 4.18Å; L104-F110 HydrophobicContact CD2-CD2 4.21Å; L104-F110 HydrophobicContact CD2-CE1 4.32Å; L104-F110 HydrophobicContact CD2-CE2 3.96Å; L104-F110 HydrophobicContact CD2-CZ 4Å; L104-F110 HydrophobicContact CG-CD2 4.31Å; L104-F110 HydrophobicContact CG-CE2 4.25Å; H108-F110 HydrophobicContact CB-CD2 4.38Å; H108-F110 HydrophobicContact CB-CE2 3.92Å; F110-H144 HydrophobicContact CB-CB 3.75Å; F110-W145 CarbonylContact C-O 3.51Å; F110-W145 WeakPolarHBondContact CA-O 3.44Å; F110-N146 HydrophobicContact CD1-CB 3.97Å; F110-N146 HydrophobicContact CE1-CB 3.63Å; F110-N146 HydrophobicContact CE2-CB 4.31Å; F110-N146 HydrophobicContact CG-CB 4.48Å; F110-N146 HydrophobicContact CZ-CB 3.82Å; F110-N146 WeakPolarHBondContact CZ-ND2 3.47Å; F110-H161 WeakPolarHBondContact CE1-O 3.45Å; F110-H161 WeakPolarHBondContact CZ-O 3.44Å; F110-A164 HydrophobicContact CD1-CB 3.56Å; F110-A164 HydrophobicContact CE1-CB 3.85Å; F110-A164 HydrophobicContact CG-CB 4.21Å
111	E	98.1	Very high	97.6	Very high	48 Å²	48	34.3 Å²	34.3	22%	0.224	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	129.4	-177	-178	162.9	169.5	0	0	110.6	K96 S97 Y113 H144 W145	K96-E111 HydrophobicContact CG-CG 4.47Å; S97-E111 CarbonylContact O-C 3.31Å; S97-E111 WeakPolarHBondContact O-CA 3.41Å; E111-Y113 PolarHBondContact O-N 2.91Å; E111-H144 CarbonylContact O-C 3.59Å; E111-H144 WeakPolarHBondContact O-CA 3.28Å; E111-H144 WeakPolarHBondContact O-CB 3.21Å; E111-W145 HydrophobicContact CB-CZ2 4.48Å; E111-W145 PolarHBondContact N-O 2.89Å; E111-W145 PolarHBondContact O-N 3.13Å
112	L	98	Very high	97.6	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.01	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	112.6	177.3	175.9	56	0	0	0	109.4	Y74 L93 S97 E114 L142 I143 P203	Y74-L112 HydrophobicContact CD1-CD2 4.15Å; Y74-L112 HydrophobicContact CE1-CB 4.29Å; Y74-L112 HydrophobicContact CE1-CD2 4.05Å; Y74-L112 HydrophobicContact CE2-CD2 4.43Å; Y74-L112 HydrophobicContact CG-CD2 4.36Å; L93-L112 HydrophobicContact CD1-CD2 4.09Å; L93-L112 HydrophobicContact CD1-CG 4.09Å; L93-L112 HydrophobicContact CD2-CD2 3.56Å; L93-L112 HydrophobicContact CD2-CG 4.1Å; L93-L112 HydrophobicContact CG-CD2 4.44Å; S97-L112 WeakPolarHBondContact O-CB 3.2Å; S97-L112 PolarHBondContact O-N 3.31Å; L112-E114 WeakPolarHBondContact CD1-O 3.39Å; L112-L142 HydrophobicContact CD1-CB 3.77Å; L112-L142 HydrophobicContact CD1-CG 4.3Å; L112-I143 WeakPolarHBondContact CD1-O 3.4Å; L112-P203 HydrophobicContact CD2-CB 4.02Å; L112-P203 HydrophobicContact CD2-CG 4.43Å
113	Y	96.3	Very high	97.6	Very high	93 Å²	93	41 Å²	41	37%	0.365	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	-54.5	-179.6	174.8	-108.3	0	0	0	111.2	L93 E111 I143 I153	L93-Y113 PolarHBondContact N-O 3.05Å; E111-Y113 PolarHBondContact O-N 2.91Å; Y113-I143 PolarHBondContact N-O 3.24Å; Y113-I153 HydrophobicContact CD1-CD1 3.37Å; Y113-I153 HydrophobicContact CD2-CB 4.43Å; Y113-I153 HydrophobicContact CD2-CD1 4.26Å; Y113-I153 HydrophobicContact CD2-CG2 4.09Å; Y113-I153 HydrophobicContact CE1-CD1 3.89Å; Y113-I153 HydrophobicContact CE1-CG2 4.44Å; Y113-I153 HydrophobicContact CE2-CG2 3.84Å; Y113-I153 HydrophobicContact CG-CD1 3.6Å; Y113-I153 HydrophobicContact CG-CG2 4.5Å
114	E	96.6	Very high	97.6	Very high	5 Å²	5	46.3 Å²	46.3	2%	0.023	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	157.5	-177.5	74.2	175.5	-149.3	0	0	113.2	V91 I92 L112 R116 I143	V91-E114 WeakPolarHBondContact O-CA 3.28Å; I92-E114 HydrophobicContact CD1-CB 3.71Å; L112-E114 WeakPolarHBondContact CD1-O 3.39Å; E114-R116 IonicContact OE1-CZ 3.74Å; E114-R116 IonicContact OE1-NE 3.8Å; E114-R116 PolarHBondContact OE1-NE 3.28Å; E114-R116 IonicContact OE1-NH2 3.97Å; E114-R116 PolarHBondContact OE1-NH2 3.32Å; E114-R116 IonicContact OE2-NH2 2.82Å; E114-I143 HydrophobicContact CG-CB 4.05Å; E114-I143 HydrophobicContact CG-CD1 3.9Å; E114-I143 HydrophobicContact CG-CG1 4.14Å; E114-I143 PolarHBondContact O-N 3.49Å; E114-I143 WeakPolarHBondContact OE1-CD1 3.43Å
115	V	98	Very high	97.5	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	126.9	160.3	-173	0	0	0	0	109.2	V91 L93 F117 L140 H141 L142 F201 L206	V91-V115 HydrophobicContact CB-CB 4.14Å; V91-V115 PolarHBondContact N-O 3.41Å; V91-V115 PolarHBondContact O-N 2.99Å; L93-V115 HydrophobicContact CD1-CG2 4Å; V115-F117 HydrophobicContact CB-CE2 4.44Å; V115-F117 HydrophobicContact CG1-CE2 3.88Å; V115-F117 HydrophobicContact CG1-CZ 3.96Å; V115-L140 HydrophobicContact CG1-CD2 4.4Å; V115-H141 CarbonylContact C-O 3.58Å; V115-H141 VanDerWaalsContact CA-O 3.31Å; V115-H141 WeakPolarHBondContact CA-O 3.38Å; V115-L142 HydrophobicContact CG1-CD1 4.16Å; V115-L142 HydrophobicContact CG2-CD1 4.49Å; V115-L142 HydrophobicContact CG2-CG 4.1Å; V115-F201 HydrophobicContact CG2-CE1 4.22Å; V115-L206 HydrophobicContact CG1-CD1 3.74Å; V115-L206 HydrophobicContact CG2-CD1 4.09Å
116	R	98	Very high	97.5	Very high	18 Å²	18	49.6 Å²	49.6	7%	0.068	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	151.9	-178.9	175.8	172.2	-62.1	-158.9	-2.2	111.2	T88 E114 L140 H141 I143 I224	T88-R116 HydrophobicContact CG2-CG 3.8Å; E114-R116 IonicContact OE1-CZ 3.74Å; E114-R116 IonicContact OE1-NE 3.8Å; E114-R116 PolarHBondContact OE1-NE 3.28Å; E114-R116 IonicContact OE1-NH2 3.97Å; E114-R116 PolarHBondContact OE1-NH2 3.32Å; E114-R116 IonicContact OE2-NH2 2.82Å; R116-L140 CarbonylContact O-C 3.49Å; R116-L140 WeakPolarHBondContact O-CA 3.49Å; R116-H141 HydrophobicContact CB-CB 4.32Å; R116-H141 PolarHBondContact N-O 3.34Å; R116-H141 PolarHBondContact O-N 3.08Å; R116-I143 HydrophobicContact CB-CD1 4.46Å; R116-I224 VanDerWaalsContact NH1-CG1 3.27Å
117	F	98.6	Very high	97.7	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	135	-175	-58.9	-105.4	0	0	0	111.9	T88 I89 V91 V115 W119 M138 L140 L179 F250 N273	T88-F117 PolarHBondContact OG1-N 3.18Å; T88-F117 PolarHBondContact OG1-O 3.39Å; I89-F117 HydrophobicContact CB-CD2 4.04Å; I89-F117 HydrophobicContact CG2-CD2 4.13Å; I89-F117 HydrophobicContact CG2-CE2 4.2Å; I89-F117 VanDerWaalsContact O-CD2 3.31Å; I89-F117 WeakPolarHBondContact O-CD2 3.26Å; V91-F117 HydrophobicContact CG2-CE2 3.89Å; V91-F117 HydrophobicContact CG2-CZ 4.44Å; V115-F117 HydrophobicContact CB-CE2 4.44Å; V115-F117 HydrophobicContact CG1-CE2 3.88Å; V115-F117 HydrophobicContact CG1-CZ 3.96Å; F117-W119 HydrophobicContact CB-CE3 3.85Å; F117-W119 HydrophobicContact CB-CZ3 3.77Å; F117-W119 VanDerWaalsContact O-CZ3 3.26Å; F117-W119 WeakPolarHBondContact O-CZ3 3.34Å; F117-M138 HydrophobicContact CD1-SD 4.23Å; F117-L140 HydrophobicContact CD1-CD2 3.82Å; F117-L140 HydrophobicContact CD1-CG 3.95Å; F117-L140 HydrophobicContact CE1-CD2 3.32Å; F117-L140 HydrophobicContact CE1-CG 3.98Å; F117-L140 HydrophobicContact CZ-CD2 3.99Å; F117-L179 HydrophobicContact CE1-CD2 3.67Å; F117-L179 HydrophobicContact CZ-CD2 3.95Å; F117-F250 HydrophobicContact CB-CE1 4Å; F117-F250 AromaticContact CD1-CE1 3.74Å; F117-F250 HydrophobicContact CD1-CE1 3.74Å; F117-F250 AromaticContact CD1-CZ 3.66Å; F117-F250 HydrophobicContact CD1-CZ 3.66Å; F117-F250 HydrophobicContact CD2-CE1 4.35Å; F117-F250 HydrophobicContact CE1-CE1 4.28Å; F117-F250 AromaticContact CE1-CZ 3.83Å; F117-F250 HydrophobicContact CE1-CZ 3.83Å; F117-F250 AromaticContact CG-CE1 3.78Å; F117-F250 HydrophobicContact CG-CE1 3.78Å; F117-F250 HydrophobicContact CG-CZ 4.18Å; F117-F250 HydrophobicContact CZ-CZ 4.5Å; F117-N273 PolarHBondContact O-ND2 3.15Å
118	H	98.7	Very high	97.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	131.1	170.3	-62.5	-85.8	0	0	0	108.2	G126 E128 M138 E139 H141 N273 F274	H118-G126 CarbonylContact C-O 3.54Å; H118-G126 VanDerWaalsContact C-O 3.31Å; H118-E128 HydrophobicContact CB-CG 4.17Å; H118-E128 IonicContact CD2-OE2 3.42Å; H118-E128 VanDerWaalsContact CE1-CD 3.45Å; H118-E128 IonicContact CE1-OE1 2.72Å; H118-E128 PolarHBondContact CE1-OE1 2.87Å; H118-E128 IonicContact CE1-OE2 3.47Å; H118-E128 PolarHBondContact CE1-OE2 2.76Å; H118-E128 IonicContact CG-OE2 2.66Å; H118-E128 IonicContact ND1-OE1 3.5Å; H118-E128 IonicContact ND1-OE2 3.66Å; H118-E128 IonicContact NE2-OE2 3.47Å; H118-E128 PolarHBondContact NE2-OE2 3.49Å; H118-M138 CarbonylContact O-C 3.57Å; H118-M138 WeakPolarHBondContact O-CA 3.42Å; H118-M138 WeakPolarHBondContact O-CB 3.45Å; H118-M138 VanDerWaalsContact O-CG 3.24Å; H118-M138 WeakPolarHBondContact O-CG 3.38Å; H118-E139 PolarHBondContact N-O 3.44Å; H118-E139 PolarHBondContact O-N 2.84Å; H118-H141 AromaticContact CD2-CE1 3.56Å; H118-H141 AromaticContact CD2-ND1 3.73Å; H118-H141 AromaticContact NE2-CE1 3.51Å; H118-H141 AromaticContact NE2-ND1 3.46Å; H118-H141 PolarHBondContact NE2-ND1 3.04Å; H118-N273 PolarHBondContact ND1-O 3.09Å; H118-F274 HydrophobicContact CB-CB 4.26Å
119	W	98.7	Very high	97.8	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	153.4	-179.5	65.1	92.3	0	0	0	112.4	I89 F117 G126 P137 M138 F250 L253 L270 D272 N273	I89-W119 HydrophobicContact CG1-CH2 4.14Å; F117-W119 HydrophobicContact CB-CE3 3.85Å; F117-W119 HydrophobicContact CB-CZ3 3.77Å; F117-W119 VanDerWaalsContact O-CZ3 3.26Å; F117-W119 WeakPolarHBondContact O-CZ3 3.34Å; W119-G126 PolarHBondContact N-O 3.34Å; W119-P137 WeakPolarHBondContact CA-O 3.45Å; W119-M138 HydrophobicContact CB-CB 4.1Å; W119-M138 HydrophobicContact CB-CE 3.88Å; W119-M138 HydrophobicContact CB-CG 4.38Å; W119-M138 HydrophobicContact CG-CE 4.46Å; W119-F250 HydrophobicContact CD2-CB 3.99Å; W119-F250 HydrophobicContact CD2-CD1 4.08Å; W119-F250 HydrophobicContact CD2-CG 4.41Å; W119-F250 AromaticContact CE3-CD1 3.83Å; W119-F250 HydrophobicContact CE3-CD1 3.83Å; W119-F250 HydrophobicContact CG-CB 4.13Å; W119-F250 HydrophobicContact CH2-CD1 4.06Å; W119-F250 HydrophobicContact CZ2-CB 4.3Å; W119-F250 HydrophobicContact CZ2-CD1 4.28Å; W119-F250 AromaticContact CZ3-CD1 3.84Å; W119-F250 HydrophobicContact CZ3-CD1 3.84Å; W119-F250 HydrophobicContact CZ3-CE1 4.39Å; W119-F250 PolarHBondContact NE1-O 2.88Å; W119-L253 HydrophobicContact CH2-CD1 3.76Å; W119-L253 HydrophobicContact CZ2-CB 4.42Å; W119-L253 HydrophobicContact CZ2-CD1 3.63Å; W119-L270 HydrophobicContact CH2-CD2 3.55Å; W119-L270 HydrophobicContact CH2-CG 3.85Å; W119-L270 HydrophobicContact CZ2-CB 4.26Å; W119-L270 HydrophobicContact CZ2-CD2 3.63Å; W119-L270 HydrophobicContact CZ2-CG 3.51Å; W119-L270 WeakPolarHBondContact CZ2-O 3.41Å; W119-L270 PolarHBondContact NE1-O 3.26Å; W119-D272 WeakPolarHBondContact O-CA 3.38Å; W119-D272 PolarHBondContact O-N 2.94Å; W119-N273 WeakPolarHBondContact CZ3-ND2 3.32Å; W119-N273 PolarHBondContact N-OD1 3.15Å; W119-N273 PolarHBondContact O-OD1 3.28Å; W119-N273 VanDerWaalsContact O-OD1 3.13Å
120	G	97.8	Very high	97.8	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	15%	0.147	C	C	.	.			trans	-98	162.1	175.8	0	0	0	0	0	111.9	E122 R125 P137 R251 D272	G120-E122 PolarHBondContact O-N 3.3Å; G120-R125 VanDerWaalsContact CA-O 3.28Å; G120-R125 WeakPolarHBondContact CA-O 3.24Å; G120-R125 PolarHBondContact N-O 2.84Å; G120-P137 PolarHBondContact N-O 2.89Å; G120-P137 VanDerWaalsContact N-O 3.12Å; G120-R251 PolarHBondContact O-NE 3.2Å; G120-R251 PolarHBondContact O-NH2 2.93Å; G120-D272 VanDerWaalsContact CA-OD1 3.26Å; G120-D272 WeakPolarHBondContact CA-OD1 3.45Å
121	R	96.9	Very high	97.8	Very high	100 Å²	100	34.6 Å²	34.6	38%	0.377	15%	0.154	S	C	.	.	S	Bend	trans	-68	-20.5	171.7	-65.1	178.3	177.8	-143.8	-9.3	112.5	R251 D267 I269 D272	R121-R251 PolarHBondContact O-NE 2.94Å; R121-D267 IonicContact CZ-OD1 3.89Å; R121-D267 IonicContact CZ-OD2 3.82Å; R121-D267 IonicContact NH1-OD1 2.79Å; R121-D267 IonicContact NH1-OD2 3.55Å; R121-D267 PolarHBondContact NH1-OD2 3.13Å; R121-D267 IonicContact NH2-OD1 3.83Å; R121-D267 PolarHBondContact NH2-OD1 2.92Å; R121-D267 IonicContact NH2-OD2 3.94Å; R121-D267 PolarHBondContact NH2-OD2 2.97Å; R121-I269 PolarHBondContact NH2-O 2.95Å; R121-D272 WeakPolarHBondContact CD-OD2 3.33Å; R121-D272 VanDerWaalsContact CG-OD2 3.3Å; R121-D272 WeakPolarHBondContact CG-OD2 3.47Å; R121-D272 PolarHBondContact N-OD1 3.03Å; R121-D272 IonicContact NE-OD2 3.33Å
122	E	96.7	Very high	97.8	Very high	117 Å²	117	36 Å²	36	55%	0.547	16%	0.163	S	C	.	.	S	Bend	trans	-124.5	165.2	-177	-62.4	179.6	-177.7	0	0	111.9	G120 Q124 R251	G120-E122 PolarHBondContact O-N 3.3Å; E122-Q124 VanDerWaalsContact C-N 3.25Å; E122-Q124 PolarHBondContact O-N 3.19Å; E122-R251 PolarHBondContact O-NH2 3.18Å
123	N	98	Very high	97.7	Very high	49 Å²	49	43.8 Å²	43.8	26%	0.262	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-9.4	-175.1	-72.3	-7.2	0	0	0	114	I172 Q244 R251	N123-I172 HydrophobicContact CB-CG1 4.19Å; N123-Q244 PolarHBondContact ND2-OE1 3Å; N123-Q244 PolarHBondContact OD1-NE2 3.19Å; N123-R251 PolarHBondContact OD1-NH1 3.39Å; N123-R251 PolarHBondContact OD1-NH2 3.1Å
124	Q	96.9	Very high	97.8	Very high	136 Å²	136	46.2 Å²	46.2	64%	0.636	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-9.4	-173.9	-67	72	33.2	0	0	113.5	E122	E122-Q124 VanDerWaalsContact C-N 3.25Å; E122-Q124 PolarHBondContact O-N 3.19Å
125	R	96.8	Very high	97.9	Very high	109 Å²	109	47.2 Å²	47.2	41%	0.411	22%	0.218	S	C	.	.			trans	-147.7	158	-175.9	58.8	178.8	-89.9	168.2	5.9	110.5	G120 F136 P137 D272 F274	G120-R125 VanDerWaalsContact CA-O 3.28Å; G120-R125 WeakPolarHBondContact CA-O 3.24Å; G120-R125 PolarHBondContact N-O 2.84Å; R125-F136 CarbonylContact C-O 3.56Å; R125-P137 WeakPolarHBondContact O-CA 3.38Å; R125-D272 IonicContact CZ-OD1 3.97Å; R125-D272 IonicContact CZ-OD2 3.08Å; R125-D272 IonicContact NE-OD1 3.68Å; R125-D272 PolarHBondContact NE-OD1 2.99Å; R125-D272 IonicContact NE-OD2 2.75Å; R125-D272 IonicContact NH2-OD1 3.65Å; R125-D272 PolarHBondContact NH2-OD1 3.27Å; R125-D272 IonicContact NH2-OD2 3.47Å; R125-D272 PolarHBondContact NH2-OD2 2.6Å; R125-F274 HydrophobicContact CB-CZ 4.35Å; R125-F274 VanDerWaalsContact NH2-CZ 3.32Å
126	G	98	Very high	97.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	22%	0.224	C	C	.	.			trans	146.7	-26.8	178.4	0	0	0	0	0	115.6	H118 W119 F136 P137	H118-G126 CarbonylContact C-O 3.54Å; H118-G126 VanDerWaalsContact C-O 3.31Å; W119-G126 PolarHBondContact N-O 3.34Å; G126-F136 CarbonylContact C-O 3.55Å; G126-F136 WeakPolarHBondContact CA-O 3.38Å; G126-F136 PolarHBondContact N-O 2.97Å; G126-P137 WeakPolarHBondContact CA-O 3.48Å
127	S	98.6	Very high	97.9	Very high	5 Å²	5	48 Å²	48	4%	0.035	22%	0.223	C	C	.	.			trans	-72.2	146.9	168.8	64.1	0	0	0	0	110.9	H129 F136 E139	S127-H129 WeakPolarHBondContact CB-O 3.19Å; S127-H129 PolarHBondContact OG-O 2.86Å; S127-F136 PolarHBondContact N-O 2.88Å; S127-F136 PolarHBondContact OG-N 2.98Å; S127-E139 WeakPolarHBondContact CB-OE2 3.19Å
128	E	98.6	Very high	97.9	Very high	3 Å²	3	48 Å²	48	1%	0.014	22%	0.223	C	C	.	.	S	Bend	trans	-77.3	-50.3	174.1	-84.8	-161.7	138.6	0	0	110.1	P51 H118 E139 H141 T223 F274 R275	P51-E128 VanDerWaalsContact CB-C 3.45Å; P51-E128 HydrophobicContact CB-CB 3.8Å; P51-E128 WeakPolarHBondContact CB-O 3.32Å; P51-E128 HydrophobicContact CG-CB 3.71Å; P51-E128 HydrophobicContact CG-CG 4.39Å; P51-E128 WeakPolarHBondContact CG-O 3.32Å; H118-E128 HydrophobicContact CB-CG 4.17Å; H118-E128 IonicContact CD2-OE2 3.42Å; H118-E128 VanDerWaalsContact CE1-CD 3.45Å; H118-E128 IonicContact CE1-OE1 2.72Å; H118-E128 PolarHBondContact CE1-OE1 2.87Å; H118-E128 IonicContact CE1-OE2 3.47Å; H118-E128 PolarHBondContact CE1-OE2 2.76Å; H118-E128 IonicContact CG-OE2 2.66Å; H118-E128 IonicContact ND1-OE1 3.5Å; H118-E128 IonicContact ND1-OE2 3.66Å; H118-E128 IonicContact NE2-OE2 3.47Å; H118-E128 PolarHBondContact NE2-OE2 3.49Å; E128-E139 PolarHBondContact N-OE2 2.82Å; E128-H141 IonicContact OE2-CE1 2.6Å; E128-H141 PolarHBondContact OE2-CE1 3.27Å; E128-H141 IonicContact OE2-NE2 3.68Å; E128-T223 WeakPolarHBondContact OE1-CB 3.35Å; E128-T223 PolarHBondContact OE1-OG1 2.96Å; E128-T223 WeakPolarHBondContact OE2-CB 3.23Å; E128-T223 VanDerWaalsContact OE2-CG2 3.26Å; E128-T223 WeakPolarHBondContact OE2-CG2 3.44Å; E128-T223 PolarHBondContact OE2-OG1 2.87Å; E128-F274 HydrophobicContact CG-CB 3.47Å; E128-F274 VanDerWaalsContact CG-CB 3.47Å; E128-R275 WeakPolarHBondContact OE1-CB 3.43Å; E128-R275 PolarHBondContact OE1-N 3.39Å
