G4VR43_SCHMA Loading...

Glutamate-gated chloride channel subunit 1

AlphaFold DB , UniProt , Accession G4VR43, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene GluCl, Length 511 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	Very low	42.9	Very low	250 Å²	250	174.9 Å²	174.9	100%	1.232	83%	0.834	S	S	*	*				0	112.5	0	-120.6	167.7	169.8	0	0	106.8
2	H	38.1	Very low	43.2	Very low	159 Å²	159	174 Å²	174	74%	0.736	83%	0.834	S	S	*	*			trans	-62.8	146.9	-171.6	-80.2	-93.6	0	0	0	113.2	H4	H2-H4 AromaticContact ND1-CD2 3.99Å; H2-H4 AromaticContact ND1-NE2 3.99Å
3	I	50.7	Low	43.6	Very low	176 Å²	176	172.8 Å²	172.8	90%	0.903	83%	0.834	S	S	*	*				-156.1	134.3	127.4	-87.9	138.9	0	0	0	107.8
4	H	46.9	Very low	43.1	Very low	155 Å²	155	169.2 Å²	169.2	72%	0.718	83%	0.833	S	S	*	*			trans	-83.9	151.4	-164.7	-100.8	-99.6	0	0	0	114.4	H2	H2-H4 AromaticContact ND1-CD2 3.99Å; H2-H4 AromaticContact ND1-NE2 3.99Å
5	N	38.2	Very low	43	Very low	152 Å²	152	165.2 Å²	165.2	81%	0.813	83%	0.825	S	S	*	*			trans	-55.7	138.2	155.4	-84.4	-25	0	0	0	112.1
6	H	43.4	Very low	43.1	Very low	177 Å²	177	164.6 Å²	164.6	82%	0.819	83%	0.825	S	S	*	*			trans	-163.6	124.8	144.3	-118.7	-79.6	0	0	0	109.9
7	Q	45.9	Very low	43	Very low	187 Å²	187	168.2 Å²	168.2	87%	0.874	83%	0.828	S	S	*	*			trans	149.1	98.7	131.9	-70.4	-128.1	-20.2	0	0	110.3
8	L	39.4	Very low	43.1	Very low	159 Å²	159	166.4 Å²	166.4	83%	0.832	82%	0.821	S	S	*	*			trans	-106.6	151	168.6	-138.8	147.5	0	0	0	105.4
9	I	43	Very low	43.1	Very low	139 Å²	139	168.4 Å²	168.4	71%	0.713	83%	0.825	S	S	*	*			trans	90.4	102.2	169.6	-51	156.5	0	0	0	114
10	Y	43	Very low	43	Very low	198 Å²	198	170.4 Å²	170.4	78%	0.776	82%	0.824	S	S	*	*			trans	-161.4	125.2	131.1	-97.5	-59.8	0	0	0	111.6
11	F	43.7	Very low	42.8	Very low	172 Å²	172	169 Å²	169	75%	0.754	82%	0.821	S	S	*	*			trans	70.1	87.5	156.6	-68.3	-71.2	0	0	0	120.5
12	I	45.9	Very low	42.9	Very low	164 Å²	164	161.7 Å²	161.7	84%	0.841	79%	0.794	S	S	*	*			trans	-63.1	123.8	136.8	-64.6	167.7	0	0	0	107.9
13	L	48.6	Very low	42.8	Very low	159 Å²	159	162.8 Å²	162.8	83%	0.832	80%	0.797	S	S	*	*			trans	-175.9	136.3	144.7	-98.7	163.2	0	0	0	109.5
14	C	37	Very low	42.1	Very low	122 Å²	122	160.5 Å²	160.5	82%	0.824	80%	0.795	S	S	*	*			trans	99.6	86.4	170	-136.2	0	0	0	0	117.3