129	H	98.7	Very high	97.9	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.223	C	C	.	.	S	Bend	trans	-73.8	156.2	170.7	-67.8	92.7	0	0	0	111.3	I52 S127 E139 F169 Y218 W233 L235	I52-H129 PolarHBondContact N-CD2 2.85Å; I52-H129 PolarHBondContact O-CD2 3.43Å; S127-H129 WeakPolarHBondContact CB-O 3.19Å; S127-H129 PolarHBondContact OG-O 2.86Å; H129-E139 WeakPolarHBondContact CB-OE2 3.43Å; H129-E139 IonicContact CE1-OE1 2.77Å; H129-E139 IonicContact CG-OE1 3.83Å; H129-E139 IonicContact CG-OE2 3.74Å; H129-E139 PolarHBondContact N-OE2 2.76Å; H129-E139 IonicContact ND1-OE1 3.93Å; H129-E139 PolarHBondContact ND1-OE1 3.02Å; H129-E139 IonicContact ND1-OE2 2.75Å; H129-F169 HydrophobicContact CB-CE1 3.68Å; H129-F169 HydrophobicContact CB-CZ 3.58Å; H129-F169 WeakPolarHBondContact O-CE1 3.46Å; H129-Y218 AromaticContact NE2-CE1 3.65Å; H129-Y218 AromaticContact NE2-CZ 3.63Å; H129-Y218 PolarHBondContact NE2-OH 2.86Å; H129-W233 AromaticContact CE1-CE3 3.62Å; H129-W233 AromaticContact CE1-CZ3 3.67Å; H129-L235 HydrophobicContact CB-CD2 3.96Å
130	T	98.5	Very high	97.9	Very high	18 Å²	18	48 Å²	48	11%	0.11	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	154.5	168.1	59.1	0	0	0	0	109.6	I52 N53 L54 K134 A135 T277	I52-T130 PolarHBondContact O-N 3.07Å; N53-T130 WeakPolarHBondContact CA-OG1 3.16Å; N53-T130 WeakPolarHBondContact CB-OG1 3.31Å; N53-T130 PolarHBondContact OD1-OG1 2.59Å; N53-T130 VanDerWaalsContact OD1-OG1 3.08Å; L54-T130 WeakPolarHBondContact CB-O 3.4Å; L54-T130 PolarHBondContact N-O 2.89Å; T130-K134 WeakPolarHBondContact CA-O 3.39Å; T130-K134 WeakPolarHBondContact CB-O 3.26Å; T130-A135 HydrophobicContact CG2-CB 3.98Å; T130-T277 HydrophobicContact CG2-CG2 4.25Å
131	V	97.8	Very high	97.9	Very high	24 Å²	24	48.1 Å²	48.1	15%	0.145	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	117.1	173.7	-178.1	0	0	0	0	108.3	L54 F133 K134 F169 W216	L54-V131 HydrophobicContact CB-CG2 4.47Å; L54-V131 HydrophobicContact CD2-CG1 4.23Å; L54-V131 CarbonylContact O-C 3.52Å; L54-V131 WeakPolarHBondContact O-CA 3.37Å; V131-F133 PolarHBondContact O-N 3.18Å; V131-K134 PolarHBondContact N-O 3.45Å; V131-K134 WeakPolarHBondContact O-CB 3.24Å; V131-K134 PolarHBondContact O-N 3.36Å; V131-F169 HydrophobicContact CG2-CD2 4.4Å; V131-F169 HydrophobicContact CG2-CE2 3.45Å; V131-F169 VanDerWaalsContact CG2-CE2 3.45Å; V131-F169 HydrophobicContact CG2-CZ 3.73Å; V131-W216 HydrophobicContact CG1-CH2 4.33Å; V131-W216 HydrophobicContact CG2-CZ3 4.41Å
132	N	97.1	Very high	98	Very high	77 Å²	77	43.3 Å²	43.3	41%	0.412	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	45.5	-172.4	-48.1	-46	0	0	0	111.8	N53 L54 S56 K134	N53-N132 PolarHBondContact OD1-N 2.74Å; L54-N132 PolarHBondContact O-N 2.75Å; S56-N132 PolarHBondContact N-OD1 2.7Å; S56-N132 VanDerWaalsContact OG-CG 3.31Å; S56-N132 PolarHBondContact OG-ND2 3Å; S56-N132 PolarHBondContact OG-OD1 3.03Å; N132-K134 PolarHBondContact O-N 2.93Å
133	F	96.9	Very high	98.1	Very high	166 Å²	166	38.4 Å²	38.4	73%	0.728	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.8	12.8	-177.2	-55.1	-77	0	0	0	115.4	N53 V131	N53-F133 HydrophobicContact CB-CD1 4.14Å; N53-F133 HydrophobicContact CB-CE1 4.01Å; N53-F133 VanDerWaalsContact ND2-CE1 3.26Å; N53-F133 WeakPolarHBondContact ND2-CE1 3.31Å; N53-F133 WeakPolarHBondContact ND2-CZ 3.11Å; N53-F133 WeakPolarHBondContact OD1-CA 3.44Å; N53-F133 PolarHBondContact OD1-N 2.74Å; V131-F133 PolarHBondContact O-N 3.18Å
134	K	97.7	Very high	98.1	Very high	143 Å²	143	36 Å²	36	62%	0.622	17%	0.17	S	C	*	.	B	Isolated β-bridge	trans	-96.1	121.7	173.2	-174.2	177.2	173.1	-176.8	0	110	T130 V131 N132	T130-K134 WeakPolarHBondContact CA-O 3.39Å; T130-K134 WeakPolarHBondContact CB-O 3.26Å; V131-K134 PolarHBondContact N-O 3.45Å; V131-K134 WeakPolarHBondContact O-CB 3.24Å; V131-K134 PolarHBondContact O-N 3.36Å; N132-K134 PolarHBondContact O-N 2.93Å
135	A	98.2	Very high	98.2	Very high	26 Å²	26	31 Å²	31	22%	0.215	15%	0.145	C	C	.	.			trans	-86.1	165.4	171.5	0	0	0	0	0	111.8	T130	T130-A135 HydrophobicContact CG2-CB 3.98Å
136	F	98.5	Very high	98.3	Very high	29 Å²	29	25.8 Å²	25.8	13%	0.127	13%	0.126	C	C	.	.			trans	-116.5	158.1	172.9	-72.5	-95.5	0	0	0	109.4	R125 G126 S127 M138 F169 V170 Q171 P239	R125-F136 CarbonylContact C-O 3.56Å; G126-F136 CarbonylContact C-O 3.55Å; G126-F136 WeakPolarHBondContact CA-O 3.38Å; G126-F136 PolarHBondContact N-O 2.97Å; S127-F136 PolarHBondContact N-O 2.88Å; S127-F136 PolarHBondContact OG-N 2.98Å; F136-M138 PolarHBondContact O-N 3.18Å; F136-F169 HydrophobicContact CB-CB 4.27Å; F136-F169 HydrophobicContact CB-CD1 4.08Å; F136-F169 HydrophobicContact CD1-CB 3.96Å; F136-F169 HydrophobicContact CD2-CB 3.8Å; F136-F169 AromaticContact CD2-CD1 3.34Å; F136-F169 HydrophobicContact CD2-CD1 3.34Å; F136-F169 HydrophobicContact CD2-CD2 4.14Å; F136-F169 AromaticContact CD2-CE1 3.9Å; F136-F169 HydrophobicContact CD2-CE1 3.9Å; F136-F169 AromaticContact CD2-CG 3.48Å; F136-F169 HydrophobicContact CD2-CG 3.48Å; F136-F169 VanDerWaalsContact CD2-CG 3.48Å; F136-F169 HydrophobicContact CD2-CZ 4.49Å; F136-F169 HydrophobicContact CE1-CB 4.21Å; F136-F169 HydrophobicContact CE2-CB 4.05Å; F136-F169 AromaticContact CE2-CD1 3.95Å; F136-F169 HydrophobicContact CE2-CD1 3.95Å; F136-F169 AromaticContact CE2-CD2 3.88Å; F136-F169 HydrophobicContact CE2-CD2 3.88Å; F136-F169 HydrophobicContact CE2-CE1 4.37Å; F136-F169 HydrophobicContact CE2-CE2 4.32Å; F136-F169 AromaticContact CE2-CG 3.68Å; F136-F169 HydrophobicContact CE2-CG 3.68Å; F136-F169 HydrophobicContact CG-CB 3.74Å; F136-F169 AromaticContact CG-CD1 3.88Å; F136-F169 HydrophobicContact CG-CD1 3.88Å; F136-F169 AromaticContact CG-CG 3.94Å; F136-F169 HydrophobicContact CG-CG 3.94Å; F136-F169 HydrophobicContact CZ-CB 4.25Å; F136-F169 HydrophobicContact CZ-CD2 4.44Å; F136-F169 HydrophobicContact CZ-CG 4.3Å; F136-V170 WeakPolarHBondContact CB-O 3.11Å; F136-Q171 HydrophobicContact CD1-CB 4.16Å; F136-Q171 HydrophobicContact CE1-CB 4.46Å; F136-P239 HydrophobicContact CD1-CB 4.34Å; F136-P239 HydrophobicContact CE1-CB 3.94Å; F136-P239 HydrophobicContact CE1-CG 4.05Å
137	P	98.6	Very high	98.3	Very high	7 Å²	7	27.1 Å²	27.1	5%	0.045	14%	0.135	C	C	.	.	S	Bend	trans	-64	-22.4	179.5	24.3	-36.1	0	0	0	114.5	W119 G120 R125 G126 V170 I172 I247	W119-P137 WeakPolarHBondContact CA-O 3.45Å; G120-P137 PolarHBondContact N-O 2.89Å; G120-P137 VanDerWaalsContact N-O 3.12Å; R125-P137 WeakPolarHBondContact O-CA 3.38Å; G126-P137 WeakPolarHBondContact CA-O 3.48Å; P137-V170 WeakPolarHBondContact CD-O 3.31Å; P137-V170 WeakPolarHBondContact CG-O 3.3Å; P137-I172 HydrophobicContact CB-CD1 4.37Å; P137-I172 HydrophobicContact CG-CD1 4.16Å; P137-I172 HydrophobicContact CG-CG1 4.18Å; P137-I247 HydrophobicContact CB-CD1 3.72Å; P137-I247 HydrophobicContact CG-CD1 4.5Å
138	M	98.8	Very high	98.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	153.5	180	166.4	-172.1	-70.9	0	0	110.9	F117 H118 W119 F136 V170 I242 I247 F250	F117-M138 HydrophobicContact CD1-SD 4.23Å; H118-M138 CarbonylContact O-C 3.57Å; H118-M138 WeakPolarHBondContact O-CA 3.42Å; H118-M138 WeakPolarHBondContact O-CB 3.45Å; H118-M138 VanDerWaalsContact O-CG 3.24Å; H118-M138 WeakPolarHBondContact O-CG 3.38Å; W119-M138 HydrophobicContact CB-CB 4.1Å; W119-M138 HydrophobicContact CB-CE 3.88Å; W119-M138 HydrophobicContact CB-CG 4.38Å; W119-M138 HydrophobicContact CG-CE 4.46Å; F136-M138 PolarHBondContact O-N 3.18Å; M138-V170 HydrophobicContact CB-CB 3.93Å; M138-V170 HydrophobicContact CB-CG2 4.17Å; M138-V170 HydrophobicContact CG-CB 4.11Å; M138-V170 HydrophobicContact CG-CG2 3.8Å; M138-V170 PolarHBondContact O-N 3.42Å; M138-V170 HydrophobicContact SD-CB 4.34Å; M138-V170 HydrophobicContact SD-CG1 4.39Å; M138-V170 HydrophobicContact SD-CG2 4Å; M138-I242 HydrophobicContact CE-CD1 4.4Å; M138-I242 HydrophobicContact SD-CD1 4.16Å; M138-I247 HydrophobicContact CB-CD1 4.29Å; M138-I247 HydrophobicContact CE-CD1 4.35Å; M138-I247 HydrophobicContact CE-CG1 4.1Å; M138-F250 HydrophobicContact CE-CB 4.28Å; M138-F250 HydrophobicContact CE-CD1 4.04Å; M138-F250 HydrophobicContact CE-CD2 3.54Å; M138-F250 HydrophobicContact CE-CE1 4.22Å; M138-F250 HydrophobicContact CE-CE2 3.73Å; M138-F250 HydrophobicContact CE-CG 3.7Å; M138-F250 HydrophobicContact CE-CZ 4.07Å
139	E	98.8	Very high	98.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	137.2	170.2	-174.6	174.2	146	0	0	109.6	H118 S127 E128 H129 H141 A167 L168	H118-E139 PolarHBondContact N-O 3.44Å; H118-E139 PolarHBondContact O-N 2.84Å; S127-E139 WeakPolarHBondContact CB-OE2 3.19Å; E128-E139 PolarHBondContact N-OE2 2.82Å; H129-E139 WeakPolarHBondContact CB-OE2 3.43Å; H129-E139 IonicContact CE1-OE1 2.77Å; H129-E139 IonicContact CG-OE1 3.83Å; H129-E139 IonicContact CG-OE2 3.74Å; H129-E139 PolarHBondContact N-OE2 2.76Å; H129-E139 IonicContact ND1-OE1 3.93Å; H129-E139 PolarHBondContact ND1-OE1 3.02Å; H129-E139 IonicContact ND1-OE2 2.75Å; E139-H141 IonicContact OE1-CD2 3.98Å; E139-H141 PolarHBondContact OE1-CD2 3.38Å; E139-H141 IonicContact OE1-CE1 3.68Å; E139-H141 IonicContact OE1-NE2 3.06Å; E139-H141 PolarHBondContact OE1-NE2 3.33Å; E139-A167 HydrophobicContact CG-CB 4.46Å; E139-A167 WeakPolarHBondContact OE1-CB 3.17Å; E139-L168 CarbonylContact C-O 3.56Å; E139-L168 VanDerWaalsContact CA-O 3.31Å; E139-L168 WeakPolarHBondContact CA-O 3.35Å
140	L	98.4	Very high	98.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	142.5	171.1	-48	91.5	0	0	0	109.9	V115 R116 F117 A167 L168 V170 L179 L206 L240	V115-L140 HydrophobicContact CG1-CD2 4.4Å; R116-L140 CarbonylContact O-C 3.49Å; R116-L140 WeakPolarHBondContact O-CA 3.49Å; F117-L140 HydrophobicContact CD1-CD2 3.82Å; F117-L140 HydrophobicContact CD1-CG 3.95Å; F117-L140 HydrophobicContact CE1-CD2 3.32Å; F117-L140 HydrophobicContact CE1-CG 3.98Å; F117-L140 HydrophobicContact CZ-CD2 3.99Å; L140-A167 WeakPolarHBondContact O-CA 3.46Å; L140-L168 HydrophobicContact CB-CB 4.49Å; L140-L168 HydrophobicContact CB-CD1 4.48Å; L140-L168 HydrophobicContact CD1-CB 4.02Å; L140-L168 PolarHBondContact N-O 2.65Å; L140-L168 PolarHBondContact O-N 3.46Å; L140-V170 HydrophobicContact CD1-CG2 3.08Å; L140-V170 HydrophobicContact CG-CG2 4.21Å; L140-L179 HydrophobicContact CD2-CD1 4.49Å; L140-L179 HydrophobicContact CD2-CD2 4.12Å; L140-L206 HydrophobicContact CD2-CD1 4.07Å; L140-L206 HydrophobicContact CD2-CD2 4.01Å; L140-L240 HydrophobicContact CD1-CD1 3.82Å
141	H	98.7	Very high	98.1	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	125.8	170.3	-64.5	171.5	0	0	0	109.9	V115 R116 H118 E128 E139 I143 I165 I166 W233	V115-H141 CarbonylContact C-O 3.58Å; V115-H141 VanDerWaalsContact CA-O 3.31Å; V115-H141 WeakPolarHBondContact CA-O 3.38Å; R116-H141 HydrophobicContact CB-CB 4.32Å; R116-H141 PolarHBondContact N-O 3.34Å; R116-H141 PolarHBondContact O-N 3.08Å; H118-H141 AromaticContact CD2-CE1 3.56Å; H118-H141 AromaticContact CD2-ND1 3.73Å; H118-H141 AromaticContact NE2-CE1 3.51Å; H118-H141 AromaticContact NE2-ND1 3.46Å; H118-H141 PolarHBondContact NE2-ND1 3.04Å; E128-H141 IonicContact OE2-CE1 2.6Å; E128-H141 PolarHBondContact OE2-CE1 3.27Å; E128-H141 IonicContact OE2-NE2 3.68Å; E139-H141 IonicContact OE1-CD2 3.98Å; E139-H141 PolarHBondContact OE1-CD2 3.38Å; E139-H141 IonicContact OE1-CE1 3.68Å; E139-H141 IonicContact OE1-NE2 3.06Å; E139-H141 PolarHBondContact OE1-NE2 3.33Å; H141-I143 HydrophobicContact CB-CG1 4.15Å; H141-I165 HydrophobicContact CB-CG2 3.74Å; H141-I166 CarbonylContact C-O 3.58Å; H141-I166 WeakPolarHBondContact CA-O 3.42Å; H141-W233 AromaticContact CD2-CZ3 3.82Å; H141-W233 AromaticContact CE1-CH2 3.38Å; H141-W233 WeakPolarHBondContact CE1-CH2 3.41Å; H141-W233 AromaticContact CE1-CZ3 3.83Å; H141-W233 AromaticContact ND1-CH2 3.69Å; H141-W233 AromaticContact NE2-CH2 3.65Å; H141-W233 AromaticContact NE2-CZ3 3.59Å
142	L	98.5	Very high	98.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	105.7	165.3	-74.7	62.2	0	0	0	106.1	Y74 L112 V115 H144 I165 I166 L168 L206 L207	Y74-L142 HydrophobicContact CE2-CD2 3.63Å; L112-L142 HydrophobicContact CD1-CB 3.77Å; L112-L142 HydrophobicContact CD1-CG 4.3Å; V115-L142 HydrophobicContact CG1-CD1 4.16Å; V115-L142 HydrophobicContact CG2-CD1 4.49Å; V115-L142 HydrophobicContact CG2-CG 4.1Å; L142-H144 PolarHBondContact O-CE1 3.14Å; L142-H144 PolarHBondContact O-ND1 3.35Å; L142-I165 WeakPolarHBondContact O-CA 3.36Å; L142-I166 HydrophobicContact CB-CB 4.2Å; L142-I166 PolarHBondContact N-O 2.83Å; L142-I166 PolarHBondContact O-N 2.77Å; L142-L168 HydrophobicContact CD1-CD1 3.43Å; L142-L168 VanDerWaalsContact CD1-CD1 3.43Å; L142-L206 HydrophobicContact CD1-CD1 4.01Å; L142-L207 HydrophobicContact CD2-CD2 4.35Å
143	I	98.3	Very high	98	Very high	13 Å²	13	36.4 Å²	36.4	7%	0.067	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	122.2	-173.5	-54.7	-175.7	0	0	0	108.8	L112 Y113 E114 R116 H141 I153 I163 I165	L112-I143 WeakPolarHBondContact CD1-O 3.4Å; Y113-I143 PolarHBondContact N-O 3.24Å; E114-I143 HydrophobicContact CG-CB 4.05Å; E114-I143 HydrophobicContact CG-CD1 3.9Å; E114-I143 HydrophobicContact CG-CG1 4.14Å; E114-I143 PolarHBondContact O-N 3.49Å; E114-I143 WeakPolarHBondContact OE1-CD1 3.43Å; R116-I143 HydrophobicContact CB-CD1 4.46Å; H141-I143 HydrophobicContact CB-CG1 4.15Å; I143-I153 HydrophobicContact CG2-CD1 4.28Å; I143-I163 HydrophobicContact CG2-CG2 4.36Å; I143-I165 HydrophobicContact CG1-CD1 4.2Å; I143-I165 HydrophobicContact CG1-CG1 4.29Å; I143-I165 HydrophobicContact CG1-CG2 4.41Å; I143-I165 HydrophobicContact CG2-CD1 4.42Å; I143-I165 HydrophobicContact CG2-CG1 4.27Å
144	H	98.5	Very high	97.9	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	151	178.6	-45.2	71.6	0	0	0	110.8	Y74 F110 E111 L142 I163 A164	Y74-H144 AromaticContact CE1-NE2 3.46Å; Y74-H144 WeakPolarHBondContact CE1-NE2 3.5Å; Y74-H144 AromaticContact CZ-NE2 3.43Å; Y74-H144 PolarHBondContact OH-CE1 3.23Å; Y74-H144 PolarHBondContact OH-NE2 3.19Å; F110-H144 HydrophobicContact CB-CB 3.75Å; E111-H144 CarbonylContact O-C 3.59Å; E111-H144 WeakPolarHBondContact O-CA 3.28Å; E111-H144 WeakPolarHBondContact O-CB 3.21Å; L142-H144 PolarHBondContact O-CE1 3.14Å; L142-H144 PolarHBondContact O-ND1 3.35Å; H144-I163 WeakPolarHBondContact O-CA 3.21Å; H144-A164 WeakPolarHBondContact CA-O 3.3Å; H144-A164 WeakPolarHBondContact CB-O 3.3Å; H144-A164 PolarHBondContact N-O 2.7Å; H144-A164 PolarHBondContact ND1-O 2.66Å; H144-A164 VanDerWaalsContact ND1-O 3.16Å; H144-A164 PolarHBondContact O-N 2.75Å
145	W	98.1	Very high	97.9	Very high	30 Å²	30	33.3 Å²	33.3	11%	0.114	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	150.1	175.3	68.7	-77.3	0	0	0	110.6	F110 E111 S147 F150 S152 I153 A156 G162 I163	F110-W145 CarbonylContact C-O 3.51Å; F110-W145 WeakPolarHBondContact CA-O 3.44Å; E111-W145 HydrophobicContact CB-CZ2 4.48Å; E111-W145 PolarHBondContact N-O 2.89Å; E111-W145 PolarHBondContact O-N 3.13Å; W145-S147 PolarHBondContact O-N 3Å; W145-F150 HydrophobicContact CE3-CB 4.22Å; W145-F150 HydrophobicContact CZ3-CB 4.08Å; W145-F150 WeakPolarHBondContact CZ3-O 3.26Å; W145-S152 VanDerWaalsContact CE3-C 3.48Å; W145-I153 HydrophobicContact CB-CB 4.12Å; W145-I153 HydrophobicContact CB-CG1 4.01Å; W145-I153 HydrophobicContact CG-CB 4.03Å; W145-I153 HydrophobicContact CG-CG1 4.41Å; W145-A156 HydrophobicContact CB-CB 4.19Å; W145-A156 HydrophobicContact CE3-CB 4.5Å; W145-G162 CarbonylContact C-O 3.57Å; W145-G162 VanDerWaalsContact CA-O 3.31Å; W145-G162 WeakPolarHBondContact CA-O 3.29Å; W145-I163 HydrophobicContact CB-CD1 3.86Å
146	N	98.5	Very high	97.9	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	83.2	-173.4	-164.5	-24	0	0	0	112.2	H108 F110 T148 L149 F150 H161 G162	H108-N146 PolarHBondContact ND1-ND2 3.15Å; H108-N146 PolarHBondContact ND1-OD1 2.97Å; F110-N146 HydrophobicContact CD1-CB 3.97Å; F110-N146 HydrophobicContact CE1-CB 3.63Å; F110-N146 HydrophobicContact CE2-CB 4.31Å; F110-N146 HydrophobicContact CG-CB 4.48Å; F110-N146 HydrophobicContact CZ-CB 3.82Å; F110-N146 WeakPolarHBondContact CZ-ND2 3.47Å; N146-T148 PolarHBondContact O-N 2.83Å; N146-T148 WeakPolarHBondContact OD1-CB 3.42Å; N146-T148 PolarHBondContact OD1-N 2.92Å; N146-L149 PolarHBondContact O-N 3.34Å; N146-F150 HydrophobicContact CB-CD2 4.01Å; N146-F150 HydrophobicContact CB-CE2 4.22Å; N146-F150 PolarHBondContact O-N 3.02Å; N146-H161 WeakPolarHBondContact CB-O 3.35Å; N146-H161 PolarHBondContact ND2-O 2.92Å; N146-G162 PolarHBondContact N-O 2.75Å
147	S	98	Very high	97.8	Very high	28 Å²	28	32.6 Å²	32.6	20%	0.196	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-12	178.1	66.6	0	0	0	0	114.9	E109 W145	E109-S147 PolarHBondContact O-N 2.87Å; E109-S147 VanDerWaalsContact O-N 3.1Å; E109-S147 PolarHBondContact O-OG 3.5Å; W145-S147 PolarHBondContact O-N 3Å
148	T	98.3	Very high	97.6	Very high	69 Å²	69	34.3 Å²	34.3	42%	0.423	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-28.6	173.2	-56	0	0	0	0	112.4	E109 N146	E109-T148 PolarHBondContact N-OG1 3.19Å; N146-T148 PolarHBondContact O-N 2.83Å; N146-T148 WeakPolarHBondContact OD1-CB 3.42Å; N146-T148 PolarHBondContact OD1-N 2.92Å
149	L	97.9	Very high	97.5	Very high	93 Å²	93	39.4 Å²	39.4	49%	0.487	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-32.3	-174.7	-69.8	-174.6	0	0	0	114	N146	N146-L149 PolarHBondContact O-N 3.34Å
150	F	98.1	Very high	97.2	Very high	43 Å²	43	44.2 Å²	44.2	19%	0.189	26%	0.261	C	S	.	.			trans	-117.5	161.6	-171.1	-55.7	-73.7	0	0	0	110.8	W145 N146 E155 A156 K159	W145-F150 HydrophobicContact CE3-CB 4.22Å; W145-F150 HydrophobicContact CZ3-CB 4.08Å; W145-F150 WeakPolarHBondContact CZ3-O 3.26Å; N146-F150 HydrophobicContact CB-CD2 4.01Å; N146-F150 HydrophobicContact CB-CE2 4.22Å; N146-F150 PolarHBondContact O-N 3.02Å; F150-E155 HydrophobicContact CB-CB 4.14Å; F150-E155 HydrophobicContact CD1-CB 4.22Å; F150-A156 HydrophobicContact CB-CB 4.01Å; F150-A156 HydrophobicContact CD2-CB 3.52Å; F150-A156 HydrophobicContact CE2-CB 4.17Å; F150-A156 HydrophobicContact CG-CB 3.74Å; F150-K159 HydrophobicContact CE1-CB 3.89Å; F150-K159 HydrophobicContact CE1-CG 3.77Å; F150-K159 HydrophobicContact CE2-CB 4.29Å; F150-K159 HydrophobicContact CZ-CB 3.49Å; F150-K159 VanDerWaalsContact CZ-CB 3.49Å; F150-K159 HydrophobicContact CZ-CG 3.93Å
151	G	97.3	Very high	97.1	Very high	60 Å²	60	48.5 Å²	48.5	62%	0.619	28%	0.281	S	S	*	.	S	Bend	trans	-88.9	-22.7	174	0	0	0	0	0	113.8	E155	G151-E155 PolarHBondContact N-OE2 3.33Å
152	S	96.6	Very high	97.1	Very high	37 Å²	37	48.5 Å²	48.5	26%	0.259	28%	0.281	S	S	.	.	S	Bend	trans	-149.6	168.9	-179.5	69.6	0	0	0	0	111.9	W145 D154 E155 A156	W145-S152 VanDerWaalsContact CE3-C 3.48Å; S152-D154 VanDerWaalsContact C-N 3.32Å; S152-D154 PolarHBondContact OG-N 3.3Å; S152-E155 PolarHBondContact OG-N 2.97Å; S152-A156 PolarHBondContact O-N 2.9Å
153	I	95.4	Very high	97.1	Very high	20 Å²	20	48.7 Å²	48.7	10%	0.103	28%	0.282	C	S	.	.	H	α-helix	trans	-62.7	-39.8	171.1	-172.6	165.4	0	0	0	111.6	Y113 I143 W145 E155 A156 V157 I163	Y113-I153 HydrophobicContact CD1-CD1 3.37Å; Y113-I153 HydrophobicContact CD2-CB 4.43Å; Y113-I153 HydrophobicContact CD2-CD1 4.26Å; Y113-I153 HydrophobicContact CD2-CG2 4.09Å; Y113-I153 HydrophobicContact CE1-CD1 3.89Å; Y113-I153 HydrophobicContact CE1-CG2 4.44Å; Y113-I153 HydrophobicContact CE2-CG2 3.84Å; Y113-I153 HydrophobicContact CG-CD1 3.6Å; Y113-I153 HydrophobicContact CG-CG2 4.5Å; I143-I153 HydrophobicContact CG2-CD1 4.28Å; W145-I153 HydrophobicContact CB-CB 4.12Å; W145-I153 HydrophobicContact CB-CG1 4.01Å; W145-I153 HydrophobicContact CG-CB 4.03Å; W145-I153 HydrophobicContact CG-CG1 4.41Å; I153-E155 VanDerWaalsContact C-N 3.28Å; I153-E155 PolarHBondContact O-N 2.86Å; I153-A156 WeakPolarHBondContact O-CA 3.42Å; I153-A156 WeakPolarHBondContact O-CB 3.4Å; I153-A156 PolarHBondContact O-N 2.85Å; I153-V157 HydrophobicContact CG1-CG2 4.26Å; I153-V157 WeakPolarHBondContact O-CG2 3.44Å; I153-V157 PolarHBondContact O-N 2.9Å; I153-I163 HydrophobicContact CD1-CD1 4.43Å; I153-I163 HydrophobicContact CG1-CD1 3.93Å
154	D	95.7	Very high	97.1	Very high	133 Å²	133	48 Å²	48	71%	0.711	28%	0.279	S	S	*	.	H	α-helix	trans	-62.5	-36.2	-178.3	-56.9	-40.2	0	0	0	112.1	S152 A156	S152-D154 VanDerWaalsContact C-N 3.32Å; S152-D154 PolarHBondContact OG-N 3.3Å; D154-A156 VanDerWaalsContact C-N 3.31Å
155	E	97.1	Very high	97.1	Very high	110 Å²	110	48.1 Å²	48.1	51%	0.514	28%	0.279	S	S	.	.	H	α-helix	trans	-69.3	-29.6	173.4	-73.3	-177.9	179.6	0	0	113	F150 G151 S152 I153 K159	F150-E155 HydrophobicContact CB-CB 4.14Å; F150-E155 HydrophobicContact CD1-CB 4.22Å; G151-E155 PolarHBondContact N-OE2 3.33Å; S152-E155 PolarHBondContact OG-N 2.97Å; I153-E155 VanDerWaalsContact C-N 3.28Å; I153-E155 PolarHBondContact O-N 2.86Å; E155-K159 WeakPolarHBondContact O-CG 3.37Å
156	A	97.6	Very high	97.2	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-83.6	-29.7	-175.5	0	0	0	0	0	113.1	W145 F150 S152 I153 D154 G158 K159 G162 I163	W145-A156 HydrophobicContact CB-CB 4.19Å; W145-A156 HydrophobicContact CE3-CB 4.5Å; F150-A156 HydrophobicContact CB-CB 4.01Å; F150-A156 HydrophobicContact CD2-CB 3.52Å; F150-A156 HydrophobicContact CE2-CB 4.17Å; F150-A156 HydrophobicContact CG-CB 3.74Å; S152-A156 PolarHBondContact O-N 2.9Å; I153-A156 WeakPolarHBondContact O-CA 3.42Å; I153-A156 WeakPolarHBondContact O-CB 3.4Å; I153-A156 PolarHBondContact O-N 2.85Å; D154-A156 VanDerWaalsContact C-N 3.31Å; A156-G158 PolarHBondContact O-N 2.83Å; A156-K159 WeakPolarHBondContact O-CB 3.32Å; A156-K159 PolarHBondContact O-N 2.91Å; A156-G162 WeakPolarHBondContact O-CA 3.39Å; A156-I163 HydrophobicContact CB-CD1 4.02Å
157	V	96.4	Very high	97.2	Very high	41 Å²	41	46.9 Å²	46.9	25%	0.248	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	133.1	179.4	170.7	0	0	0	0	110.8	I153 K159 I163 L222	I153-V157 HydrophobicContact CG1-CG2 4.26Å; I153-V157 WeakPolarHBondContact O-CG2 3.44Å; I153-V157 PolarHBondContact O-N 2.9Å; V157-K159 PolarHBondContact O-N 2.92Å; V157-I163 HydrophobicContact CG2-CD1 4.04Å; V157-I163 HydrophobicContact CG2-CG1 4.23Å; V157-L222 HydrophobicContact CG1-CD1 3.91Å; V157-L222 HydrophobicContact CG2-CD1 4.4Å
158	G	93.9	Very high	97.2	Very high	42 Å²	42	45.6 Å²	45.6	43%	0.433	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	72	4.2	-178	0	0	0	0	0	114.9	A156	A156-G158 PolarHBondContact O-N 2.83Å
159	K	96.3	Very high	97.2	Very high	108 Å²	108	42.4 Å²	42.4	47%	0.47	25%	0.246	S	C	.	.	S	Bend	trans	-97.1	145.4	176.1	-54.4	-56.4	-177.7	-170.9	0	111.4	F150 E155 A156 V157 H161 G162	F150-K159 HydrophobicContact CE1-CB 3.89Å; F150-K159 HydrophobicContact CE1-CG 3.77Å; F150-K159 HydrophobicContact CE2-CB 4.29Å; F150-K159 HydrophobicContact CZ-CB 3.49Å; F150-K159 VanDerWaalsContact CZ-CB 3.49Å; F150-K159 HydrophobicContact CZ-CG 3.93Å; E155-K159 WeakPolarHBondContact O-CG 3.37Å; A156-K159 WeakPolarHBondContact O-CB 3.32Å; A156-K159 PolarHBondContact O-N 2.91Å; V157-K159 PolarHBondContact O-N 2.92Å; K159-H161 PolarHBondContact O-N 3.03Å; K159-G162 PolarHBondContact O-N 3.47Å
160	P	94.5	Very high	97.2	Very high	100 Å²	100	38 Å²	38	65%	0.649	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.3	130.1	171.5	-25.2	34.2	0	0	0	111.5	G162	P160-G162 PolarHBondContact O-N 2.85Å; P160-G162 VanDerWaalsContact O-N 3.15Å
161	H	95.7	Very high	97.2	Very high	91 Å²	91	39.9 Å²	39.9	42%	0.421	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	21.8	-176	-48.8	-59	0	0	0	114.3	P105 F110 N146 K159	P105-H161 HydrophobicContact CG-CB 4.02Å; F110-H161 WeakPolarHBondContact CE1-O 3.45Å; F110-H161 WeakPolarHBondContact CZ-O 3.44Å; N146-H161 WeakPolarHBondContact CB-O 3.35Å; N146-H161 PolarHBondContact ND2-O 2.92Å; K159-H161 PolarHBondContact O-N 3.03Å
162	G	97.9	Very high	97.3	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.218	C	C	.	.			trans	-76.3	-41.8	-179.6	0	0	0	0	0	112.9	W145 N146 A156 K159 P160	W145-G162 CarbonylContact C-O 3.57Å; W145-G162 VanDerWaalsContact CA-O 3.31Å; W145-G162 WeakPolarHBondContact CA-O 3.29Å; N146-G162 PolarHBondContact N-O 2.75Å; A156-G162 WeakPolarHBondContact O-CA 3.39Å; K159-G162 PolarHBondContact O-N 3.47Å; P160-G162 PolarHBondContact O-N 2.85Å; P160-G162 VanDerWaalsContact O-N 3.15Å
163	I	98.6	Very high	97.3	Very high	4 Å²	4	40.1 Å²	40.1	2%	0.021	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	137.8	-172.1	-56.7	-62.6	0	0	0	110.6	I143 H144 W145 I153 A156 V157 I165 L222 V231 T232	I143-I163 HydrophobicContact CG2-CG2 4.36Å; H144-I163 WeakPolarHBondContact O-CA 3.21Å; W145-I163 HydrophobicContact CB-CD1 3.86Å; I153-I163 HydrophobicContact CD1-CD1 4.43Å; I153-I163 HydrophobicContact CG1-CD1 3.93Å; A156-I163 HydrophobicContact CB-CD1 4.02Å; V157-I163 HydrophobicContact CG2-CD1 4.04Å; V157-I163 HydrophobicContact CG2-CG1 4.23Å; I163-I165 HydrophobicContact CG2-CD1 4.22Å; I163-I165 HydrophobicContact CG2-CG1 3.89Å; I163-L222 HydrophobicContact CG2-CD2 4.38Å; I163-V231 HydrophobicContact CB-CG2 4.08Å; I163-V231 HydrophobicContact CG2-CG1 4.08Å; I163-V231 HydrophobicContact CG2-CG2 4Å; I163-T232 PolarHBondContact O-N 3Å
164	A	98.8	Very high	97.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	129.9	169.4	0	0	0	0	0	110	L104 F110 H144 T232	L104-A164 HydrophobicContact CD2-CB 3.63Å; F110-A164 HydrophobicContact CD1-CB 3.56Å; F110-A164 HydrophobicContact CE1-CB 3.85Å; F110-A164 HydrophobicContact CG-CB 4.21Å; H144-A164 WeakPolarHBondContact CA-O 3.3Å; H144-A164 WeakPolarHBondContact CB-O 3.3Å; H144-A164 PolarHBondContact N-O 2.7Å; H144-A164 PolarHBondContact ND1-O 2.66Å; H144-A164 VanDerWaalsContact ND1-O 3.16Å; H144-A164 PolarHBondContact O-N 2.75Å; A164-T232 WeakPolarHBondContact CA-O 3.41Å
165	I	98.8	Very high	97.6	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.01	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	123.7	-178.6	-56.8	-178.2	0	0	0	109.6	H141 L142 I143 I163 L222 V231 T232 W233 I234	H141-I165 HydrophobicContact CB-CG2 3.74Å; L142-I165 WeakPolarHBondContact O-CA 3.36Å; I143-I165 HydrophobicContact CG1-CD1 4.2Å; I143-I165 HydrophobicContact CG1-CG1 4.29Å; I143-I165 HydrophobicContact CG1-CG2 4.41Å; I143-I165 HydrophobicContact CG2-CD1 4.42Å; I143-I165 HydrophobicContact CG2-CG1 4.27Å; I163-I165 HydrophobicContact CG2-CD1 4.22Å; I163-I165 HydrophobicContact CG2-CG1 3.89Å; I165-L222 HydrophobicContact CD1-CD2 4.06Å; I165-V231 HydrophobicContact CB-CG1 4.23Å; I165-V231 HydrophobicContact CD1-CG1 3.77Å; I165-V231 HydrophobicContact CG1-CG1 3.72Å; I165-T232 PolarHBondContact N-O 2.82Å; I165-W233 HydrophobicContact CB-CD2 4.29Å; I165-W233 HydrophobicContact CB-CE3 3.95Å; I165-W233 HydrophobicContact CB-CH2 4.05Å; I165-W233 HydrophobicContact CB-CZ2 4.37Å; I165-W233 HydrophobicContact CB-CZ3 3.83Å; I165-W233 HydrophobicContact CD1-CH2 3.84Å; I165-W233 HydrophobicContact CD1-CZ2 3.75Å; I165-W233 HydrophobicContact CG2-CE3 3.93Å; I165-W233 HydrophobicContact CG2-CH2 3.67Å; I165-W233 HydrophobicContact CG2-CZ2 4.45Å; I165-W233 HydrophobicContact CG2-CZ3 3.35Å; I165-I234 PolarHBondContact O-N 2.75Å
166	I	98.8	Very high	97.6	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	121.4	165.6	-66	179.7	0	0	0	108.2	Y74 L99 H141 L142 L168 L207 I234 F236	Y74-I166 WeakPolarHBondContact OH-CD1 3.26Å; L99-I166 HydrophobicContact CD1-CD1 3.89Å; L99-I166 HydrophobicContact CD2-CD1 3.77Å; L99-I166 HydrophobicContact CD2-CG1 3.92Å; L99-I166 HydrophobicContact CG-CD1 4.47Å; H141-I166 CarbonylContact C-O 3.58Å; H141-I166 WeakPolarHBondContact CA-O 3.42Å; L142-I166 HydrophobicContact CB-CB 4.2Å; L142-I166 PolarHBondContact N-O 2.83Å; L142-I166 PolarHBondContact O-N 2.77Å; I166-L168 HydrophobicContact CG2-CD1 3.91Å; I166-L168 HydrophobicContact CG2-CG 4.14Å; I166-L207 HydrophobicContact CD1-CD2 4.48Å; I166-I234 CarbonylContact C-O 3.47Å; I166-I234 VanDerWaalsContact CA-O 3.28Å; I166-I234 WeakPolarHBondContact CA-O 3.14Å; I166-I234 HydrophobicContact CG1-CB 4.18Å; I166-I234 HydrophobicContact CG1-CD1 4.5Å; I166-I234 HydrophobicContact CG1-CG2 4.33Å; I166-F236 HydrophobicContact CD1-CE2 4.18Å; I166-F236 HydrophobicContact CG2-CD2 3.53Å; I166-F236 HydrophobicContact CG2-CE2 3.48Å; I166-F236 VanDerWaalsContact CG2-CE2 3.48Å
167	A	98.8	Very high	97.5	Very high	3 Å²	3	47 Å²	47	3%	0.025	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	135.4	172.9	0	0	0	0	0	111.3	E139 L140 W233 I234 L235 F236	E139-A167 HydrophobicContact CG-CB 4.46Å; E139-A167 WeakPolarHBondContact OE1-CB 3.17Å; L140-A167 WeakPolarHBondContact O-CA 3.46Å; A167-W233 HydrophobicContact CB-CE3 3.99Å; A167-W233 HydrophobicContact CB-CZ3 3.84Å; A167-I234 PolarHBondContact N-O 3.22Å; A167-L235 HydrophobicContact CB-CD1 4.11Å; A167-L235 HydrophobicContact CB-CG 3.82Å; A167-F236 PolarHBondContact O-N 3.06Å
168	L	98.5	Very high	97.4	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	118.9	179.4	-63.1	124.8	0	0	0	110.1	E139 L140 L142 I166 L206 P208 F236 L240	E139-L168 CarbonylContact C-O 3.56Å; E139-L168 VanDerWaalsContact CA-O 3.31Å; E139-L168 WeakPolarHBondContact CA-O 3.35Å; L140-L168 HydrophobicContact CB-CB 4.49Å; L140-L168 HydrophobicContact CB-CD1 4.48Å; L140-L168 HydrophobicContact CD1-CB 4.02Å; L140-L168 PolarHBondContact N-O 2.65Å; L140-L168 PolarHBondContact O-N 3.46Å; L142-L168 HydrophobicContact CD1-CD1 3.43Å; L142-L168 VanDerWaalsContact CD1-CD1 3.43Å; I166-L168 HydrophobicContact CG2-CD1 3.91Å; I166-L168 HydrophobicContact CG2-CG 4.14Å; L168-L206 WeakPolarHBondContact CD2-O 3.13Å; L168-P208 HydrophobicContact CD2-CG 4.16Å; L168-F236 HydrophobicContact CD2-CB 4.22Å; L168-F236 HydrophobicContact CD2-CD2 3.66Å; L168-F236 HydrophobicContact CD2-CG 4.32Å; L168-F236 HydrophobicContact CG-CD2 4.12Å; L168-L240 HydrophobicContact CB-CD1 4.41Å; L168-L240 HydrophobicContact CD2-CD1 4.39Å; L168-L240 HydrophobicContact CD2-CD2 4.47Å; L168-L240 HydrophobicContact CD2-CG 4.33Å
169	F	98.4	Very high	97.6	Very high	3 Å²	3	43.6 Å²	43.6	1%	0.013	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	148.4	168.5	-64.7	-58.6	0	0	0	111.2	H129 V131 F136 L235 P239 L240	H129-F169 HydrophobicContact CB-CE1 3.68Å; H129-F169 HydrophobicContact CB-CZ 3.58Å; H129-F169 WeakPolarHBondContact O-CE1 3.46Å; V131-F169 HydrophobicContact CG2-CD2 4.4Å; V131-F169 HydrophobicContact CG2-CE2 3.45Å; V131-F169 VanDerWaalsContact CG2-CE2 3.45Å; V131-F169 HydrophobicContact CG2-CZ 3.73Å; F136-F169 HydrophobicContact CB-CB 4.27Å; F136-F169 HydrophobicContact CB-CD1 4.08Å; F136-F169 HydrophobicContact CD1-CB 3.96Å; F136-F169 HydrophobicContact CD2-CB 3.8Å; F136-F169 AromaticContact CD2-CD1 3.34Å; F136-F169 HydrophobicContact CD2-CD1 3.34Å; F136-F169 HydrophobicContact CD2-CD2 4.14Å; F136-F169 AromaticContact CD2-CE1 3.9Å; F136-F169 HydrophobicContact CD2-CE1 3.9Å; F136-F169 AromaticContact CD2-CG 3.48Å; F136-F169 HydrophobicContact CD2-CG 3.48Å; F136-F169 VanDerWaalsContact CD2-CG 3.48Å; F136-F169 HydrophobicContact CD2-CZ 4.49Å; F136-F169 HydrophobicContact CE1-CB 4.21Å; F136-F169 HydrophobicContact CE2-CB 4.05Å; F136-F169 AromaticContact CE2-CD1 3.95Å; F136-F169 HydrophobicContact CE2-CD1 3.95Å; F136-F169 AromaticContact CE2-CD2 3.88Å; F136-F169 HydrophobicContact CE2-CD2 3.88Å; F136-F169 HydrophobicContact CE2-CE1 4.37Å; F136-F169 HydrophobicContact CE2-CE2 4.32Å; F136-F169 AromaticContact CE2-CG 3.68Å; F136-F169 HydrophobicContact CE2-CG 3.68Å; F136-F169 HydrophobicContact CG-CB 3.74Å; F136-F169 AromaticContact CG-CD1 3.88Å; F136-F169 HydrophobicContact CG-CD1 3.88Å; F136-F169 AromaticContact CG-CG 3.94Å; F136-F169 HydrophobicContact CG-CG 3.94Å; F136-F169 HydrophobicContact CZ-CB 4.25Å; F136-F169 HydrophobicContact CZ-CD2 4.44Å; F136-F169 HydrophobicContact CZ-CG 4.3Å; F169-L235 HydrophobicContact CZ-CD2 4.44Å; F169-P239 HydrophobicContact CB-CB 3.91Å; F169-P239 CarbonylContact O-C 3.57Å; F169-P239 WeakPolarHBondContact O-CA 3.39Å; F169-P239 WeakPolarHBondContact O-CB 3.41Å; F169-L240 PolarHBondContact O-N 2.98Å
170	V	98.5	Very high	97.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	134.2	174.3	-169.3	0	0	0	0	109.2	F136 P137 M138 L140 L240 I242	F136-V170 WeakPolarHBondContact CB-O 3.11Å; P137-V170 WeakPolarHBondContact CD-O 3.31Å; P137-V170 WeakPolarHBondContact CG-O 3.3Å; M138-V170 HydrophobicContact CB-CB 3.93Å; M138-V170 HydrophobicContact CB-CG2 4.17Å; M138-V170 HydrophobicContact CG-CB 4.11Å; M138-V170 HydrophobicContact CG-CG2 3.8Å; M138-V170 PolarHBondContact O-N 3.42Å; M138-V170 HydrophobicContact SD-CB 4.34Å; M138-V170 HydrophobicContact SD-CG1 4.39Å; M138-V170 HydrophobicContact SD-CG2 4Å; L140-V170 HydrophobicContact CD1-CG2 3.08Å; L140-V170 HydrophobicContact CG-CG2 4.21Å; V170-L240 CarbonylContact C-O 3.47Å; V170-L240 WeakPolarHBondContact CA-O 3.31Å; V170-I242 HydrophobicContact CG1-CB 3.56Å; V170-I242 HydrophobicContact CG1-CG2 3.38Å