15	P	40.6	Very low	41.7	Very low	109 Å²	109	157 Å²	157	71%	0.708	79%	0.793	S	S	*	*			trans	-88.3	169.1	154.5	36.8	-28.8	0	0	0	110.9
16	L	45	Very low	42	Very low	156 Å²	156	155.8 Å²	155.8	82%	0.817	79%	0.791	S	S	*	*			trans	88.6	76.5	170	-57.7	160.5	0	0	0	116.8
17	Y	42	Very low	42	Very low	225 Å²	225	154.8 Å²	154.8	88%	0.882	79%	0.791	S	S	*	*			trans	-137.9	95	132.9	-93.1	-82	0	0	0	109
18	I	44.9	Very low	42	Very low	137 Å²	137	153.2 Å²	153.2	70%	0.703	79%	0.788	S	S	*	*			trans	45.9	108.7	131.4	-56.6	172.7	0	0	0	116.1	Y20	I18-Y20 PolarHBondContact O-N 2.69Å
19	F	43.4	Very low	42.5	Very low	203 Å²	203	149.8 Å²	149.8	89%	0.89	78%	0.783	S	S	*	*			trans	-37.6	117.2	154.2	-85.3	-103.1	0	0	0	112
20	Y	40.9	Very low	43.6	Very low	209 Å²	209	145.8 Å²	145.8	82%	0.82	77%	0.767	S	S	*	*			trans	-124.4	105	150.7	-130.3	-93.7	0	0	0	107.4	I18 S22	I18-Y20 PolarHBondContact O-N 2.69Å; Y20-S22 VanDerWaalsContact C-N 3.32Å; Y20-S22 PolarHBondContact O-N 3.28Å
21	D	38.5	Very low	45.6	Very low	142 Å²	142	139.3 Å²	139.3	76%	0.759	75%	0.751	S	S	*	*			trans	-63.4	90.3	171	-174.2	12.4	0	0	0	108.6
22	S	41.3	Very low	47.7	Very low	95 Å²	95	135.8 Å²	135.8	66%	0.664	74%	0.739	S	S	*	*			trans	-97.7	96.8	168.3	-66.8	0	0	0	0	107.5	Y20 C24	Y20-S22 VanDerWaalsContact C-N 3.32Å; Y20-S22 PolarHBondContact O-N 3.28Å; S22-C24 PolarHBondContact O-N 3.23Å
23	K	36.8	Very low	49.7	Very low	183 Å²	183	132.2 Å²	132.2	80%	0.796	72%	0.715	S	S	*	*			trans	-39.4	116.4	161.3	-69.9	177.3	177.6	178.2	0	109.1	A25	K23-A25 PolarHBondContact O-N 2.76Å
24	C	35.4	Very low	51.7	Low	128 Å²	128	128.1 Å²	128.1	87%	0.865	69%	0.694	S	S	*	*			trans	-62.8	84.6	159.2	-93.8	0	0	0	0	108	S22 V26	S22-C24 PolarHBondContact O-N 3.23Å; C24-V26 VanDerWaalsContact C-N 3.28Å; C24-V26 PolarHBondContact O-N 3.47Å; C24-V26 VanDerWaalsContact O-N 3.11Å
25	A	39.2	Very low	54.3	Low	80 Å²	80	124.6 Å²	124.6	66%	0.661	67%	0.665	S	S	*	*			trans	-70.7	94.5	156	0	0	0	0	0	106.3	K23 L27	K23-A25 PolarHBondContact O-N 2.76Å; A25-L27 PolarHBondContact O-N 3.41Å
26	V	43.6	Very low	56.7	Low	128 Å²	128	119.4 Å²	119.4	78%	0.776	63%	0.632	S	S	*	*			trans	-62.4	96.7	157.7	178.3	0	0	0	0	104.9	C24 D28	C24-V26 VanDerWaalsContact C-N 3.28Å; C24-V26 PolarHBondContact O-N 3.47Å; C24-V26 VanDerWaalsContact O-N 3.11Å; V26-D28 VanDerWaalsContact C-N 3.35Å; V26-D28 PolarHBondContact O-N 3.22Å