171	Q	98	Very high	97.6	Very high	82 Å²	82	39 Å²	39	38%	0.383	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	156.1	174.1	66.4	-178	6.9	0	0	111.7	F136 G173 P239 L240 T241 I242	F136-Q171 HydrophobicContact CD1-CB 4.16Å; F136-Q171 HydrophobicContact CE1-CB 4.46Å; Q171-G173 PolarHBondContact O-N 3.46Å; Q171-P239 HydrophobicContact CB-CB 4.5Å; Q171-P239 HydrophobicContact CG-CB 4.18Å; Q171-P239 HydrophobicContact CG-CG 4.06Å; Q171-L240 PolarHBondContact N-O 3.47Å; Q171-T241 HydrophobicContact CG-CG2 4.16Å; Q171-T241 WeakPolarHBondContact O-CA 3.02Å; Q171-I242 PolarHBondContact O-N 2.8Å
172	I	98.5	Very high	97.6	Very high	60 Å²	60	34.7 Å²	34.7	31%	0.308	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	130.8	174.4	-54.2	-55.8	0	0	0	109.9	N123 P137 I242 I247	N123-I172 HydrophobicContact CB-CG1 4.19Å; P137-I172 HydrophobicContact CB-CD1 4.37Å; P137-I172 HydrophobicContact CG-CD1 4.16Å; P137-I172 HydrophobicContact CG-CG1 4.18Å; I172-I242 CarbonylContact C-O 3.57Å; I172-I242 WeakPolarHBondContact CA-O 3.32Å; I172-I242 HydrophobicContact CD1-CG2 4.24Å; I172-I247 HydrophobicContact CD1-CB 4.45Å; I172-I247 HydrophobicContact CD1-CD1 4.17Å; I172-I247 HydrophobicContact CD1-CG2 3.7Å
173	G	98.2	Very high	97.6	Very high	42 Å²	42	35.1 Å²	35.1	43%	0.433	19%	0.19	S	C	.	.	S	Bend	trans	-173.2	-133.4	-179.4	0	0	0	0	0	112.2	Q171 I242	Q171-G173 PolarHBondContact O-N 3.46Å; G173-I242 PolarHBondContact N-O 3.47Å
174	K	97.8	Very high	97.5	Very high	173 Å²	173	40.3 Å²	40.3	75%	0.752	22%	0.215	S	C	*	.	S	Bend	trans	-73.9	157.4	176	-67	-177.2	-180	178.7	0	110.8	H176 T241 I242 S243	K174-H176 PolarHBondContact O-N 3.17Å; K174-T241 CarbonylContact O-C 3.55Å; K174-I242 CarbonylContact O-C 3.5Å; K174-I242 VanDerWaalsContact O-C 3.23Å; K174-I242 WeakPolarHBondContact O-CA 3.47Å; K174-S243 PolarHBondContact O-N 3.06Å
175	E	98.3	Very high	97.5	Very high	91 Å²	91	41 Å²	41	43%	0.425	22%	0.218	S	C	.	.			trans	-54.9	131.1	172.8	-175.4	177.7	102.6	0	0	111	V177 K180 Q246	E175-V177 PolarHBondContact O-N 3.35Å; E175-K180 IonicContact OE1-NZ 3.2Å; E175-Q246 HydrophobicContact CG-CG 4.42Å
176	H	97.9	Very high	97.4	Very high	22 Å²	22	41 Å²	41	10%	0.102	22%	0.218	C	C	.	.			trans	-85.3	107.6	174.4	-162	-86.7	0	0	0	109.9	K174 G178 L179 K180 T205 T241 Q246	K174-H176 PolarHBondContact O-N 3.17Å; H176-G178 VanDerWaalsContact C-N 3.27Å; H176-G178 PolarHBondContact ND1-N 3.15Å; H176-G178 PolarHBondContact O-N 3.49Å; H176-L179 HydrophobicContact CB-CB 4.1Å; H176-L179 HydrophobicContact CB-CD1 4.13Å; H176-L179 HydrophobicContact CB-CG 4.31Å; H176-L179 PolarHBondContact ND1-N 2.8Å; H176-L179 VanDerWaalsContact ND1-N 3.19Å; H176-L179 PolarHBondContact O-N 3.25Å; H176-L179 VanDerWaalsContact O-N 3.15Å; H176-K180 PolarHBondContact O-N 3.01Å; H176-T205 PolarHBondContact CE1-O 3.44Å; H176-T205 PolarHBondContact NE2-O 3.37Å; H176-T241 VanDerWaalsContact CB-O 3.22Å; H176-T241 WeakPolarHBondContact CB-O 3.17Å; H176-T241 PolarHBondContact CD2-O 3.2Å; H176-T241 VanDerWaalsContact CD2-O 3.29Å; H176-Q246 PolarHBondContact O-NE2 3.46Å
177	V	95.9	Very high	97.4	Very high	121 Å²	121	47.2 Å²	47.2	73%	0.733	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-58.7	-39.9	-177.2	-179.4	0	0	0	0	111.7	E175 L179 K180	E175-V177 PolarHBondContact O-N 3.35Å; V177-L179 VanDerWaalsContact C-N 3.32Å; V177-L179 PolarHBondContact O-N 2.74Å; V177-K180 VanDerWaalsContact O-CB 3.32Å; V177-K180 WeakPolarHBondContact O-CB 3.33Å; V177-K180 PolarHBondContact O-N 2.96Å
178	G	94.1	Very high	97.3	Very high	12 Å²	12	51 Å²	51	12%	0.124	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-66.7	-28.2	-179.8	0	0	0	0	0	115	H176 T205	H176-G178 VanDerWaalsContact C-N 3.27Å; H176-G178 PolarHBondContact ND1-N 3.15Å; H176-G178 PolarHBondContact O-N 3.49Å; G178-T205 WeakPolarHBondContact CA-OG1 3.37Å
179	L	96.7	Very high	97.3	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-91.4	-9.9	-179.3	-71.2	174.4	0	0	0	112.5	F117 L140 H176 V177 A181 V182 T183 L206 I242	F117-L179 HydrophobicContact CE1-CD2 3.67Å; F117-L179 HydrophobicContact CZ-CD2 3.95Å; L140-L179 HydrophobicContact CD2-CD1 4.49Å; L140-L179 HydrophobicContact CD2-CD2 4.12Å; H176-L179 HydrophobicContact CB-CB 4.1Å; H176-L179 HydrophobicContact CB-CD1 4.13Å; H176-L179 HydrophobicContact CB-CG 4.31Å; H176-L179 PolarHBondContact ND1-N 2.8Å; H176-L179 VanDerWaalsContact ND1-N 3.19Å; H176-L179 PolarHBondContact O-N 3.25Å; H176-L179 VanDerWaalsContact O-N 3.15Å; V177-L179 VanDerWaalsContact C-N 3.32Å; V177-L179 PolarHBondContact O-N 2.74Å; L179-A181 VanDerWaalsContact C-N 3.3Å; L179-A181 PolarHBondContact O-N 3.48Å; L179-V182 PolarHBondContact O-N 2.83Å; L179-T183 PolarHBondContact O-N 3.14Å; L179-T183 PolarHBondContact O-OG1 3.13Å; L179-T183 VanDerWaalsContact O-OG1 3.14Å; L179-L206 HydrophobicContact CD2-CD2 3.52Å; L179-L206 HydrophobicContact CG-CD2 3.94Å; L179-I242 HydrophobicContact CD1-CD1 3.95Å; L179-I242 HydrophobicContact CD1-CG1 4.49Å
180	K	96.4	Very high	97.3	Very high	81 Å²	81	53.3 Å²	53.3	35%	0.352	28%	0.278	S	S	.	.	H	α-helix	trans	-53.3	-47.5	-178.4	-175.7	168.2	-178.6	160.3	0	112.4	E175 H176 V177 V182 T183 E184	E175-K180 IonicContact OE1-NZ 3.2Å; H176-K180 PolarHBondContact O-N 3.01Å; V177-K180 VanDerWaalsContact O-CB 3.32Å; V177-K180 WeakPolarHBondContact O-CB 3.33Å; V177-K180 PolarHBondContact O-N 2.96Å; K180-V182 PolarHBondContact O-N 3.21Å; K180-T183 WeakPolarHBondContact CA-OG1 3.36Å; K180-T183 PolarHBondContact O-N 3.02Å; K180-T183 PolarHBondContact O-OG1 3.47Å; K180-E184 WeakPolarHBondContact CE-OE1 3.38Å; K180-E184 HydrophobicContact CG-CG 4.06Å; K180-E184 WeakPolarHBondContact CG-OE1 3.43Å; K180-E184 IonicContact NZ-OE1 2.75Å; K180-E184 WeakPolarHBondContact O-CB 3.26Å; K180-E184 VanDerWaalsContact O-CG 3.3Å; K180-E184 WeakPolarHBondContact O-CG 3.03Å; K180-E184 PolarHBondContact O-N 2.77Å
181	A	94.3	Very high	97.3	Very high	31 Å²	31	55.9 Å²	55.9	26%	0.256	29%	0.288	S	S	.	.	H	α-helix	trans	-59.2	-32	179.5	0	0	0	0	0	113.3	L179 I198	L179-A181 VanDerWaalsContact C-N 3.3Å; L179-A181 PolarHBondContact O-N 3.48Å; A181-I198 HydrophobicContact CB-CD1 4.29Å
182	V	97.1	Very high	97.3	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-78	-51.3	174.8	177.1	0	0	0	0	109.8	V82 I89 V91 L179 K180 E184 I185 L186 I198 F201 F250	V82-V182 HydrophobicContact CG1-CG1 4.27Å; I89-V182 HydrophobicContact CG2-CG1 4.32Å; V91-V182 HydrophobicContact CG2-CG2 4.2Å; L179-V182 PolarHBondContact O-N 2.83Å; K180-V182 PolarHBondContact O-N 3.21Å; V182-E184 VanDerWaalsContact C-N 3.29Å; V182-E184 PolarHBondContact O-N 3.05Å; V182-I185 WeakPolarHBondContact O-CD1 3.48Å; V182-I185 VanDerWaalsContact O-CG1 3.32Å; V182-I185 WeakPolarHBondContact O-CG1 3.41Å; V182-I185 PolarHBondContact O-N 3.04Å; V182-L186 HydrophobicContact CG1-CD2 4.17Å; V182-L186 WeakPolarHBondContact O-CG 3.49Å; V182-L186 PolarHBondContact O-N 3.1Å; V182-I198 HydrophobicContact CG2-CD1 4.19Å; V182-F201 HydrophobicContact CG2-CD2 3.94Å; V182-F201 HydrophobicContact CG2-CE2 3.63Å; V182-F201 HydrophobicContact CG2-CZ 4.42Å; V182-F250 HydrophobicContact CG1-CZ 4.48Å
183	T	97.6	Very high	97.2	Very high	9 Å²	9	55 Å²	55	6%	0.055	30%	0.297	C	S	.	.	H	α-helix	trans	-62.7	-32.3	-175.4	52.2	0	0	0	0	113.6	L179 K180 I185 L186 Q246 F250	L179-T183 PolarHBondContact O-N 3.14Å; L179-T183 PolarHBondContact O-OG1 3.13Å; L179-T183 VanDerWaalsContact O-OG1 3.14Å; K180-T183 WeakPolarHBondContact CA-OG1 3.36Å; K180-T183 PolarHBondContact O-N 3.02Å; K180-T183 PolarHBondContact O-OG1 3.47Å; T183-I185 PolarHBondContact O-N 2.93Å; T183-L186 HydrophobicContact CG2-CD1 4.39Å; T183-L186 PolarHBondContact O-N 3.06Å; T183-Q246 HydrophobicContact CG2-CB 3.94Å; T183-Q246 HydrophobicContact CG2-CG 4Å; T183-F250 HydrophobicContact CG2-CD2 4.34Å; T183-F250 HydrophobicContact CG2-CE2 3.69Å
184	E	96.9	Very high	97.2	Very high	113 Å²	113	58 Å²	58	53%	0.528	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-22.7	179.7	-77.7	177.5	160.7	0	0	113.5	K180 V182	K180-E184 WeakPolarHBondContact CE-OE1 3.38Å; K180-E184 HydrophobicContact CG-CG 4.06Å; K180-E184 WeakPolarHBondContact CG-OE1 3.43Å; K180-E184 IonicContact NZ-OE1 2.75Å; K180-E184 WeakPolarHBondContact O-CB 3.26Å; K180-E184 VanDerWaalsContact O-CG 3.3Å; K180-E184 WeakPolarHBondContact O-CG 3.03Å; K180-E184 PolarHBondContact O-N 2.77Å; V182-E184 VanDerWaalsContact C-N 3.29Å; V182-E184 PolarHBondContact O-N 3.05Å
185	I	97.4	Very high	97.3	Very high	15 Å²	15	52.6 Å²	52.6	8%	0.077	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-5.8	-178.2	65.5	66.6	0	0	0	114	V82 V182 T183 Q187 D188 I189 K196 I198	V82-I185 HydrophobicContact CB-CD1 3.99Å; V82-I185 HydrophobicContact CG1-CD1 3.91Å; V82-I185 HydrophobicContact CG2-CD1 4.45Å; V182-I185 WeakPolarHBondContact O-CD1 3.48Å; V182-I185 VanDerWaalsContact O-CG1 3.32Å; V182-I185 WeakPolarHBondContact O-CG1 3.41Å; V182-I185 PolarHBondContact O-N 3.04Å; T183-I185 PolarHBondContact O-N 2.93Å; I185-Q187 PolarHBondContact O-N 3.49Å; I185-D188 WeakPolarHBondContact O-CB 3.43Å; I185-D188 PolarHBondContact O-N 3.33Å; I185-I189 HydrophobicContact CD1-CD1 3.56Å; I185-I189 HydrophobicContact CD1-CG1 3.89Å; I185-I189 PolarHBondContact O-N 2.8Å; I185-K196 HydrophobicContact CB-CD 3.92Å; I185-K196 HydrophobicContact CG2-CD 3.97Å; I185-I198 HydrophobicContact CG1-CG2 3.77Å; I185-I198 HydrophobicContact CG2-CG2 4.07Å
186	L	98.3	Very high	97.2	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.01	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-33.3	-173.7	-68.8	-177	0	0	0	112.7	I89 V182 T183 D188 I189 Q190 E249 F250 L253	I89-L186 HydrophobicContact CD1-CD2 3.89Å; I89-L186 HydrophobicContact CG1-CD2 3.85Å; I89-L186 HydrophobicContact CG2-CD2 4.4Å; V182-L186 HydrophobicContact CG1-CD2 4.17Å; V182-L186 WeakPolarHBondContact O-CG 3.49Å; V182-L186 PolarHBondContact O-N 3.1Å; T183-L186 HydrophobicContact CG2-CD1 4.39Å; T183-L186 PolarHBondContact O-N 3.06Å; L186-D188 PolarHBondContact O-N 3.15Å; L186-I189 HydrophobicContact CD2-CD1 4.07Å; L186-I189 HydrophobicContact CD2-CG1 4.34Å; L186-I189 CarbonylContact O-C 3.23Å; L186-I189 PolarHBondContact O-N 2.82Å; L186-Q190 PolarHBondContact O-N 3.38Å; L186-Q190 VanDerWaalsContact O-N 3.12Å; L186-E249 HydrophobicContact CB-CB 4.27Å; L186-E249 HydrophobicContact CD1-CB 3.87Å; L186-F250 HydrophobicContact CD1-CB 4.48Å; L186-F250 HydrophobicContact CD1-CD1 4.01Å; L186-F250 HydrophobicContact CD1-CD2 3.71Å; L186-F250 HydrophobicContact CD1-CE1 4.16Å; L186-F250 HydrophobicContact CD1-CE2 3.88Å; L186-F250 HydrophobicContact CD1-CG 3.8Å; L186-F250 HydrophobicContact CD1-CZ 4.1Å; L186-L253 HydrophobicContact CB-CD2 4.23Å; L186-L253 HydrophobicContact CD2-CD1 4.44Å; L186-L253 HydrophobicContact CD2-CD2 4.45Å
187	Q	97.4	Very high	97.2	Very high	130 Å²	130	54.5 Å²	54.5	61%	0.607	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-30.9	174	65.3	-179.5	-13	0	0	113.3	I185	I185-Q187 PolarHBondContact O-N 3.49Å
188	D	97.7	Very high	97.1	Very high	83 Å²	83	49 Å²	49	44%	0.444	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-27	-179.8	-60.1	-43.2	0	0	0	111.6	I185 L186 K196	I185-D188 WeakPolarHBondContact O-CB 3.43Å; I185-D188 PolarHBondContact O-N 3.33Å; L186-D188 PolarHBondContact O-N 3.15Å; D188-K196 HydrophobicContact CB-CD 4.03Å; D188-K196 IonicContact OD2-NZ 3.34Å; D188-K196 PolarHBondContact OD2-NZ 2.97Å
189	I	98.2	Very high	97	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.005	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	30.3	177.4	63.9	168.4	0	0	0	112.4	V82 N84 I89 I185 L186 Y191 K194 S195 K196	V82-I189 HydrophobicContact CB-CD1 4.27Å; V82-I189 HydrophobicContact CG1-CD1 3.67Å; N84-I189 WeakPolarHBondContact CB-O 3.5Å; N84-I189 PolarHBondContact ND2-O 3.33Å; I89-I189 HydrophobicContact CD1-CD1 3.89Å; I185-I189 HydrophobicContact CD1-CD1 3.56Å; I185-I189 HydrophobicContact CD1-CG1 3.89Å; I185-I189 PolarHBondContact O-N 2.8Å; L186-I189 HydrophobicContact CD2-CD1 4.07Å; L186-I189 HydrophobicContact CD2-CG1 4.34Å; L186-I189 CarbonylContact O-C 3.23Å; L186-I189 PolarHBondContact O-N 2.82Å; I189-Y191 PolarHBondContact O-N 2.9Å; I189-K194 HydrophobicContact CB-CB 4.02Å; I189-K194 HydrophobicContact CG2-CB 4.2Å; I189-S195 VanDerWaalsContact CG2-C 3.48Å; I189-K196 HydrophobicContact CG2-CB 3.7Å
190	Q	98.3	Very high	96.8	Very high	51 Å²	51	56.4 Å²	56.4	24%	0.238	31%	0.308	C	S	.	.			trans	-56.2	-31.7	-172.7	-179.8	175.1	24.9	0	0	114	N84 L186 R252 L253 R254	N84-Q190 PolarHBondContact ND2-O 3.43Å; L186-Q190 PolarHBondContact O-N 3.38Å; L186-Q190 VanDerWaalsContact O-N 3.12Å; Q190-R252 WeakPolarHBondContact CG-O 3.22Å; Q190-R252 PolarHBondContact NE2-O 3Å; Q190-L253 CarbonylContact O-C 3.35Å; Q190-R254 HydrophobicContact CG-CG 3.96Å; Q190-R254 WeakPolarHBondContact O-CB 3.35Å; Q190-R254 PolarHBondContact O-N 2.77Å
191	Y	98.3	Very high	96.8	Very high	55 Å²	55	52.7 Å²	52.7	22%	0.216	29%	0.292	C	S	.	.	S	Bend	trans	-108.2	153.5	-171.8	-64.9	-90	0	0	0	112	N84 I189 K194 R254 H256 K258	N84-Y191 VanDerWaalsContact ND2-C 3.34Å; I189-Y191 PolarHBondContact O-N 2.9Å; Y191-K194 WeakPolarHBondContact O-CB 3.49Å; Y191-K194 WeakPolarHBondContact O-CG 3.36Å; Y191-K194 PolarHBondContact O-N 2.98Å; Y191-R254 HydrophobicContact CD1-CB 3.9Å; Y191-R254 HydrophobicContact CD1-CG 4.01Å; Y191-R254 HydrophobicContact CE1-CB 4.31Å; Y191-R254 HydrophobicContact CE1-CG 3.94Å; Y191-H256 WeakPolarHBondContact CB-O 3.22Å; Y191-H256 AromaticContact CD1-NE2 3.85Å; Y191-H256 AromaticContact CE1-NE2 3.62Å; Y191-K258 HydrophobicContact CD1-CB 3.95Å; Y191-K258 HydrophobicContact CD1-CG 4.37Å; Y191-K258 HydrophobicContact CD2-CB 3.83Å; Y191-K258 HydrophobicContact CD2-CD 4.05Å; Y191-K258 HydrophobicContact CD2-CG 3.94Å; Y191-K258 HydrophobicContact CE1-CB 4.34Å; Y191-K258 HydrophobicContact CE1-CG 4.28Å; Y191-K258 HydrophobicContact CE2-CB 4.25Å; Y191-K258 HydrophobicContact CE2-CD 3.97Å; Y191-K258 HydrophobicContact CE2-CG 3.86Å; Y191-K258 HydrophobicContact CG-CB 3.66Å; Y191-K258 HydrophobicContact CG-CG 4.2Å
192	K	97.8	Very high	96.9	Very high	65 Å²	65	53.7 Å²	53.7	28%	0.283	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50	139.1	176.1	176.4	174.6	-178.5	176.8	0	111.1	N84 D85 K194 R254 T255 H256 V257	N84-K192 CarbonylContact O-C 3.58Å; D85-K192 WeakPolarHBondContact O-CE 3.46Å; K192-K194 VanDerWaalsContact C-N 3.25Å; K192-K194 PolarHBondContact O-N 3.12Å; K192-R254 PolarHBondContact N-O 2.76Å; K192-T255 VanDerWaalsContact CD-O 3.28Å; K192-T255 WeakPolarHBondContact CD-O 3.42Å; K192-H256 VanDerWaalsContact CB-C 3.48Å; K192-H256 PolarHBondContact N-O 3.11Å; K192-V257 HydrophobicContact CB-CG1 4.37Å; K192-V257 HydrophobicContact CG-CG1 4.46Å
193	G	97.6	Very high	96.8	Very high	58 Å²	58	53.7 Å²	53.7	60%	0.598	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.3	3.7	179.3	0	0	0	0	0	114.6	N84	N84-G193 PolarHBondContact O-N 3.46Å
194	K	98.3	Very high	96.7	Very high	105 Å²	105	55.8 Å²	55.8	46%	0.457	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	131.1	172.8	-63.5	-57.5	-178.3	-167.9	0	110.2	N84 I189 Y191 K192	N84-K194 PolarHBondContact N-O 3.2Å; I189-K194 HydrophobicContact CB-CB 4.02Å; I189-K194 HydrophobicContact CG2-CB 4.2Å; Y191-K194 WeakPolarHBondContact O-CB 3.49Å; Y191-K194 WeakPolarHBondContact O-CG 3.36Å; Y191-K194 PolarHBondContact O-N 2.98Å; K192-K194 VanDerWaalsContact C-N 3.25Å; K192-K194 PolarHBondContact O-N 3.12Å
195	S	97.8	Very high	96.7	Very high	60 Å²	60	52.9 Å²	52.9	42%	0.42	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	157	171.9	74.5	0	0	0	0	111.8	E81 V82 T83 I189	E81-S195 VanDerWaalsContact OE2-CB 3.26Å; E81-S195 WeakPolarHBondContact OE2-CB 3.29Å; E81-S195 PolarHBondContact OE2-OG 2.93Å; V82-S195 CarbonylContact O-C 3.13Å; V82-S195 WeakPolarHBondContact O-CA 3.42Å; T83-S195 WeakPolarHBondContact OG1-CB 3.31Å; I189-S195 VanDerWaalsContact CG2-C 3.48Å
196	K	97.6	Very high	96.7	Very high	80 Å²	80	52.1 Å²	52.1	35%	0.348	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	137.8	171.6	-166.9	176.6	-175.8	-173.7	0	110	V82 I185 D188 I189	V82-K196 PolarHBondContact N-O 2.93Å; V82-K196 PolarHBondContact O-N 3.18Å; I185-K196 HydrophobicContact CB-CD 3.92Å; I185-K196 HydrophobicContact CG2-CD 3.97Å; D188-K196 HydrophobicContact CB-CD 4.03Å; D188-K196 IonicContact OD2-NZ 3.34Å; D188-K196 PolarHBondContact OD2-NZ 2.97Å; I189-K196 HydrophobicContact CG2-CB 3.7Å
197	T	96.5	Very high	96.6	Very high	72 Å²	72	52.6 Å²	52.6	44%	0.442	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	128.7	173.1	-52.3	0	0	0	0	110.6	D79 C80	D79-T197 VanDerWaalsContact C-CG2 3.42Å; D79-T197 VanDerWaalsContact CA-CG2 3.45Å; D79-T197 HydrophobicContact CB-CG2 3.74Å; C80-T197 CarbonylContact O-C 3.59Å; C80-T197 VanDerWaalsContact O-CA 3.32Å; C80-T197 WeakPolarHBondContact O-CA 3.35Å
198	I	94.8	Very high	96.4	Very high	5 Å²	5	47 Å²	47	3%	0.026	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	137.5	168.6	60.1	177.8	0	0	0	109.8	D79 C80 V82 A181 V182 I185 C200 F201	D79-I198 CarbonylContact C-O 3.46Å; D79-I198 WeakPolarHBondContact CA-O 3.41Å; C80-I198 HydrophobicContact CB-CD1 4.39Å; C80-I198 HydrophobicContact CB-CG1 3.8Å; C80-I198 PolarHBondContact N-O 2.87Å; C80-I198 PolarHBondContact O-N 2.88Å; V82-I198 HydrophobicContact CG2-CD1 3.74Å; V82-I198 HydrophobicContact CG2-CG1 3.94Å; V82-I198 HydrophobicContact CG2-CG2 4.23Å; A181-I198 HydrophobicContact CB-CD1 4.29Å; V182-I198 HydrophobicContact CG2-CD1 4.19Å; I185-I198 HydrophobicContact CG1-CG2 3.77Å; I185-I198 HydrophobicContact CG2-CG2 4.07Å; I198-C200 PolarHBondContact O-N 2.87Å; I198-F201 HydrophobicContact CD1-CB 3.81Å; I198-F201 HydrophobicContact CD1-CD2 4.09Å; I198-F201 HydrophobicContact CD1-CG 4.23Å; I198-F201 HydrophobicContact CG1-CB 4.41Å
199	P	92.7	Very high	96.1	Very high	101 Å²	101	47.3 Å²	47.3	66%	0.656	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68	-25.8	-170.8	26.2	-35.4	0	0	0	113	D79	D79-P199 PolarHBondContact N-O 2.86Å
200	C	92.9	Very high	95.7	Very high	68 Å²	68	51.4 Å²	51.4	46%	0.459	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	126	-176.3	178.4	0	0	0	0	110.6	V76 C77 I198	V76-C200 WeakPolarHBondContact CG1-SG 3.45Å; C77-C200 WeakPolarHBondContact O-CA 3.37Å; I198-C200 PolarHBondContact O-N 2.87Å
201	F	95.4	Very high	95.3	Very high	3 Å²	3	56.5 Å²	56.5	1%	0.013	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	123.7	169.4	-175.6	-111.6	0	0	0	109.8	C77 C80 V91 V115 V182 I198 P203 L206	C77-F201 HydrophobicContact CB-CB 4.48Å; C77-F201 PolarHBondContact N-O 2.82Å; C77-F201 PolarHBondContact O-N 3.01Å; C80-F201 HydrophobicContact CB-CB 3.95Å; V91-F201 HydrophobicContact CG1-CD1 3.79Å; V91-F201 HydrophobicContact CG1-CE1 3.86Å; V91-F201 HydrophobicContact CG1-CG 4.3Å; V91-F201 HydrophobicContact CG1-CZ 4.43Å; V115-F201 HydrophobicContact CG2-CE1 4.22Å; V182-F201 HydrophobicContact CG2-CD2 3.94Å; V182-F201 HydrophobicContact CG2-CE2 3.63Å; V182-F201 HydrophobicContact CG2-CZ 4.42Å; I198-F201 HydrophobicContact CD1-CB 3.81Å; I198-F201 HydrophobicContact CD1-CD2 4.09Å; I198-F201 HydrophobicContact CD1-CG 4.23Å; I198-F201 HydrophobicContact CG1-CB 4.41Å; F201-P203 HydrophobicContact CE1-CB 4.34Å; F201-P203 VanDerWaalsContact O-CD 3.31Å; F201-P203 WeakPolarHBondContact O-CD 3.42Å; F201-L206 HydrophobicContact CE1-CD1 4.43Å; F201-L206 HydrophobicContact CZ-CD1 3.95Å; F201-L206 HydrophobicContact CZ-CD2 4.41Å; F201-L206 HydrophobicContact CZ-CG 4.3Å
202	N	95.6	Very high	95	Very high	52 Å²	52	57.5 Å²	57.5	28%	0.278	33%	0.333	S	S	.	.			trans	-105.6	99.1	178.4	-176.1	0.9	0	0	0	110.1	V76 N204 T205	V76-N202 HydrophobicContact CG2-CB 4.07Å; N202-N204 PolarHBondContact O-N 3.02Å; N202-N204 VanDerWaalsContact O-N 3.15Å; N202-N204 VanDerWaalsContact OD1-CB 3.29Å; N202-N204 WeakPolarHBondContact OD1-CB 3.35Å; N202-N204 PolarHBondContact OD1-N 2.85Å; N202-N204 VanDerWaalsContact OD1-N 3.1Å; N202-N204 PolarHBondContact OD1-ND2 2.78Å; N202-T205 HydrophobicContact CB-CG2 3.9Å; N202-T205 WeakPolarHBondContact O-CB 3.49Å; N202-T205 WeakPolarHBondContact O-CG2 3.14Å; N202-T205 PolarHBondContact O-N 2.93Å; N202-T205 PolarHBondContact O-OG1 2.71Å
203	P	95.9	Very high	94.7	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-61	-23	179.7	27.5	-39.9	0	0	0	113.4	Y74 L93 L112 F201 T205 L206	Y74-P203 VanDerWaalsContact CB-CG 3.43Å; Y74-P203 HydrophobicContact CD2-CB 3.93Å; Y74-P203 HydrophobicContact CD2-CG 4.08Å; Y74-P203 HydrophobicContact CG-CB 4.32Å; Y74-P203 HydrophobicContact CG-CG 4.02Å; L93-P203 HydrophobicContact CD2-CB 4.05Å; L93-P203 HydrophobicContact CD2-CG 3.67Å; L112-P203 HydrophobicContact CD2-CB 4.02Å; L112-P203 HydrophobicContact CD2-CG 4.43Å; F201-P203 HydrophobicContact CE1-CB 4.34Å; F201-P203 VanDerWaalsContact O-CD 3.31Å; F201-P203 WeakPolarHBondContact O-CD 3.42Å; P203-T205 PolarHBondContact O-N 3.16Å; P203-T205 VanDerWaalsContact O-N 3.14Å; P203-L206 WeakPolarHBondContact O-CB 3.29Å; P203-L206 PolarHBondContact O-N 2.85Å
204	N	95.7	Very high	94.6	Very high	53 Å²	53	56.9 Å²	56.9	28%	0.283	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-61.2	-24	174.4	-63.6	-78.7	0	0	0	112.6	Y74 N202 L206 L207	Y74-N204 PolarHBondContact O-ND2 2.98Å; N202-N204 PolarHBondContact O-N 3.02Å; N202-N204 VanDerWaalsContact O-N 3.15Å; N202-N204 VanDerWaalsContact OD1-CB 3.29Å; N202-N204 WeakPolarHBondContact OD1-CB 3.35Å; N202-N204 PolarHBondContact OD1-N 2.85Å; N202-N204 VanDerWaalsContact OD1-N 3.1Å; N202-N204 PolarHBondContact OD1-ND2 2.78Å; N204-L206 PolarHBondContact O-N 3.47Å; N204-L207 PolarHBondContact O-N 3.34Å
205	T	96	Very high	94.6	Very high	51 Å²	51	52.2 Å²	52.2	31%	0.313	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-69.8	-17.7	177.5	65	0	0	0	0	112.8	H176 G178 N202 P203 L207	H176-T205 PolarHBondContact CE1-O 3.44Å; H176-T205 PolarHBondContact NE2-O 3.37Å; G178-T205 WeakPolarHBondContact CA-OG1 3.37Å; N202-T205 HydrophobicContact CB-CG2 3.9Å; N202-T205 WeakPolarHBondContact O-CB 3.49Å; N202-T205 WeakPolarHBondContact O-CG2 3.14Å; N202-T205 PolarHBondContact O-N 2.93Å; N202-T205 PolarHBondContact O-OG1 2.71Å; P203-T205 PolarHBondContact O-N 3.16Å; P203-T205 VanDerWaalsContact O-N 3.14Å; T205-L207 VanDerWaalsContact C-N 3.33Å
206	L	97	Very high	94.6	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-83	-11.4	174.8	-53.7	-176.9	0	0	0	112.5	V115 L140 L142 L168 L179 F201 P203 N204 L240	V115-L206 HydrophobicContact CG1-CD1 3.74Å; V115-L206 HydrophobicContact CG2-CD1 4.09Å; L140-L206 HydrophobicContact CD2-CD1 4.07Å; L140-L206 HydrophobicContact CD2-CD2 4.01Å; L142-L206 HydrophobicContact CD1-CD1 4.01Å; L168-L206 WeakPolarHBondContact CD2-O 3.13Å; L179-L206 HydrophobicContact CD2-CD2 3.52Å; L179-L206 HydrophobicContact CG-CD2 3.94Å; F201-L206 HydrophobicContact CE1-CD1 4.43Å; F201-L206 HydrophobicContact CZ-CD1 3.95Å; F201-L206 HydrophobicContact CZ-CD2 4.41Å; F201-L206 HydrophobicContact CZ-CG 4.3Å; P203-L206 WeakPolarHBondContact O-CB 3.29Å; P203-L206 PolarHBondContact O-N 2.85Å; N204-L206 PolarHBondContact O-N 3.47Å; L206-L240 HydrophobicContact CB-CD1 4.47Å; L206-L240 VanDerWaalsContact O-CD1 3.3Å; L206-L240 WeakPolarHBondContact O-CD1 3.2Å; L206-L240 WeakPolarHBondContact O-CD2 3.26Å
207	L	96.5	Very high	94.7	Very high	12 Å²	12	46 Å²	46	6%	0.063	26%	0.258	C	S	.	.	S	Bend	trans	-86.4	143.6	-179.9	-61.1	173.3	0	0	0	109.9	P72 Y74 L142 I166 N204 T205 F236	P72-L207 HydrophobicContact CB-CD1 3.53Å; P72-L207 HydrophobicContact CG-CD1 3.79Å; P72-L207 HydrophobicContact CG-CD2 4.41Å; Y74-L207 HydrophobicContact CD2-CD1 3.98Å; Y74-L207 HydrophobicContact CE2-CD1 3.73Å; Y74-L207 HydrophobicContact CE2-CD2 4.13Å; Y74-L207 HydrophobicContact CE2-CG 4.13Å; L142-L207 HydrophobicContact CD2-CD2 4.35Å; I166-L207 HydrophobicContact CD1-CD2 4.48Å; N204-L207 PolarHBondContact O-N 3.34Å; T205-L207 VanDerWaalsContact C-N 3.33Å; L207-F236 HydrophobicContact CD2-CE2 3.78Å; L207-F236 HydrophobicContact CD2-CZ 4.45Å
208	P	93.8	Very high	94.8	Very high	11 Å²	11	42.8 Å²	42.8	7%	0.071	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-57.2	157.7	168.5	-22.1	33.2	0	0	0	111.1	L168 L212 R213 F236	L168-P208 HydrophobicContact CD2-CG 4.16Å; P208-L212 HydrophobicContact CB-CB 4.22Å; P208-R213 PolarHBondContact O-NE 2.82Å; P208-R213 VanDerWaalsContact O-NE 3.11Å; P208-F236 HydrophobicContact CG-CB 4.06Å; P208-F236 HydrophobicContact CG-CD1 4.26Å; P208-F236 HydrophobicContact CG-CD2 4.32Å; P208-F236 HydrophobicContact CG-CG 3.96Å
209	D	91.4	Very high	94.9	Very high	91 Å²	91	46.2 Å²	46.2	49%	0.487	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-46.3	137.3	168.8	-175.1	-79.5	0	0	0	109.7	L211 L212	D209-L211 PolarHBondContact O-N 3.07Å; D209-L211 WeakPolarHBondContact OD1-CB 3.28Å; D209-L211 PolarHBondContact OD1-N 3.49Å; D209-L212 HydrophobicContact CB-CD1 4.34Å; D209-L212 HydrophobicContact CB-CG 4.37Å; D209-L212 CarbonylContact O-C 3.56Å; D209-L212 WeakPolarHBondContact O-CA 3.44Å; D209-L212 PolarHBondContact O-N 2.87Å
210	P	90.7	Very high	95.2	Very high	87 Å²	87	41.4 Å²	41.4	57%	0.565	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-48.3	-30.6	-179.4	-30.5	36.5	0	0	0	115.4	L212	P210-L212 VanDerWaalsContact C-N 3.3Å
211	L	89.2	Confident	95.4	Very high	157 Å²	157	38.1 Å²	38.1	82%	0.822	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-75.9	-15.6	177.1	-60.6	175.7	0	0	0	113.8	D209	D209-L211 PolarHBondContact O-N 3.07Å; D209-L211 WeakPolarHBondContact OD1-CB 3.28Å; D209-L211 PolarHBondContact OD1-N 3.49Å
212	L	91	Very high	95.6	Very high	77 Å²	77	39 Å²	39	40%	0.403	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-110.6	24.1	-179	-59.5	179.5	0	0	0	112	P208 D209 P210 D214 Y238	P208-L212 HydrophobicContact CB-CB 4.22Å; D209-L212 HydrophobicContact CB-CD1 4.34Å; D209-L212 HydrophobicContact CB-CG 4.37Å; D209-L212 CarbonylContact O-C 3.56Å; D209-L212 WeakPolarHBondContact O-CA 3.44Å; D209-L212 PolarHBondContact O-N 2.87Å; P210-L212 VanDerWaalsContact C-N 3.3Å; L212-D214 PolarHBondContact O-N 2.98Å; L212-Y238 HydrophobicContact CB-CD2 3.86Å; L212-Y238 HydrophobicContact CB-CE2 4.25Å; L212-Y238 HydrophobicContact CB-CG 4.23Å; L212-Y238 HydrophobicContact CD2-CD2 4.44Å; L212-Y238 HydrophobicContact CD2-CE1 4.43Å; L212-Y238 HydrophobicContact CD2-CE2 4.2Å; L212-Y238 WeakPolarHBondContact O-CD2 3.33Å
213	R	92.9	Very high	95.6	Very high	71 Å²	71	36.8 Å²	36.8	27%	0.268	19%	0.194	S	C	.	.			trans	-89.1	39.8	-180	-70.4	-175	-172.5	-179	0.2	113.1	P208 Y215 F236	P208-R213 PolarHBondContact O-NE 2.82Å; P208-R213 VanDerWaalsContact O-NE 3.11Å; R213-Y215 WeakPolarHBondContact O-CD1 3.45Å; R213-F236 HydrophobicContact CB-CD1 4.4Å; R213-F236 HydrophobicContact CB-CE1 3.72Å; R213-F236 HydrophobicContact CG-CE1 3.88Å; R213-F236 HydrophobicContact CG-CZ 4.33Å
214	D	95.9	Very high	95.6	Very high	38 Å²	38	38.1 Å²	38.1	20%	0.203	20%	0.2	C	C	.	.			trans	-67.9	133.2	165.5	-73.2	-9.9	0	0	0	108.6	L212 R237 Y238 F289	L212-D214 PolarHBondContact O-N 2.98Å; D214-R237 HydrophobicContact CB-CB 3.85Å; D214-R237 VanDerWaalsContact O-CB 3.32Å; D214-R237 WeakPolarHBondContact O-CB 3.44Å; D214-R237 PolarHBondContact O-N 2.95Å; D214-R237 IonicContact OD2-NH1 3.83Å; D214-R237 PolarHBondContact OD2-NH1 2.85Å; D214-Y238 HydrophobicContact CB-CD2 4.39Å; D214-Y238 HydrophobicContact CB-CE2 3.83Å; D214-Y238 PolarHBondContact OD2-OH 3.28Å; D214-F289 HydrophobicContact CB-CB 4.34Å; D214-F289 HydrophobicContact CB-CD1 3.57Å; D214-F289 HydrophobicContact CB-CE1 4.01Å; D214-F289 HydrophobicContact CB-CG 4Å
215	Y	97.9	Very high	95.5	Very high	7 Å²	7	36.1 Å²	36.1	3%	0.027	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	157.5	178.3	62.2	-93.4	0	0	0	112.5	L65 L70 G102 R213 I234 L235 F236 A288 F289	L65-Y215 HydrophobicContact CD1-CE2 4.27Å; L65-Y215 PolarHBondContact O-OH 2.7Å; L70-Y215 HydrophobicContact CB-CE1 3.84Å; L70-Y215 HydrophobicContact CD2-CD1 4.22Å; L70-Y215 HydrophobicContact CD2-CE1 4.13Å; G102-Y215 WeakPolarHBondContact CA-OH 3.11Å; R213-Y215 WeakPolarHBondContact O-CD1 3.45Å; Y215-I234 HydrophobicContact CD2-CG2 3.85Å; Y215-I234 HydrophobicContact CE2-CG2 4.49Å; Y215-I234 HydrophobicContact CG-CG2 3.92Å; Y215-L235 CarbonylContact C-O 3.53Å; Y215-L235 WeakPolarHBondContact CA-O 3.39Å; Y215-L235 VanDerWaalsContact CB-O 3.29Å; Y215-L235 WeakPolarHBondContact CB-O 3.34Å; Y215-F236 HydrophobicContact CD1-CE1 4.28Å; Y215-A288 HydrophobicContact CD1-CB 4.05Å; Y215-A288 HydrophobicContact CD2-CB 4.15Å; Y215-A288 HydrophobicContact CE1-CB 3.73Å; Y215-A288 HydrophobicContact CE2-CB 3.84Å; Y215-A288 HydrophobicContact CG-CB 4.25Å; Y215-A288 PolarHBondContact O-N 3.4Å; Y215-F289 WeakPolarHBondContact O-CE1 3.17Å
216	W	98.3	Very high	95.4	Very high	11 Å²	11	36.3 Å²	36.3	4%	0.042	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	155.2	163.5	-62.9	-80.4	0	0	0	110.5	L54 V131 I234 L235 R237 I285 R286 F289	L54-W216 HydrophobicContact CD1-CB 3.6Å; L54-W216 HydrophobicContact CD1-CD2 3.41Å; L54-W216 VanDerWaalsContact CD1-CD2 3.41Å; L54-W216 HydrophobicContact CD1-CE3 3.66Å; L54-W216 HydrophobicContact CD1-CG 3.42Å; L54-W216 VanDerWaalsContact CD1-CG 3.42Å; L54-W216 HydrophobicContact CD1-CZ3 4.39Å; L54-W216 HydrophobicContact CD2-CD2 3.8Å; L54-W216 VanDerWaalsContact CD2-CE2 3.47Å; L54-W216 HydrophobicContact CD2-CE3 4.21Å; L54-W216 HydrophobicContact CD2-CG 4.28Å; L54-W216 HydrophobicContact CD2-CH2 4.05Å; L54-W216 HydrophobicContact CD2-CZ2 3.63Å; L54-W216 HydrophobicContact CD2-CZ3 4.31Å; L54-W216 HydrophobicContact CG-CD2 4.27Å; L54-W216 HydrophobicContact CG-CG 4.42Å; V131-W216 HydrophobicContact CG1-CH2 4.33Å; V131-W216 HydrophobicContact CG2-CZ3 4.41Å; W216-I234 CarbonylContact O-C 3.56Å; W216-I234 WeakPolarHBondContact O-CA 3.46Å; W216-L235 HydrophobicContact CB-CB 4.47Å; W216-L235 HydrophobicContact CE3-CB 4.39Å; W216-L235 PolarHBondContact N-O 3.16Å; W216-L235 PolarHBondContact O-N 3.17Å; W216-R237 HydrophobicContact CE3-CB 4.43Å; W216-R237 HydrophobicContact CH2-CB 4.15Å; W216-R237 HydrophobicContact CH2-CG 3.75Å; W216-R237 HydrophobicContact CZ2-CG 4.38Å; W216-R237 HydrophobicContact CZ3-CB 3.93Å; W216-R237 HydrophobicContact CZ3-CG 4.04Å; W216-I285 HydrophobicContact CB-CG2 3.87Å; W216-I285 HydrophobicContact CG-CG2 4.16Å; W216-R286 CarbonylContact C-O 3.58Å; W216-R286 VanDerWaalsContact CA-O 3.23Å; W216-R286 WeakPolarHBondContact CA-O 3.23Å; W216-F289 HydrophobicContact CD2-CE1 4.2Å; W216-F289 HydrophobicContact CD2-CZ 4.11Å; W216-F289 AromaticContact CE2-CE1 3.95Å; W216-F289 AromaticContact CE2-CZ 3.41Å; W216-F289 VanDerWaalsContact CE2-CZ 3.41Å; W216-F289 HydrophobicContact CG-CE1 4.38Å; W216-F289 HydrophobicContact CH2-CZ 4.38Å; W216-F289 HydrophobicContact CZ2-CE1 4.42Å; W216-F289 HydrophobicContact CZ2-CE2 4.44Å; W216-F289 AromaticContact CZ2-CZ 3.57Å; W216-F289 HydrophobicContact CZ2-CZ 3.57Å; W216-F289 AromaticContact NE1-CE1 3.89Å; W216-F289 AromaticContact NE1-CZ 3.4Å
217	V	98.4	Very high	95.4	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	140.6	173.5	59.2	0	0	0	0	111.3	L65 P103 T232 W233 R286	L65-V217 HydrophobicContact CD1-CG1 3.74Å; L65-V217 HydrophobicContact CD2-CG1 3.94Å; P103-V217 HydrophobicContact CB-CB 4.32Å; P103-V217 HydrophobicContact CB-CG1 4.33Å; P103-V217 HydrophobicContact CB-CG2 3.62Å; P103-V217 HydrophobicContact CG-CB 4.28Å; P103-V217 HydrophobicContact CG-CG2 3.71Å; V217-T232 HydrophobicContact CG2-CG2 3.89Å; V217-W233 WeakPolarHBondContact CA-O 3.48Å; V217-W233 VanDerWaalsContact CG2-O 3.31Å; V217-W233 WeakPolarHBondContact CG2-O 3.39Å; V217-R286 HydrophobicContact CG1-CB 3.72Å; V217-R286 PolarHBondContact N-O 3.08Å; V217-R286 PolarHBondContact O-N 3.31Å
218	Y	98.3	Very high	95.4	Very high	4 Å²	4	36.3 Å²	36.3	2%	0.016	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	160.7	169.5	78.2	-80.7	0	0	0	110.4	S50 I52 H129 W233 L235	S50-Y218 WeakPolarHBondContact CB-OH 3.36Å; S50-Y218 PolarHBondContact OG-OH 3.16Å; I52-Y218 HydrophobicContact CD1-CD1 3.87Å; I52-Y218 HydrophobicContact CD1-CD2 3.94Å; I52-Y218 HydrophobicContact CD1-CE1 3.87Å; I52-Y218 HydrophobicContact CD1-CE2 4Å; I52-Y218 HydrophobicContact CD1-CG 3.91Å; I52-Y218 HydrophobicContact CG1-CD1 4.44Å; I52-Y218 HydrophobicContact CG1-CE1 3.93Å; I52-Y218 HydrophobicContact CG1-CE2 4.18Å; I52-Y218 HydrophobicContact CG2-CE2 4.19Å; H129-Y218 AromaticContact NE2-CE1 3.65Å; H129-Y218 AromaticContact NE2-CZ 3.63Å; H129-Y218 PolarHBondContact NE2-OH 2.86Å; Y218-W233 HydrophobicContact CD1-CB 3.6Å; Y218-W233 HydrophobicContact CD1-CG 4.33Å; Y218-W233 HydrophobicContact CE1-CB 3.27Å; Y218-W233 HydrophobicContact CE1-CD2 4.35Å; Y218-W233 AromaticContact CE1-CG 3.59Å; Y218-W233 HydrophobicContact CE1-CG 3.59Å; Y218-W233 HydrophobicContact CE2-CB 4.43Å; Y218-W233 AromaticContact CE2-CD1 3.93Å; Y218-W233 HydrophobicContact CE2-CG 4.27Å; Y218-W233 HydrophobicContact CG-CB 4.32Å; Y218-W233 AromaticContact CZ-CD1 3.55Å; Y218-W233 AromaticContact CZ-CG 3.52Å; Y218-W233 PolarHBondContact N-O 2.74Å; Y218-W233 PolarHBondContact O-N 2.92Å; Y218-L235 HydrophobicContact CD1-CD1 4.23Å; Y218-L235 HydrophobicContact CE1-CD1 3.77Å
219	E	97.9	Very high	95.6	Very high	76 Å²	76	38.7 Å²	38.7	36%	0.355	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	133	172.5	-61.4	-56.4	140.2	0	0	110	T232 R283	E219-T232 PolarHBondContact OE1-OG1 2.8Å; E219-T232 PolarHBondContact OE2-OG1 3.4Å; E219-T232 VanDerWaalsContact OE2-OG1 3.09Å; E219-R283 WeakPolarHBondContact O-CD 3.44Å; E219-R283 PolarHBondContact O-NH1 2.89Å
220	G	98.2	Very high	95.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	-152.9	-173.6	0	0	0	0	0	113.6	Y48 S50 E229 G230 V231	Y48-G220 CarbonylContact O-C 3.52Å; Y48-G220 WeakPolarHBondContact O-CA 3.33Å; S50-G220 WeakPolarHBondContact OG-CA 3.14Å; G220-E229 CarbonylContact O-C 3.08Å; G220-G230 PolarHBondContact O-N 3Å; G220-V231 PolarHBondContact N-O 2.97Å; G220-V231 PolarHBondContact O-N 3.45Å
221	S	98.3	Very high	96.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	174.8	178.9	74.2	0	0	0	0	112.1	Y48 Q49 S50 C227 S228 V231 W233	Y48-S221 PolarHBondContact O-N 2.89Å; Q49-S221 WeakPolarHBondContact CA-OG 3.22Å; Q49-S221 VanDerWaalsContact NE2-CB 3.34Å; Q49-S221 PolarHBondContact OE1-OG 3.48Å; S50-S221 WeakPolarHBondContact CB-O 3.33Å; S50-S221 PolarHBondContact N-OG 3.34Å; S50-S221 PolarHBondContact OG-N 2.93Å; S50-S221 VanDerWaalsContact OG-N 3.07Å; S50-S221 PolarHBondContact OG-O 3.3Å; S221-C227 WeakPolarHBondContact CB-O 3.34Å; S221-S228 CarbonylContact C-O 3.55Å; S221-S228 WeakPolarHBondContact CA-O 3.33Å; S221-S228 WeakPolarHBondContact CB-O 3.46Å; S221-V231 VanDerWaalsContact C-CG2 3.4Å; S221-W233 WeakPolarHBondContact O-CZ2 3.35Å; S221-W233 PolarHBondContact O-NE1 2.72Å
222	L	97.9	Very high	96.6	Very high	21 Å²	21	24.1 Å²	24.1	11%	0.11	13%	0.128	C	C	.	.			trans	-62.3	147.5	156.6	-62.7	176.9	0	0	0	109.7	V157 I163 I165 I224 S228 V231	V157-L222 HydrophobicContact CG1-CD1 3.91Å; V157-L222 HydrophobicContact CG2-CD1 4.4Å; I163-L222 HydrophobicContact CG2-CD2 4.38Å; I165-L222 HydrophobicContact CD1-CD2 4.06Å; L222-I224 VanDerWaalsContact C-N 3.34Å; L222-S228 PolarHBondContact N-O 2.89Å; L222-V231 HydrophobicContact CD2-CG2 3.94Å; L222-V231 HydrophobicContact CG-CG2 4.12Å
223	T	97.2	Very high	96.9	Very high	6 Å²	6	20.4 Å²	20.4	4%	0.037	11%	0.109	C	C	.	.	S	Bend	trans	-93.6	2.8	176.5	58.4	0	0	0	0	113.3	W37 P51 E128 W233	W37-T223 WeakPolarHBondContact CZ3-O 3.16Å; P51-T223 HydrophobicContact CB-CG2 4.3Å; E128-T223 WeakPolarHBondContact OE1-CB 3.35Å; E128-T223 PolarHBondContact OE1-OG1 2.96Å; E128-T223 WeakPolarHBondContact OE2-CB 3.23Å; E128-T223 VanDerWaalsContact OE2-CG2 3.26Å; E128-T223 WeakPolarHBondContact OE2-CG2 3.44Å; E128-T223 PolarHBondContact OE2-OG1 2.87Å; T223-W233 HydrophobicContact CG2-CH2 3.99Å; T223-W233 HydrophobicContact CG2-CZ2 3.71Å
224	I	95	Very high	97.2	Very high	27 Å²	27	17 Å²	17	14%	0.138	10%	0.096	C	C	.	.	S	Bend	trans	-123.8	158.1	171.4	60.5	140.4	0	0	0	109.5	W29 Y31 R116 L222 C227	W29-I224 HydrophobicContact CH2-CB 3.65Å; W29-I224 HydrophobicContact CH2-CG2 3.47Å; W29-I224 VanDerWaalsContact CH2-CG2 3.47Å; W29-I224 HydrophobicContact CZ2-CB 3.93Å; W29-I224 HydrophobicContact CZ2-CD1 4.13Å; W29-I224 HydrophobicContact CZ2-CG2 4.19Å; W29-I224 HydrophobicContact CZ3-CB 4.33Å; W29-I224 HydrophobicContact CZ3-CG2 4.12Å; Y31-I224 WeakPolarHBondContact OH-CG2 3.3Å; R116-I224 VanDerWaalsContact NH1-CG1 3.27Å; L222-I224 VanDerWaalsContact C-N 3.34Å; I224-C227 WeakPolarHBondContact O-CA 3.37Å; I224-C227 PolarHBondContact O-N 3.13Å
225	P	94.1	Very high	97.3	Very high	11 Å²	11	15.3 Å²	15.3	7%	0.071	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.3	140.1	169.5	-33.4	41	0	0	0	113.4	W29 W37 F41 C227	W29-P225 HydrophobicContact CB-CG 4.15Å; W29-P225 HydrophobicContact CD2-CB 4.34Å; W29-P225 HydrophobicContact CD2-CG 3.64Å; W29-P225 HydrophobicContact CE3-CG 3.98Å; W29-P225 HydrophobicContact CG-CB 4.21Å; W29-P225 HydrophobicContact CG-CG 3.69Å; W37-P225 HydrophobicContact CD2-CG 3.95Å; W37-P225 HydrophobicContact CE3-CG 4.17Å; W37-P225 HydrophobicContact CG-CG 4.16Å; F41-P225 HydrophobicContact CD1-CB 3.89Å; F41-P225 HydrophobicContact CD2-CB 3.63Å; F41-P225 HydrophobicContact CD2-CG 3.73Å; F41-P225 HydrophobicContact CE1-CB 3.8Å; F41-P225 HydrophobicContact CE2-CB 3.53Å; F41-P225 HydrophobicContact CE2-CG 3.64Å; F41-P225 HydrophobicContact CG-CB 3.81Å; F41-P225 HydrophobicContact CG-CG 4.34Å; F41-P225 HydrophobicContact CZ-CB 3.61Å; F41-P225 HydrophobicContact CZ-CG 4.19Å; P225-C227 VanDerWaalsContact C-N 3.27Å; P225-C227 VanDerWaalsContact CA-N 3.31Å
226	P	94	Very high	97.3	Very high	56 Å²	56	15 Å²	15	36%	0.364	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	cis	-79.4	6.5	7	32.4	-36.5	0	0	0	114.8	F41 D43 S228	F41-P226 HydrophobicContact CD1-CB 4.17Å; D43-P226 WeakPolarHBondContact CB-O 3.47Å; P226-S228 VanDerWaalsContact C-N 3.26Å; P226-S228 WeakPolarHBondContact CG-OG 3.42Å; P226-S228 PolarHBondContact O-N 2.88Å
227	C	96.3	Very high	97.3	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.1	C	C	.	.			trans	63.7	27.9	-178.2	-51.9	0	0	0	0	113.8	A44 Q49 S221 I224 P225 E229	A44-C227 HydrophobicContact CB-CB 3.75Å; Q49-C227 PolarHBondContact NE2-O 2.91Å; Q49-C227 VanDerWaalsContact OE1-CB 3.32Å; S221-C227 WeakPolarHBondContact CB-O 3.34Å; I224-C227 WeakPolarHBondContact O-CA 3.37Å; I224-C227 PolarHBondContact O-N 3.13Å; P225-C227 VanDerWaalsContact C-N 3.27Å; P225-C227 VanDerWaalsContact CA-N 3.31Å; C227-E229 PolarHBondContact O-N 3.09Å
228	S	96.8	Very high	97.2	Very high	12 Å²	12	22.8 Å²	22.8	8%	0.084	12%	0.115	C	C	.	.			trans	-61.8	137.1	-177.7	-61	0	0	0	0	112.5	D43 S221 L222 P226	D43-S228 WeakPolarHBondContact OD2-CA 3.46Å; D43-S228 PolarHBondContact OD2-OG 3.13Å; S221-S228 CarbonylContact C-O 3.55Å; S221-S228 WeakPolarHBondContact CA-O 3.33Å; S221-S228 WeakPolarHBondContact CB-O 3.46Å; L222-S228 PolarHBondContact N-O 2.89Å; P226-S228 VanDerWaalsContact C-N 3.26Å; P226-S228 WeakPolarHBondContact CG-OG 3.42Å; P226-S228 PolarHBondContact O-N 2.88Å
229	E	97.1	Very high	97.1	Very high	60 Å²	60	24.3 Å²	24.3	28%	0.28	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	166.7	176.9	-58.7	-175	155.9	0	0	111.9	G46 E47 Y48 G220 C227	G46-E229 WeakPolarHBondContact CA-OE1 3.49Å; E47-E229 PolarHBondContact N-OE1 3.25Å; Y48-E229 WeakPolarHBondContact CA-OE1 3.44Å; Y48-E229 PolarHBondContact N-OE1 2.99Å; G220-E229 CarbonylContact O-C 3.08Å; C227-E229 PolarHBondContact O-N 3.09Å
230	G	95.3	Very high	97.1	Very high	26 Å²	26	21.4 Å²	21.4	27%	0.268	11%	0.113	S	C	.	.	E	Extended strand (participates in β ladder)	trans	100.2	19.7	-178	0	0	0	0	0	114	G220	G220-G230 PolarHBondContact O-N 3Å
231	V	98.5	Very high	97	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.012	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	123.2	174.2	178.7	0	0	0	0	110.1	I163 I165 G220 S221 L222 W233	I163-V231 HydrophobicContact CB-CG2 4.08Å; I163-V231 HydrophobicContact CG2-CG1 4.08Å; I163-V231 HydrophobicContact CG2-CG2 4Å; I165-V231 HydrophobicContact CB-CG1 4.23Å; I165-V231 HydrophobicContact CD1-CG1 3.77Å; I165-V231 HydrophobicContact CG1-CG1 3.72Å; G220-V231 PolarHBondContact N-O 2.97Å; G220-V231 PolarHBondContact O-N 3.45Å; S221-V231 VanDerWaalsContact C-CG2 3.4Å; L222-V231 HydrophobicContact CD2-CG2 3.94Å; L222-V231 HydrophobicContact CG-CG2 4.12Å; V231-W233 HydrophobicContact CG1-CD2 4.4Å; V231-W233 HydrophobicContact CG1-CG 4.25Å; V231-W233 HydrophobicContact CG1-CZ2 4.48Å; V231-W233 PolarHBondContact O-N 2.8Å
232	T	98.6	Very high	97	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.006	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	109.1	167.8	-57.4	0	0	0	0	109.5	P103 L104 I163 A164 I165 V217 E219	P103-T232 HydrophobicContact CB-CG2 4.28Å; P103-T232 HydrophobicContact CG-CG2 4.03Å; L104-T232 HydrophobicContact CD2-CG2 4.35Å; I163-T232 PolarHBondContact O-N 3Å; A164-T232 WeakPolarHBondContact CA-O 3.41Å; I165-T232 PolarHBondContact N-O 2.82Å; V217-T232 HydrophobicContact CG2-CG2 3.89Å; E219-T232 PolarHBondContact OE1-OG1 2.8Å; E219-T232 PolarHBondContact OE2-OG1 3.4Å; E219-T232 VanDerWaalsContact OE2-OG1 3.09Å
233	W	98.8	Very high	97.1	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	133.5	178.9	-80.7	89.7	0	0	0	111.6	S50 H129 H141 I165 A167 V217 Y218 S221 T223 V231 L235	S50-W233 PolarHBondContact OG-NE1 2.93Å; H129-W233 AromaticContact CE1-CE3 3.62Å; H129-W233 AromaticContact CE1-CZ3 3.67Å; H141-W233 AromaticContact CD2-CZ3 3.82Å; H141-W233 AromaticContact CE1-CH2 3.38Å; H141-W233 WeakPolarHBondContact CE1-CH2 3.41Å; H141-W233 AromaticContact CE1-CZ3 3.83Å; H141-W233 AromaticContact ND1-CH2 3.69Å; H141-W233 AromaticContact NE2-CH2 3.65Å; H141-W233 AromaticContact NE2-CZ3 3.59Å; I165-W233 HydrophobicContact CB-CD2 4.29Å; I165-W233 HydrophobicContact CB-CE3 3.95Å; I165-W233 HydrophobicContact CB-CH2 4.05Å; I165-W233 HydrophobicContact CB-CZ2 4.37Å; I165-W233 HydrophobicContact CB-CZ3 3.83Å; I165-W233 HydrophobicContact CD1-CH2 3.84Å; I165-W233 HydrophobicContact CD1-CZ2 3.75Å; I165-W233 HydrophobicContact CG2-CE3 3.93Å; I165-W233 HydrophobicContact CG2-CH2 3.67Å; I165-W233 HydrophobicContact CG2-CZ2 4.45Å; I165-W233 HydrophobicContact CG2-CZ3 3.35Å; A167-W233 HydrophobicContact CB-CE3 3.99Å; A167-W233 HydrophobicContact CB-CZ3 3.84Å; V217-W233 WeakPolarHBondContact CA-O 3.48Å; V217-W233 VanDerWaalsContact CG2-O 3.31Å; V217-W233 WeakPolarHBondContact CG2-O 3.39Å; Y218-W233 HydrophobicContact CD1-CB 3.6Å; Y218-W233 HydrophobicContact CD1-CG 4.33Å; Y218-W233 HydrophobicContact CE1-CB 3.27Å; Y218-W233 HydrophobicContact CE1-CD2 4.35Å; Y218-W233 AromaticContact CE1-CG 3.59Å; Y218-W233 HydrophobicContact CE1-CG 3.59Å; Y218-W233 HydrophobicContact CE2-CB 4.43Å; Y218-W233 AromaticContact CE2-CD1 3.93Å; Y218-W233 HydrophobicContact CE2-CG 4.27Å; Y218-W233 HydrophobicContact CG-CB 4.32Å; Y218-W233 AromaticContact CZ-CD1 3.55Å; Y218-W233 AromaticContact CZ-CG 3.52Å; Y218-W233 PolarHBondContact N-O 2.74Å; Y218-W233 PolarHBondContact O-N 2.92Å; S221-W233 WeakPolarHBondContact O-CZ2 3.35Å; S221-W233 PolarHBondContact O-NE1 2.72Å; T223-W233 HydrophobicContact CG2-CH2 3.99Å; T223-W233 HydrophobicContact CG2-CZ2 3.71Å; V231-W233 HydrophobicContact CG1-CD2 4.4Å; V231-W233 HydrophobicContact CG1-CG 4.25Å; V231-W233 HydrophobicContact CG1-CZ2 4.48Å; V231-W233 PolarHBondContact O-N 2.8Å; W233-L235 HydrophobicContact CB-CD1 3.81Å; W233-L235 HydrophobicContact CE3-CD1 4.01Å; W233-L235 HydrophobicContact CG-CD1 4.49Å
234	I	98.7	Very high	97.1	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	102.2	176.9	-60.2	168.4	0	0	0	108.1	L70 L99 P103 L104 I165 I166 A167 Y215 W216	L70-I234 HydrophobicContact CD1-CD1 3.78Å; L70-I234 HydrophobicContact CD2-CD1 4.34Å; L70-I234 HydrophobicContact CD2-CG2 3.69Å; L99-I234 HydrophobicContact CD2-CD1 4.15Å; P103-I234 HydrophobicContact CG-CD1 3.85Å; P103-I234 HydrophobicContact CG-CG1 3.87Å; L104-I234 HydrophobicContact CD2-CD1 4.48Å; I165-I234 PolarHBondContact O-N 2.75Å; I166-I234 CarbonylContact C-O 3.47Å; I166-I234 VanDerWaalsContact CA-O 3.28Å; I166-I234 WeakPolarHBondContact CA-O 3.14Å; I166-I234 HydrophobicContact CG1-CB 4.18Å; I166-I234 HydrophobicContact CG1-CD1 4.5Å; I166-I234 HydrophobicContact CG1-CG2 4.33Å; A167-I234 PolarHBondContact N-O 3.22Å; Y215-I234 HydrophobicContact CD2-CG2 3.85Å; Y215-I234 HydrophobicContact CE2-CG2 4.49Å; Y215-I234 HydrophobicContact CG-CG2 3.92Å; W216-I234 CarbonylContact O-C 3.56Å; W216-I234 WeakPolarHBondContact O-CA 3.46Å
235	L	98.5	Very high	97.3	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	113	-176.3	-81.9	70.1	0	0	0	110.1	L54 H129 A167 F169 Y215 W216 Y218 W233	L54-L235 HydrophobicContact CD1-CD2 4.29Å; H129-L235 HydrophobicContact CB-CD2 3.96Å; A167-L235 HydrophobicContact CB-CD1 4.11Å; A167-L235 HydrophobicContact CB-CG 3.82Å; F169-L235 HydrophobicContact CZ-CD2 4.44Å; Y215-L235 CarbonylContact C-O 3.53Å; Y215-L235 WeakPolarHBondContact CA-O 3.39Å; Y215-L235 VanDerWaalsContact CB-O 3.29Å; Y215-L235 WeakPolarHBondContact CB-O 3.34Å; W216-L235 HydrophobicContact CB-CB 4.47Å; W216-L235 HydrophobicContact CE3-CB 4.39Å; W216-L235 PolarHBondContact N-O 3.16Å; W216-L235 PolarHBondContact O-N 3.17Å; Y218-L235 HydrophobicContact CD1-CD1 4.23Å; Y218-L235 HydrophobicContact CE1-CD1 3.77Å; W233-L235 HydrophobicContact CB-CD1 3.81Å; W233-L235 HydrophobicContact CE3-CD1 4.01Å; W233-L235 HydrophobicContact CG-CD1 4.49Å
236	F	98.1	Very high	97.5	Very high	1 Å²	1	30.5 Å²	30.5	0%	0.004	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	134.6	173.1	-80.5	-61.2	0	0	0	111.3	L70 I166 A167 L168 L207 P208 R213 Y215	L70-F236 HydrophobicContact CD2-CE1 4.49Å; L70-F236 HydrophobicContact CD2-CZ 4.02Å; I166-F236 HydrophobicContact CD1-CE2 4.18Å; I166-F236 HydrophobicContact CG2-CD2 3.53Å; I166-F236 HydrophobicContact CG2-CE2 3.48Å; I166-F236 VanDerWaalsContact CG2-CE2 3.48Å; A167-F236 PolarHBondContact O-N 3.06Å; L168-F236 HydrophobicContact CD2-CB 4.22Å; L168-F236 HydrophobicContact CD2-CD2 3.66Å; L168-F236 HydrophobicContact CD2-CG 4.32Å; L168-F236 HydrophobicContact CG-CD2 4.12Å; L207-F236 HydrophobicContact CD2-CE2 3.78Å; L207-F236 HydrophobicContact CD2-CZ 4.45Å; P208-F236 HydrophobicContact CG-CB 4.06Å; P208-F236 HydrophobicContact CG-CD1 4.26Å; P208-F236 HydrophobicContact CG-CD2 4.32Å; P208-F236 HydrophobicContact CG-CG 3.96Å; R213-F236 HydrophobicContact CB-CD1 4.4Å; R213-F236 HydrophobicContact CB-CE1 3.72Å; R213-F236 HydrophobicContact CG-CE1 3.88Å; R213-F236 HydrophobicContact CG-CZ 4.33Å; Y215-F236 HydrophobicContact CD1-CE1 4.28Å
237	R	96.5	Very high	97.7	Very high	95 Å²	95	27.9 Å²	27.9	36%	0.358	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	-38.8	-175.9	179.6	-176.9	-176.6	174.1	6.6	113.2	D214 W216 F289	D214-R237 HydrophobicContact CB-CB 3.85Å; D214-R237 VanDerWaalsContact O-CB 3.32Å; D214-R237 WeakPolarHBondContact O-CB 3.44Å; D214-R237 PolarHBondContact O-N 2.95Å; D214-R237 IonicContact OD2-NH1 3.83Å; D214-R237 PolarHBondContact OD2-NH1 2.85Å; W216-R237 HydrophobicContact CE3-CB 4.43Å; W216-R237 HydrophobicContact CH2-CB 4.15Å; W216-R237 HydrophobicContact CH2-CG 3.75Å; W216-R237 HydrophobicContact CZ2-CG 4.38Å; W216-R237 HydrophobicContact CZ3-CB 3.93Å; W216-R237 HydrophobicContact CZ3-CG 4.04Å; R237-F289 HydrophobicContact CB-CE1 4.44Å; R237-F289 HydrophobicContact CG-CZ 4.31Å
238	Y	96.3	Very high	97.8	Very high	80 Å²	80	30.9 Å²	30.9	31%	0.314	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	125.4	-172.3	-61.3	-84.8	0	0	0	110.3	L212 D214	L212-Y238 HydrophobicContact CB-CD2 3.86Å; L212-Y238 HydrophobicContact CB-CE2 4.25Å; L212-Y238 HydrophobicContact CB-CG 4.23Å; L212-Y238 HydrophobicContact CD2-CD2 4.44Å; L212-Y238 HydrophobicContact CD2-CE1 4.43Å; L212-Y238 HydrophobicContact CD2-CE2 4.2Å; L212-Y238 WeakPolarHBondContact O-CD2 3.33Å; D214-Y238 HydrophobicContact CB-CD2 4.39Å; D214-Y238 HydrophobicContact CB-CE2 3.83Å; D214-Y238 PolarHBondContact OD2-OH 3.28Å
239	P	96.7	Very high	97.9	Very high	36 Å²	36	31.6 Å²	31.6	23%	0.234	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	149.6	-178.2	30.9	-36	0	0	0	111.6	F136 F169 Q171	F136-P239 HydrophobicContact CD1-CB 4.34Å; F136-P239 HydrophobicContact CE1-CB 3.94Å; F136-P239 HydrophobicContact CE1-CG 4.05Å; F169-P239 HydrophobicContact CB-CB 3.91Å; F169-P239 CarbonylContact O-C 3.57Å; F169-P239 WeakPolarHBondContact O-CA 3.39Å; F169-P239 WeakPolarHBondContact O-CB 3.41Å; Q171-P239 HydrophobicContact CB-CB 4.5Å; Q171-P239 HydrophobicContact CG-CB 4.18Å; Q171-P239 HydrophobicContact CG-CG 4.06Å
240	L	97.1	Very high	97.9	Very high	15 Å²	15	28.8 Å²	28.8	8%	0.079	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	159.1	162.6	-57	-179.5	0	0	0	110.2	L140 L168 F169 V170 Q171 L206	L140-L240 HydrophobicContact CD1-CD1 3.82Å; L168-L240 HydrophobicContact CB-CD1 4.41Å; L168-L240 HydrophobicContact CD2-CD1 4.39Å; L168-L240 HydrophobicContact CD2-CD2 4.47Å; L168-L240 HydrophobicContact CD2-CG 4.33Å; F169-L240 PolarHBondContact O-N 2.98Å; V170-L240 CarbonylContact C-O 3.47Å; V170-L240 WeakPolarHBondContact CA-O 3.31Å; Q171-L240 PolarHBondContact N-O 3.47Å; L206-L240 HydrophobicContact CB-CD1 4.47Å; L206-L240 VanDerWaalsContact O-CD1 3.3Å; L206-L240 WeakPolarHBondContact O-CD1 3.2Å; L206-L240 WeakPolarHBondContact O-CD2 3.26Å
241	T	97.6	Very high	98.1	Very high	51 Å²	51	28.8 Å²	28.8	31%	0.313	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	132.4	172.6	59.8	0	0	0	0	110.6	Q171 K174 H176	Q171-T241 HydrophobicContact CG-CG2 4.16Å; Q171-T241 WeakPolarHBondContact O-CA 3.02Å; K174-T241 CarbonylContact O-C 3.55Å; H176-T241 VanDerWaalsContact CB-O 3.22Å; H176-T241 WeakPolarHBondContact CB-O 3.17Å; H176-T241 PolarHBondContact CD2-O 3.2Å; H176-T241 VanDerWaalsContact CD2-O 3.29Å
242	I	98.3	Very high	98.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	147.2	173.1	-161.9	170.5	0	0	0	109.7	M138 V170 Q171 I172 G173 K174 L179 Q246 I247 F250	M138-I242 HydrophobicContact CE-CD1 4.4Å; M138-I242 HydrophobicContact SD-CD1 4.16Å; V170-I242 HydrophobicContact CG1-CB 3.56Å; V170-I242 HydrophobicContact CG1-CG2 3.38Å; Q171-I242 PolarHBondContact O-N 2.8Å; I172-I242 CarbonylContact C-O 3.57Å; I172-I242 WeakPolarHBondContact CA-O 3.32Å; I172-I242 HydrophobicContact CD1-CG2 4.24Å; G173-I242 PolarHBondContact N-O 3.47Å; K174-I242 CarbonylContact O-C 3.5Å; K174-I242 VanDerWaalsContact O-C 3.23Å; K174-I242 WeakPolarHBondContact O-CA 3.47Å; L179-I242 HydrophobicContact CD1-CD1 3.95Å; L179-I242 HydrophobicContact CD1-CG1 4.49Å; I242-Q246 HydrophobicContact CD1-CB 3.81Å; I242-Q246 HydrophobicContact CG1-CB 3.46Å; I242-Q246 VanDerWaalsContact CG1-CB 3.46Å; I242-Q246 HydrophobicContact CG1-CG 4.33Å; I242-I247 HydrophobicContact CG2-CB 4.33Å; I242-F250 HydrophobicContact CD1-CE2 4.37Å
243	S	98.6	Very high	98	Very high	17 Å²	17	34.6 Å²	34.6	12%	0.119	16%	0.16	C	C	.	.			trans	-73.7	158.9	174.8	67.1	0	0	0	0	111.6	K174 L245 Q246 I247	K174-S243 PolarHBondContact O-N 3.06Å; S243-L245 VanDerWaalsContact C-N 3.27Å; S243-L245 PolarHBondContact O-N 2.84Å; S243-Q246 VanDerWaalsContact N-OE1 3.15Å; S243-Q246 PolarHBondContact O-N 2.91Å; S243-Q246 WeakPolarHBondContact OG-CB 3.09Å; S243-Q246 VanDerWaalsContact OG-CG 3.3Å; S243-Q246 WeakPolarHBondContact OG-CG 3.42Å; S243-Q246 PolarHBondContact OG-N 3.45Å; S243-Q246 PolarHBondContact OG-OE1 3.22Å; S243-I247 PolarHBondContact O-N 3.23Å
244	Q	98.5	Very high	98	Very high	70 Å²	70	37.8 Å²	37.8	33%	0.327	17%	0.172	S	C	.	.	H	α-helix	trans	-56.4	-44.3	172.4	-171	65.8	42.6	0	0	111.2	N123 Q246 I247 E248	N123-Q244 PolarHBondContact ND2-OE1 3Å; N123-Q244 PolarHBondContact OD1-NE2 3.19Å; Q244-Q246 VanDerWaalsContact C-N 3.32Å; Q244-Q246 PolarHBondContact O-N 3.23Å; Q244-I247 WeakPolarHBondContact O-CG2 3.44Å; Q244-I247 PolarHBondContact O-N 2.82Å; Q244-E248 HydrophobicContact CG-CG 4.4Å; Q244-E248 PolarHBondContact NE2-OE1 2.79Å; Q244-E248 WeakPolarHBondContact O-CG 3.37Å; Q244-E248 PolarHBondContact O-N 2.9Å
245	L	98.4	Very high	97.9	Very high	111 Å²	111	40.6 Å²	40.6	58%	0.581	19%	0.189	S	C	*	.	H	α-helix	trans	-59.2	-44.1	-179.3	-179.8	61.7	0	0	0	111.8	S243 E248 E249	S243-L245 VanDerWaalsContact C-N 3.27Å; S243-L245 PolarHBondContact O-N 2.84Å; L245-E248 PolarHBondContact O-N 2.94Å; L245-E249 PolarHBondContact O-N 3.17Å
246	Q	98.5	Very high	97.7	Very high	7 Å²	7	42 Å²	42	3%	0.033	20%	0.196	C	C	.	.	H	α-helix	trans	-63.3	-43.2	179.9	-81.2	178.8	-56.1	0	0	112.9	E175 H176 T183 I242 S243 Q244 E248 E249 F250	E175-Q246 HydrophobicContact CG-CG 4.42Å; H176-Q246 PolarHBondContact O-NE2 3.46Å; T183-Q246 HydrophobicContact CG2-CB 3.94Å; T183-Q246 HydrophobicContact CG2-CG 4Å; I242-Q246 HydrophobicContact CD1-CB 3.81Å; I242-Q246 HydrophobicContact CG1-CB 3.46Å; I242-Q246 VanDerWaalsContact CG1-CB 3.46Å; I242-Q246 HydrophobicContact CG1-CG 4.33Å; S243-Q246 VanDerWaalsContact N-OE1 3.15Å; S243-Q246 PolarHBondContact O-N 2.91Å; S243-Q246 WeakPolarHBondContact OG-CB 3.09Å; S243-Q246 VanDerWaalsContact OG-CG 3.3Å; S243-Q246 WeakPolarHBondContact OG-CG 3.42Å; S243-Q246 PolarHBondContact OG-N 3.45Å; S243-Q246 PolarHBondContact OG-OE1 3.22Å; Q244-Q246 VanDerWaalsContact C-N 3.32Å; Q244-Q246 PolarHBondContact O-N 3.23Å; Q246-E248 VanDerWaalsContact C-N 3.32Å; Q246-E249 PolarHBondContact O-N 3.36Å; Q246-F250 WeakPolarHBondContact O-CD2 3.2Å
247	I	98.5	Very high	97.6	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-70.8	-29.6	177.6	-166.4	164.6	0	0	0	112.2	P137 M138 I172 I242 S243 Q244 E249 F250 R251	P137-I247 HydrophobicContact CB-CD1 3.72Å; P137-I247 HydrophobicContact CG-CD1 4.5Å; M138-I247 HydrophobicContact CB-CD1 4.29Å; M138-I247 HydrophobicContact CE-CD1 4.35Å; M138-I247 HydrophobicContact CE-CG1 4.1Å; I172-I247 HydrophobicContact CD1-CB 4.45Å; I172-I247 HydrophobicContact CD1-CD1 4.17Å; I172-I247 HydrophobicContact CD1-CG2 3.7Å; I242-I247 HydrophobicContact CG2-CB 4.33Å; S243-I247 PolarHBondContact O-N 3.23Å; Q244-I247 WeakPolarHBondContact O-CG2 3.44Å; Q244-I247 PolarHBondContact O-N 2.82Å; I247-E249 PolarHBondContact O-N 2.83Å; I247-F250 WeakPolarHBondContact O-CB 3.44Å; I247-F250 PolarHBondContact O-N 3.26Å; I247-F250 VanDerWaalsContact O-N 3.16Å; I247-R251 PolarHBondContact O-N 3.39Å
248	E	98.4	Very high	97.6	Very high	64 Å²	64	48.5 Å²	48.5	30%	0.299	23%	0.233	S	C	.	.	H	α-helix	trans	-64.3	-28.1	173.8	-70.6	-49.8	142.3	0	0	112.7	Q244 L245 Q246 F250 R251 R252	Q244-E248 HydrophobicContact CG-CG 4.4Å; Q244-E248 PolarHBondContact NE2-OE1 2.79Å; Q244-E248 WeakPolarHBondContact O-CG 3.37Å; Q244-E248 PolarHBondContact O-N 2.9Å; L245-E248 PolarHBondContact O-N 2.94Å; Q246-E248 VanDerWaalsContact C-N 3.32Å; E248-F250 VanDerWaalsContact C-N 3.34Å; E248-R251 PolarHBondContact O-N 2.89Å; E248-R251 IonicContact OE1-CZ 3.35Å; E248-R251 IonicContact OE1-NH1 2.89Å; E248-R251 PolarHBondContact OE1-NH1 2.98Å; E248-R252 WeakPolarHBondContact O-CG 3.39Å; E248-R252 PolarHBondContact O-N 2.84Å
249	E	98.4	Very high	97.5	Very high	27 Å²	27	48.2 Å²	48.2	13%	0.126	26%	0.255	C	S	.	.	H	α-helix	trans	-66.6	-35.8	173.5	-62.8	-52	139.5	0	0	112	L186 L245 Q246 I247 R252	L186-E249 HydrophobicContact CB-CB 4.27Å; L186-E249 HydrophobicContact CD1-CB 3.87Å; L245-E249 PolarHBondContact O-N 3.17Å; Q246-E249 PolarHBondContact O-N 3.36Å; I247-E249 PolarHBondContact O-N 2.83Å; E249-R252 VanDerWaalsContact CD-NH1 3.29Å; E249-R252 PolarHBondContact O-N 3.26Å; E249-R252 IonicContact OE1-CZ 3.35Å; E249-R252 IonicContact OE1-NH1 2.73Å; E249-R252 PolarHBondContact OE1-NH1 2.85Å; E249-R252 IonicContact OE1-NH2 3.76Å; E249-R252 IonicContact OE2-CZ 3.91Å; E249-R252 IonicContact OE2-NH1 3.08Å; E249-R252 PolarHBondContact OE2-NH1 3.29Å; E249-R252 VanDerWaalsContact OE2-NH1 3.08Å
250	F	98.6	Very high	97.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65	-41	171.7	-75.6	-91.9	0	0	0	111.8	I89 F117 W119 M138 V182 T183 L186 I242 Q246 I247 E248 R252 L253	I89-F250 HydrophobicContact CB-CE1 4.25Å; I89-F250 HydrophobicContact CG1-CD1 4.2Å; I89-F250 HydrophobicContact CG1-CE1 4.07Å; F117-F250 HydrophobicContact CB-CE1 4Å; F117-F250 AromaticContact CD1-CE1 3.74Å; F117-F250 HydrophobicContact CD1-CE1 3.74Å; F117-F250 AromaticContact CD1-CZ 3.66Å; F117-F250 HydrophobicContact CD1-CZ 3.66Å; F117-F250 HydrophobicContact CD2-CE1 4.35Å; F117-F250 HydrophobicContact CE1-CE1 4.28Å; F117-F250 AromaticContact CE1-CZ 3.83Å; F117-F250 HydrophobicContact CE1-CZ 3.83Å; F117-F250 AromaticContact CG-CE1 3.78Å; F117-F250 HydrophobicContact CG-CE1 3.78Å; F117-F250 HydrophobicContact CG-CZ 4.18Å; F117-F250 HydrophobicContact CZ-CZ 4.5Å; W119-F250 HydrophobicContact CD2-CB 3.99Å; W119-F250 HydrophobicContact CD2-CD1 4.08Å; W119-F250 HydrophobicContact CD2-CG 4.41Å; W119-F250 AromaticContact CE3-CD1 3.83Å; W119-F250 HydrophobicContact CE3-CD1 3.83Å; W119-F250 HydrophobicContact CG-CB 4.13Å; W119-F250 HydrophobicContact CH2-CD1 4.06Å; W119-F250 HydrophobicContact CZ2-CB 4.3Å; W119-F250 HydrophobicContact CZ2-CD1 4.28Å; W119-F250 AromaticContact CZ3-CD1 3.84Å; W119-F250 HydrophobicContact CZ3-CD1 3.84Å; W119-F250 HydrophobicContact CZ3-CE1 4.39Å; W119-F250 PolarHBondContact NE1-O 2.88Å; M138-F250 HydrophobicContact CE-CB 4.28Å; M138-F250 HydrophobicContact CE-CD1 4.04Å; M138-F250 HydrophobicContact CE-CD2 3.54Å; M138-F250 HydrophobicContact CE-CE1 4.22Å; M138-F250 HydrophobicContact CE-CE2 3.73Å; M138-F250 HydrophobicContact CE-CG 3.7Å; M138-F250 HydrophobicContact CE-CZ 4.07Å; V182-F250 HydrophobicContact CG1-CZ 4.48Å; T183-F250 HydrophobicContact CG2-CD2 4.34Å; T183-F250 HydrophobicContact CG2-CE2 3.69Å; L186-F250 HydrophobicContact CD1-CB 4.48Å; L186-F250 HydrophobicContact CD1-CD1 4.01Å; L186-F250 HydrophobicContact CD1-CD2 3.71Å; L186-F250 HydrophobicContact CD1-CE1 4.16Å; L186-F250 HydrophobicContact CD1-CE2 3.88Å; L186-F250 HydrophobicContact CD1-CG 3.8Å; L186-F250 HydrophobicContact CD1-CZ 4.1Å; I242-F250 HydrophobicContact CD1-CE2 4.37Å; Q246-F250 WeakPolarHBondContact O-CD2 3.2Å; I247-F250 WeakPolarHBondContact O-CB 3.44Å; I247-F250 PolarHBondContact O-N 3.26Å; I247-F250 VanDerWaalsContact O-N 3.16Å; E248-F250 VanDerWaalsContact C-N 3.34Å; F250-R252 PolarHBondContact O-N 2.74Å; F250-R252 VanDerWaalsContact O-N 3.12Å; F250-L253 HydrophobicContact CD1-CD1 4.21Å; F250-L253 VanDerWaalsContact O-CB 3.29Å; F250-L253 WeakPolarHBondContact O-CB 3.17Å; F250-L253 WeakPolarHBondContact O-CD1 3.4Å; F250-L253 VanDerWaalsContact O-CG 3.26Å; F250-L253 WeakPolarHBondContact O-CG 3.35Å; F250-L253 PolarHBondContact O-N 3.4Å; F250-L253 VanDerWaalsContact O-N 3.15Å
251	R	98.3	Very high	97	Very high	26 Å²	26	57 Å²	57	10%	0.098	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-5.2	-179.3	-66.6	173.8	179.7	156.3	0.2	114.5	G120 R121 E122 N123 I247 E248	G120-R251 PolarHBondContact O-NE 3.2Å; G120-R251 PolarHBondContact O-NH2 2.93Å; R121-R251 PolarHBondContact O-NE 2.94Å; E122-R251 PolarHBondContact O-NH2 3.18Å; N123-R251 PolarHBondContact OD1-NH1 3.39Å; N123-R251 PolarHBondContact OD1-NH2 3.1Å; I247-R251 PolarHBondContact O-N 3.39Å; E248-R251 PolarHBondContact O-N 2.89Å; E248-R251 IonicContact OE1-CZ 3.35Å; E248-R251 IonicContact OE1-NH1 2.89Å; E248-R251 PolarHBondContact OE1-NH1 2.98Å
252	R	97.8	Very high	96.7	Very high	125 Å²	125	58.4 Å²	58.4	47%	0.472	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-11.8	174.4	-72.1	171.4	-178.4	174	7.5	113.7	Q190 E248 E249 F250	Q190-R252 WeakPolarHBondContact CG-O 3.22Å; Q190-R252 PolarHBondContact NE2-O 3Å; E248-R252 WeakPolarHBondContact O-CG 3.39Å; E248-R252 PolarHBondContact O-N 2.84Å; E249-R252 VanDerWaalsContact CD-NH1 3.29Å; E249-R252 PolarHBondContact O-N 3.26Å; E249-R252 IonicContact OE1-CZ 3.35Å; E249-R252 IonicContact OE1-NH1 2.73Å; E249-R252 PolarHBondContact OE1-NH1 2.85Å; E249-R252 IonicContact OE1-NH2 3.76Å; E249-R252 IonicContact OE2-CZ 3.91Å; E249-R252 IonicContact OE2-NH1 3.08Å; E249-R252 PolarHBondContact OE2-NH1 3.29Å; E249-R252 VanDerWaalsContact OE2-NH1 3.08Å; F250-R252 PolarHBondContact O-N 2.74Å; F250-R252 VanDerWaalsContact O-N 3.12Å
253	L	98.5	Very high	96	Very high	1 Å²	1	63.7 Å²	63.7	1%	0.005	34%	0.337	C	S	.	.			trans	-65.4	159.3	-179.9	-63.6	170.7	0	0	0	111.1	I89 W119 L186 Q190 F250 L270	I89-L253 HydrophobicContact CD1-CD1 3.43Å; I89-L253 VanDerWaalsContact CD1-CD1 3.43Å; I89-L253 HydrophobicContact CD1-CD2 4.07Å; I89-L253 HydrophobicContact CD1-CG 4.38Å; I89-L253 HydrophobicContact CG1-CD1 3.36Å; W119-L253 HydrophobicContact CH2-CD1 3.76Å; W119-L253 HydrophobicContact CZ2-CB 4.42Å; W119-L253 HydrophobicContact CZ2-CD1 3.63Å; L186-L253 HydrophobicContact CB-CD2 4.23Å; L186-L253 HydrophobicContact CD2-CD1 4.44Å; L186-L253 HydrophobicContact CD2-CD2 4.45Å; Q190-L253 CarbonylContact O-C 3.35Å; F250-L253 HydrophobicContact CD1-CD1 4.21Å; F250-L253 VanDerWaalsContact O-CB 3.29Å; F250-L253 WeakPolarHBondContact O-CB 3.17Å; F250-L253 WeakPolarHBondContact O-CD1 3.4Å; F250-L253 VanDerWaalsContact O-CG 3.26Å; F250-L253 WeakPolarHBondContact O-CG 3.35Å; F250-L253 PolarHBondContact O-N 3.4Å; F250-L253 VanDerWaalsContact O-N 3.15Å; L253-L270 HydrophobicContact CB-CB 3.93Å; L253-L270 HydrophobicContact CB-CD2 4.11Å; L253-L270 HydrophobicContact CB-CG 4.5Å; L253-L270 HydrophobicContact CD1-CD2 4.4Å; L253-L270 PolarHBondContact O-N 3.46Å
254	R	97.6	Very high	95.4	Very high	67 Å²	67	72.3 Å²	72.3	25%	0.253	38%	0.375	S	S	.	.	B	Isolated β-bridge	trans	-128.6	143.6	-174	-57.7	-61.9	-178.7	164.8	-3.7	111.3	N84 Q190 Y191 K192 H256 D267 G268	N84-R254 PolarHBondContact ND2-O 3.39Å; Q190-R254 HydrophobicContact CG-CG 3.96Å; Q190-R254 WeakPolarHBondContact O-CB 3.35Å; Q190-R254 PolarHBondContact O-N 2.77Å; Y191-R254 HydrophobicContact CD1-CB 3.9Å; Y191-R254 HydrophobicContact CD1-CG 4.01Å; Y191-R254 HydrophobicContact CE1-CB 4.31Å; Y191-R254 HydrophobicContact CE1-CG 3.94Å; K192-R254 PolarHBondContact N-O 2.76Å; R254-H256 VanDerWaalsContact C-N 3.31Å; R254-D267 PolarHBondContact NH1-O 2.8Å; R254-G268 CarbonylContact C-O 3.6Å; R254-G268 WeakPolarHBondContact CA-O 3.19Å; R254-G268 WeakPolarHBondContact CB-O 3.33Å; R254-G268 WeakPolarHBondContact CD-O 3.34Å
255	T	95.9	Very high	94.6	Very high	58 Å²	58	73 Å²	73	36%	0.356	40%	0.401	S	S	.	.	S	Bend	trans	-81.3	-7.5	179.1	56.3	0	0	0	0	113.8	K192 G268 L270	K192-T255 VanDerWaalsContact CD-O 3.28Å; K192-T255 WeakPolarHBondContact CD-O 3.42Å; T255-G268 PolarHBondContact N-O 3.07Å; T255-G268 PolarHBondContact OG1-O 3.35Å; T255-L270 HydrophobicContact CG2-CB 3.87Å; T255-L270 HydrophobicContact CG2-CD1 3.79Å; T255-L270 HydrophobicContact CG2-CG 4.43Å
256	H	94.9	Very high	94	Very high	31 Å²	31	70 Å²	70	14%	0.144	39%	0.389	C	S	.	.	S	Bend	trans	-120.4	158.7	-171.7	57.6	-82.4	0	0	0	111.7	Y191 K192 R254 A260 L262 G268	Y191-H256 WeakPolarHBondContact CB-O 3.22Å; Y191-H256 AromaticContact CD1-NE2 3.85Å; Y191-H256 AromaticContact CE1-NE2 3.62Å; K192-H256 VanDerWaalsContact CB-C 3.48Å; K192-H256 PolarHBondContact N-O 3.11Å; R254-H256 VanDerWaalsContact C-N 3.31Å; H256-A260 HydrophobicContact CB-CB 4.34Å; H256-L262 HydrophobicContact CB-CD2 4.04Å; H256-L262 WeakPolarHBondContact ND1-CD2 3.45Å; H256-G268 PolarHBondContact CE1-O 2.83Å; H256-G268 PolarHBondContact ND1-O 3.16Å
257	V	96.7	Very high	93.7	Very high	81 Å²	81	73 Å²	73	49%	0.491	41%	0.405	S	S	.	.			trans	-69.6	148.4	173.3	-60.2	0	0	0	0	110.3	K192 G259 A260	K192-V257 HydrophobicContact CB-CG1 4.37Å; K192-V257 HydrophobicContact CG-CG1 4.46Å; V257-G259 PolarHBondContact O-N 3.23Å; V257-A260 HydrophobicContact CG2-CB 3.87Å; V257-A260 WeakPolarHBondContact O-CB 3.37Å; V257-A260 PolarHBondContact O-N 2.92Å; V257-A260 VanDerWaalsContact O-N 3.14Å
258	K	95.4	Very high	93.4	Very high	151 Å²	151	73.2 Å²	73.2	66%	0.657	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	122.1	-176.9	-172.2	175.1	-177	175.7	0	111.1	Y191	Y191-K258 HydrophobicContact CD1-CB 3.95Å; Y191-K258 HydrophobicContact CD1-CG 4.37Å; Y191-K258 HydrophobicContact CD2-CB 3.83Å; Y191-K258 HydrophobicContact CD2-CD 4.05Å; Y191-K258 HydrophobicContact CD2-CG 3.94Å; Y191-K258 HydrophobicContact CE1-CB 4.34Å; Y191-K258 HydrophobicContact CE1-CG 4.28Å; Y191-K258 HydrophobicContact CE2-CB 4.25Å; Y191-K258 HydrophobicContact CE2-CD 3.97Å; Y191-K258 HydrophobicContact CE2-CG 3.86Å; Y191-K258 HydrophobicContact CG-CB 3.66Å; Y191-K258 HydrophobicContact CG-CG 4.2Å
259	G	94	Very high	93.3	Very high	75 Å²	75	72.4 Å²	72.4	77%	0.773	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.9	0.8	178.6	0	0	0	0	0	115	V257	V257-G259 PolarHBondContact O-N 3.23Å
260	A	93.5	Very high	93.2	Very high	41 Å²	41	71.2 Å²	71.2	34%	0.339	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-62.9	143.8	171.2	0	0	0	0	0	111.7	H256 V257	H256-A260 HydrophobicContact CB-CB 4.34Å; V257-A260 HydrophobicContact CG2-CB 3.87Å; V257-A260 WeakPolarHBondContact O-CB 3.37Å; V257-A260 PolarHBondContact O-N 2.92Å; V257-A260 VanDerWaalsContact O-N 3.14Å
261	E	91.3	Very high	93	Very high	194 Å²	194	71.9 Å²	71.9	91%	0.907	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-72.2	128.7	165.7	-66.4	-175.1	171.5	0	0	108.7
262	L	89.9	Confident	92.9	Very high	80 Å²	80	72.2 Å²	72.2	42%	0.419	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-83.7	143.2	178.2	-61.4	179.1	0	0	0	110.1	H256	H256-L262 HydrophobicContact CB-CD2 4.04Å; H256-L262 WeakPolarHBondContact ND1-CD2 3.45Å
263	V	84.4	Confident	92.8	Very high	112 Å²	112	66.3 Å²	66.3	68%	0.679	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-59.8	140.4	167.7	-178.3	0	0	0	0	109	G265 C266	V263-G265 PolarHBondContact O-N 2.78Å; V263-C266 WeakPolarHBondContact O-CB 3.33Å; V263-C266 PolarHBondContact O-N 2.83Å
264	E	85.3	Confident	92.7	Very high	197 Å²	197	67.9 Å²	67.9	92%	0.921	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	125.9	179.4	-172.7	174.1	-172.6	0	0	110.8
265	G	83.2	Confident	92.7	Very high	84 Å²	84	65.3 Å²	65.3	87%	0.866	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.7	-16.9	-177.3	0	0	0	0	0	115	V263	V263-G265 PolarHBondContact O-N 2.78Å
266	C	85.8	Confident	92.6	Very high	49 Å²	49	67 Å²	67	33%	0.331	40%	0.396	S	S	.	.			trans	-88.1	122.2	176.6	-63.5	0	0	0	0	110.8	V263 G268	V263-C266 WeakPolarHBondContact O-CB 3.33Å; V263-C266 PolarHBondContact O-N 2.83Å; C266-G268 PolarHBondContact O-N 3.2Å
267	D	90.6	Very high	92.7	Very high	70 Å²	70	68.2 Å²	68.2	37%	0.374	41%	0.406	S	S	.	.			trans	-80.3	-6.6	173.9	65.1	13.3	0	0	0	113.4	R121 R254 I269	R121-D267 IonicContact CZ-OD1 3.89Å; R121-D267 IonicContact CZ-OD2 3.82Å; R121-D267 IonicContact NH1-OD1 2.79Å; R121-D267 IonicContact NH1-OD2 3.55Å; R121-D267 PolarHBondContact NH1-OD2 3.13Å; R121-D267 IonicContact NH2-OD1 3.83Å; R121-D267 PolarHBondContact NH2-OD1 2.92Å; R121-D267 IonicContact NH2-OD2 3.94Å; R121-D267 PolarHBondContact NH2-OD2 2.97Å; R254-D267 PolarHBondContact NH1-O 2.8Å; D267-I269 HydrophobicContact CB-CD1 4.38Å; D267-I269 HydrophobicContact CB-CG1 4.31Å; D267-I269 PolarHBondContact O-N 3.47Å; D267-I269 VanDerWaalsContact O-N 3.09Å; D267-I269 WeakPolarHBondContact OD1-CB 3.31Å; D267-I269 PolarHBondContact OD1-N 2.99Å
268	G	93.2	Very high	92.7	Very high	4 Å²	4	66.7 Å²	66.7	4%	0.041	39%	0.393	C	S	.	.			trans	61.3	14.4	179.8	0	0	0	0	0	114	R254 T255 H256 C266	R254-G268 CarbonylContact C-O 3.6Å; R254-G268 WeakPolarHBondContact CA-O 3.19Å; R254-G268 WeakPolarHBondContact CB-O 3.33Å; R254-G268 WeakPolarHBondContact CD-O 3.34Å; T255-G268 PolarHBondContact N-O 3.07Å; T255-G268 PolarHBondContact OG1-O 3.35Å; H256-G268 PolarHBondContact CE1-O 2.83Å; H256-G268 PolarHBondContact ND1-O 3.16Å; C266-G268 PolarHBondContact O-N 3.2Å
269	I	95.5	Very high	92.8	Very high	47 Å²	47	63.9 Å²	63.9	24%	0.241	39%	0.39	C	S	.	.	B	Isolated β-bridge	trans	-77	126.7	176.6	-63.5	174.6	0	0	0	108.5	R121 D267 G271	R121-I269 PolarHBondContact NH2-O 2.95Å; D267-I269 HydrophobicContact CB-CD1 4.38Å; D267-I269 HydrophobicContact CB-CG1 4.31Å; D267-I269 PolarHBondContact O-N 3.47Å; D267-I269 VanDerWaalsContact O-N 3.09Å; D267-I269 WeakPolarHBondContact OD1-CB 3.31Å; D267-I269 PolarHBondContact OD1-N 2.99Å; I269-G271 PolarHBondContact O-N 3.33Å; I269-G271 VanDerWaalsContact O-N 3.16Å
270	L	96.4	Very high	92.9	Very high	3 Å²	3	62.8 Å²	62.8	2%	0.016	37%	0.367	C	S	.	.			trans	-78.4	98.6	169.1	-179	63	0	0	0	108.8	W119 L253 T255 N273	W119-L270 HydrophobicContact CH2-CD2 3.55Å; W119-L270 HydrophobicContact CH2-CG 3.85Å; W119-L270 HydrophobicContact CZ2-CB 4.26Å; W119-L270 HydrophobicContact CZ2-CD2 3.63Å; W119-L270 HydrophobicContact CZ2-CG 3.51Å; W119-L270 WeakPolarHBondContact CZ2-O 3.41Å; W119-L270 PolarHBondContact NE1-O 3.26Å; L253-L270 HydrophobicContact CB-CB 3.93Å; L253-L270 HydrophobicContact CB-CD2 4.11Å; L253-L270 HydrophobicContact CB-CG 4.5Å; L253-L270 HydrophobicContact CD1-CD2 4.4Å; L253-L270 PolarHBondContact O-N 3.46Å; T255-L270 HydrophobicContact CG2-CB 3.87Å; T255-L270 HydrophobicContact CG2-CD1 3.79Å; T255-L270 HydrophobicContact CG2-CG 4.43Å; L270-N273 HydrophobicContact CD1-CB 4Å
271	G	94.8	Very high	93	Very high	13 Å²	13	63.6 Å²	63.6	13%	0.134	37%	0.37	C	S	.	.			trans	-166.3	158.8	176.1	0	0	0	0	0	109.7	I269 N273	I269-G271 PolarHBondContact O-N 3.33Å; I269-G271 VanDerWaalsContact O-N 3.16Å; G271-N273 PolarHBondContact O-N 2.72Å
272	D	95.9	Very high	93.2	Very high	33 Å²	33	59.9 Å²	59.9	18%	0.176	36%	0.356	C	S	.	.			trans	59.2	35.1	-166.2	-58.6	-46.4	0	0	0	112.6	W119 G120 R121 R125 F274	W119-D272 WeakPolarHBondContact O-CA 3.38Å; W119-D272 PolarHBondContact O-N 2.94Å; G120-D272 VanDerWaalsContact CA-OD1 3.26Å; G120-D272 WeakPolarHBondContact CA-OD1 3.45Å; R121-D272 WeakPolarHBondContact CD-OD2 3.33Å; R121-D272 VanDerWaalsContact CG-OD2 3.3Å; R121-D272 WeakPolarHBondContact CG-OD2 3.47Å; R121-D272 PolarHBondContact N-OD1 3.03Å; R121-D272 IonicContact NE-OD2 3.33Å; R125-D272 IonicContact CZ-OD1 3.97Å; R125-D272 IonicContact CZ-OD2 3.08Å; R125-D272 IonicContact NE-OD1 3.68Å; R125-D272 PolarHBondContact NE-OD1 2.99Å; R125-D272 IonicContact NE-OD2 2.75Å; R125-D272 IonicContact NH2-OD1 3.65Å; R125-D272 PolarHBondContact NH2-OD1 3.27Å; R125-D272 IonicContact NH2-OD2 3.47Å; R125-D272 PolarHBondContact NH2-OD2 2.6Å; D272-F274 HydrophobicContact CB-CD1 4.38Å; D272-F274 HydrophobicContact CB-CE1 3.87Å; D272-F274 HydrophobicContact CB-CZ 4.47Å; D272-F274 PolarHBondContact O-N 3.38Å; D272-F274 WeakPolarHBondContact OD1-CE1 3.43Å
273	N	96.9	Very high	93.5	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.005	34%	0.339	C	S	.	.			trans	-82.8	51.3	-179.1	68.9	-37.6	0	0	0	111.9	Y31 H87 F117 H118 W119 L270 G271	Y31-N273 HydrophobicContact CD2-CB 3.84Å; Y31-N273 HydrophobicContact CE2-CB 3.71Å; Y31-N273 HydrophobicContact CG-CB 4.4Å; Y31-N273 PolarHBondContact OH-O 3.2Å; H87-N273 WeakPolarHBondContact O-CB 3.29Å; H87-N273 PolarHBondContact O-ND2 3.22Å; F117-N273 PolarHBondContact O-ND2 3.15Å; H118-N273 PolarHBondContact ND1-O 3.09Å; W119-N273 WeakPolarHBondContact CZ3-ND2 3.32Å; W119-N273 PolarHBondContact N-OD1 3.15Å; W119-N273 PolarHBondContact O-OD1 3.28Å; W119-N273 VanDerWaalsContact O-OD1 3.13Å; L270-N273 HydrophobicContact CD1-CB 4Å; G271-N273 PolarHBondContact O-N 2.72Å
274	F	96.3	Very high	94.1	Very high	35 Å²	35	54.5 Å²	54.5	15%	0.154	33%	0.325	C	S	.	.			trans	-134	138.7	-174.9	60.5	-102.4	0	0	0	110.6	H118 R125 E128 D272	H118-F274 HydrophobicContact CB-CB 4.26Å; R125-F274 HydrophobicContact CB-CZ 4.35Å; R125-F274 VanDerWaalsContact NH2-CZ 3.32Å; E128-F274 HydrophobicContact CG-CB 3.47Å; E128-F274 VanDerWaalsContact CG-CB 3.47Å; D272-F274 HydrophobicContact CB-CD1 4.38Å; D272-F274 HydrophobicContact CB-CE1 3.87Å; D272-F274 HydrophobicContact CB-CZ 4.47Å; D272-F274 PolarHBondContact O-N 3.38Å; D272-F274 WeakPolarHBondContact OD1-CE1 3.43Å
275	R	96.2	Very high	94.7	Very high	13 Å²	13	45.6 Å²	45.6	5%	0.049	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-75.6	137.8	174.3	-164.5	-169.2	-167.8	-175.7	-0.4	110.1	W37 A44 S50 P51 E128	W37-R275 HydrophobicContact CE3-CG 4.33Å; W37-R275 HydrophobicContact CH2-CB 4.15Å; W37-R275 HydrophobicContact CH2-CG 4.08Å; W37-R275 HydrophobicContact CZ3-CB 4.06Å; W37-R275 HydrophobicContact CZ3-CG 3.61Å; A44-R275 PolarHBondContact O-NH2 2.95Å; A44-R275 VanDerWaalsContact O-NH2 3.14Å; S50-R275 WeakPolarHBondContact O-CD 3.44Å; S50-R275 PolarHBondContact O-NH1 2.89Å; P51-R275 VanDerWaalsContact CG-O 3.3Å; P51-R275 WeakPolarHBondContact CG-O 3.36Å; E128-R275 WeakPolarHBondContact OE1-CB 3.43Å; E128-R275 PolarHBondContact OE1-N 3.39Å
276	P	95	Very high	95.4	Very high	92 Å²	92	44.9 Å²	44.9	60%	0.597	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-59.2	154.9	171	-24.8	34.6	0	0	0	112.8	Q278	P276-Q278 PolarHBondContact O-N 3.3Å; P276-Q278 PolarHBondContact O-NE2 3.41Å
277	T	97	Very high	96	Very high	58 Å²	58	42.7 Å²	42.7	36%	0.356	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-61.8	135.9	175.7	57.4	0	0	0	0	112	P51 N53 T130	P51-T277 CarbonylContact O-C 3.59Å; P51-T277 WeakPolarHBondContact O-CA 3.49Å; N53-T277 HydrophobicContact CB-CG2 4.35Å; T130-T277 HydrophobicContact CG2-CG2 4.25Å
278	Q	97	Very high	96.3	Very high	49 Å²	49	39.7 Å²	39.7	23%	0.229	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-97	159.6	179	-54.6	-59.6	-53.8	0	0	110.6	Q49 P51 P276 L280	Q49-Q278 HydrophobicContact CB-CB 3.81Å; Q49-Q278 HydrophobicContact CB-CG 3.8Å; P51-Q278 WeakPolarHBondContact O-CB 3.18Å; P51-Q278 PolarHBondContact O-N 3.47Å; P276-Q278 PolarHBondContact O-N 3.3Å; P276-Q278 PolarHBondContact O-NE2 3.41Å; Q278-L280 PolarHBondContact O-N 3.06Å
279	P	96.7	Very high	96.3	Very high	91 Å²	91	40.7 Å²	40.7	59%	0.591	23%	0.228	S	C	*	.	P	Polyproline II helix	trans	-57.5	136.7	176.9	-24.3	35	0	0	0	111.9	S281 R283	P279-S281 PolarHBondContact O-N 3.23Å; P279-R283 PolarHBondContact O-NH2 3.41Å
280	L	96.5	Very high	95.9	Very high	52 Å²	52	48.3 Å²	48.3	27%	0.272	26%	0.263	S	S	.	.			trans	-66	-26	174.2	-175.7	63.3	0	0	0	112.1	I52 Q278 D282 R283 I285	I52-L280 HydrophobicContact CD1-CD1 3.67Å; I52-L280 HydrophobicContact CG2-CD1 4.43Å; Q278-L280 PolarHBondContact O-N 3.06Å; L280-D282 PolarHBondContact O-N 3.21Å; L280-R283 HydrophobicContact CD1-CB 3.97Å; L280-R283 HydrophobicContact CG-CB 4.38Å; L280-R283 WeakPolarHBondContact O-CB 3.12Å; L280-R283 PolarHBondContact O-N 2.89Å; L280-R283 PolarHBondContact O-NE 2.82Å; L280-I285 HydrophobicContact CD1-CD1 4.22Å; L280-I285 HydrophobicContact CD1-CG1 4.06Å
281	S	95.2	Very high	95.9	Very high	58 Å²	58	50.6 Å²	50.6	41%	0.406	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	-129.8	-173.7	-63.5	0	0	0	0	111.5	E47 P279	E47-S281 WeakPolarHBondContact O-CB 3.45Å; E47-S281 PolarHBondContact O-OG 2.88Å; E47-S281 PolarHBondContact OE2-OG 3.15Å; P279-S281 PolarHBondContact O-N 3.23Å
282	D	95.7	Very high	96	Very high	116 Å²	116	52.6 Å²	52.6	62%	0.62	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	4	-178.3	67.8	-13.8	0	0	0	113.9	Y48 L280	Y48-D282 PolarHBondContact OH-OD1 3.3Å; Y48-D282 PolarHBondContact OH-OD2 2.88Å; L280-D282 PolarHBondContact O-N 3.21Å
283	R	97.1	Very high	96	Very high	18 Å²	18	53.7 Å²	53.7	7%	0.068	29%	0.288	C	S	.	.			trans	-68.3	147.9	-176.8	-65.1	176.1	-77.3	-177.9	-5.3	112.5	Y48 Q49 E219 P279 L280	Y48-R283 VanDerWaalsContact CD1-CD 3.42Å; Y48-R283 HydrophobicContact CD1-CG 3.37Å; Y48-R283 HydrophobicContact CE1-CG 3.49Å; Y48-R283 VanDerWaalsContact CE1-CG 3.49Å; Y48-R283 HydrophobicContact CG-CG 4.38Å; Y48-R283 PolarHBondContact O-NH1 3.1Å; Y48-R283 VanDerWaalsContact O-NH1 3.16Å; Q49-R283 VanDerWaalsContact O-CZ 3.27Å; Q49-R283 PolarHBondContact O-NH1 3.05Å; Q49-R283 PolarHBondContact O-NH2 3.35Å; E219-R283 WeakPolarHBondContact O-CD 3.44Å; E219-R283 PolarHBondContact O-NH1 2.89Å; P279-R283 PolarHBondContact O-NH2 3.41Å; L280-R283 HydrophobicContact CD1-CB 3.97Å; L280-R283 HydrophobicContact CG-CB 4.38Å; L280-R283 WeakPolarHBondContact O-CB 3.12Å; L280-R283 PolarHBondContact O-N 2.89Å; L280-R283 PolarHBondContact O-NE 2.82Å
284	V	96.2	Very high	95.9	Very high	61 Å²	61	56.8 Å²	56.8	37%	0.37	31%	0.305	S	S	.	.			trans	-109.7	125.3	174.1	177.6	0	0	0	0	109.6	R60 R286	R60-V284 HydrophobicContact CB-CG1 4.35Å; R60-V284 HydrophobicContact CG-CG1 4Å; V284-R286 HydrophobicContact CG1-CG 4.44Å
285	I	98	Very high	95.9	Very high	10 Å²	10	58.1 Å²	58.1	5%	0.051	32%	0.315	C	S	.	.			trans	-82.1	122.3	169.3	-53.3	176.2	0	0	0	108	I52 L54 A59 R60 W216 L280	I52-I285 HydrophobicContact CD1-CD1 3.53Å; I52-I285 HydrophobicContact CD1-CG1 3.95Å; L54-I285 HydrophobicContact CB-CD1 4.3Å; L54-I285 HydrophobicContact CD1-CD1 4.28Å; L54-I285 HydrophobicContact CD1-CG2 3.93Å; L54-I285 HydrophobicContact CG-CD1 3.85Å; L54-I285 HydrophobicContact CG-CG2 4.32Å; A59-I285 WeakPolarHBondContact CA-O 3.49Å; A59-I285 HydrophobicContact CB-CB 4.46Å; A59-I285 HydrophobicContact CB-CG2 4.17Å; R60-I285 PolarHBondContact N-O 2.91Å; W216-I285 HydrophobicContact CB-CG2 3.87Å; W216-I285 HydrophobicContact CG-CG2 4.16Å; L280-I285 HydrophobicContact CD1-CD1 4.22Å; L280-I285 HydrophobicContact CD1-CG1 4.06Å
286	R	98.1	Very high	95.9	Very high	69 Å²	69	61.1 Å²	61.1	26%	0.26	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	150.5	174.6	-53.2	179.7	-69.4	146.2	-6.4	109.9	R60 D62 L65 W216 V217 V284	R60-R286 CarbonylContact O-C 3.59Å; R60-R286 VanDerWaalsContact O-CA 3.26Å; R60-R286 WeakPolarHBondContact O-CA 2.81Å; D62-R286 HydrophobicContact CB-CB 4.01Å; D62-R286 HydrophobicContact CB-CG 4.45Å; D62-R286 WeakPolarHBondContact OD2-CD 3.32Å; D62-R286 IonicContact OD2-CZ 3.68Å; D62-R286 IonicContact OD2-NE 3.89Å; D62-R286 IonicContact OD2-NH1 3.19Å; D62-R286 PolarHBondContact OD2-NH1 2.85Å; L65-R286 HydrophobicContact CD1-CB 4.17Å; W216-R286 CarbonylContact C-O 3.58Å; W216-R286 VanDerWaalsContact CA-O 3.23Å; W216-R286 WeakPolarHBondContact CA-O 3.23Å; V217-R286 HydrophobicContact CG1-CB 3.72Å; V217-R286 PolarHBondContact N-O 3.08Å; V217-R286 PolarHBondContact O-N 3.31Å; V284-R286 HydrophobicContact CG1-CG 4.44Å
287	A	98.1	Very high	95.9	Very high	3 Å²	3	58.9 Å²	58.9	3%	0.025	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	136	-180	0	0	0	0	0	110.7	A59 R60 Y61 D62 F289	A59-A287 HydrophobicContact CB-CB 4.33Å; R60-A287 PolarHBondContact O-N 3.06Å; Y61-A287 WeakPolarHBondContact CD2-O 3.38Å; D62-A287 PolarHBondContact N-O 2.98Å; A287-F289 HydrophobicContact CB-CD1 4.13Å; A287-F289 HydrophobicContact CB-CE1 3.98Å; A287-F289 HydrophobicContact CB-CZ 4.26Å; A287-F289 PolarHBondContact O-N 2.85Å
288	A	96.3	Very high	95.9	Very high	7 Å²	7	59 Å²	59	6%	0.058	31%	0.31	C	S	.	.	S	Bend	trans	-81.4	16.8	174.5	0	0	0	0	0	113.1	L65 L66 Y215	L65-A288 HydrophobicContact CB-CB 4.06Å; L65-A288 HydrophobicContact CD1-CB 4.09Å; L66-A288 HydrophobicContact CD2-CB 4.1Å; Y215-A288 HydrophobicContact CD1-CB 4.05Å; Y215-A288 HydrophobicContact CD2-CB 4.15Å; Y215-A288 HydrophobicContact CE1-CB 3.73Å; Y215-A288 HydrophobicContact CE2-CB 3.84Å; Y215-A288 HydrophobicContact CG-CB 4.25Å; Y215-A288 PolarHBondContact O-N 3.4Å
289	F	94.3	Very high	95.8	Very high	25 Å²	25	59.8 Å²	59.8	11%	0.11	32%	0.317	C	S	.	.			trans	-153.7	161.8	-176.1	62.9	-86.1	0	0	0	110.3	Y61 D214 Y215 W216 R237 A287	Y61-F289 WeakPolarHBondContact CD2-O 3.48Å; D214-F289 HydrophobicContact CB-CB 4.34Å; D214-F289 HydrophobicContact CB-CD1 3.57Å; D214-F289 HydrophobicContact CB-CE1 4.01Å; D214-F289 HydrophobicContact CB-CG 4Å; Y215-F289 WeakPolarHBondContact O-CE1 3.17Å; W216-F289 HydrophobicContact CD2-CE1 4.2Å; W216-F289 HydrophobicContact CD2-CZ 4.11Å; W216-F289 AromaticContact CE2-CE1 3.95Å; W216-F289 AromaticContact CE2-CZ 3.41Å; W216-F289 VanDerWaalsContact CE2-CZ 3.41Å; W216-F289 HydrophobicContact CG-CE1 4.38Å; W216-F289 HydrophobicContact CH2-CZ 4.38Å; W216-F289 HydrophobicContact CZ2-CE1 4.42Å; W216-F289 HydrophobicContact CZ2-CE2 4.44Å; W216-F289 AromaticContact CZ2-CZ 3.57Å; W216-F289 HydrophobicContact CZ2-CZ 3.57Å; W216-F289 AromaticContact NE1-CE1 3.89Å; W216-F289 AromaticContact NE1-CZ 3.4Å; R237-F289 HydrophobicContact CB-CE1 4.44Å; R237-F289 HydrophobicContact CG-CZ 4.31Å; A287-F289 HydrophobicContact CB-CD1 4.13Å; A287-F289 HydrophobicContact CB-CE1 3.98Å; A287-F289 HydrophobicContact CB-CZ 4.26Å; A287-F289 PolarHBondContact O-N 2.85Å
290	Q	87.2	Confident	95.7	Very high	208 Å²	208	57 Å²	57	97%	0.972	29%	0.292	S	S	*	.			trans	-88.8	0	178.2	-67.9	-176.3	-7.8	0	0	112.9	Y61	Y61-Q290 HydrophobicContact CD1-CG 3.67Å; Y61-Q290 HydrophobicContact CD2-CG 4.06Å; Y61-Q290 HydrophobicContact CE1-CG 3.8Å; Y61-Q290 HydrophobicContact CE2-CG 4.17Å; Y61-Q290 HydrophobicContact CG-CG 3.79Å

Retrieved 290 of 290 residues in 54.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).