27	L	43	Very low	58.9	Low	156 Å²	156	113.2 Å²	113.2	82%	0.817	60%	0.6	S	S	*	*			trans	-62.1	102.9	167.9	-96	151.4	0	0	0	106.7	A25 A29	A25-L27 PolarHBondContact O-N 3.41Å; L27-A29 PolarHBondContact O-N 3.19Å
28	D	47.4	Very low	61.3	Low	153 Å²	153	108.9 Å²	108.9	82%	0.818	59%	0.588	S	S	*	*			trans	-68.7	66.2	170.6	-152.5	13.1	0	0	0	108.6	V26 S30	V26-D28 VanDerWaalsContact C-N 3.35Å; V26-D28 PolarHBondContact O-N 3.22Å; D28-S30 VanDerWaalsContact C-N 3.3Å; D28-S30 PolarHBondContact O-N 3.35Å
29	A	50.1	Low	63.5	Low	87 Å²	87	105.9 Å²	105.9	72%	0.719	58%	0.576	S	S	*	*			trans	-82.7	83.4	171.1	0	0	0	0	0	107.1	L27 S31	L27-A29 PolarHBondContact O-N 3.19Å; A29-S31 PolarHBondContact O-N 3.46Å
30	S	65.8	Low	65.8	Low	55 Å²	55	97.1 Å²	97.1	39%	0.385	54%	0.538	S	S	.	.			trans	-50	125.1	170.8	49.2	0	0	0	0	108.9	D28 I32 E35	D28-S30 VanDerWaalsContact C-N 3.3Å; D28-S30 PolarHBondContact O-N 3.35Å; S30-I32 PolarHBondContact O-N 2.97Å; S30-E35 PolarHBondContact OG-OE1 3.27Å; S30-E35 VanDerWaalsContact OG-OE1 3.12Å
31	S	84.3	Confident	68.2	Low	63 Å²	63	88.7 Å²	88.7	44%	0.441	51%	0.506	S	S	.	.			trans	-60.4	142.6	175.8	-168.7	0	0	0	0	108.5	A29 R33 D34 E35	A29-S31 PolarHBondContact O-N 3.46Å; S31-R33 CarbonylContact O-C 3.56Å; S31-R33 PolarHBondContact O-N 3.36Å; S31-D34 VanDerWaalsContact CB-OD2 3.25Å; S31-D34 WeakPolarHBondContact CB-OD2 3.19Å; S31-D34 WeakPolarHBondContact O-CA 3.42Å; S31-D34 WeakPolarHBondContact O-CB 3.5Å; S31-D34 PolarHBondContact O-N 3.48Å; S31-E35 PolarHBondContact O-N 3.23Å; S31-E35 VanDerWaalsContact O-N 3.09Å
32	I	88.2	Confident	70.7	Confident	97 Å²	97	85.6 Å²	85.6	50%	0.497	50%	0.5	S	S	.	.	H	α-helix	trans	-49.1	-34.1	172.1	-65.1	169.9	0	0	0	110.6	S30 E35 I36 F102 Y105	S30-I32 PolarHBondContact O-N 2.97Å; I32-E35 PolarHBondContact O-N 3.05Å; I32-I36 HydrophobicContact CG2-CD1 4.01Å; I32-I36 VanDerWaalsContact O-CG1 3.26Å; I32-I36 WeakPolarHBondContact O-CG1 3.38Å; I32-I36 PolarHBondContact O-N 2.91Å; I32-F102 HydrophobicContact CG2-CD1 4.28Å; I32-Y105 HydrophobicContact CG2-CD2 3.99Å; I32-Y105 HydrophobicContact CG2-CG 4.43Å
33	R	88.2	Confident	72.8	Confident	89 Å²	89	88.4 Å²	88.4	34%	0.336	51%	0.508	S	S	.	.	H	α-helix	trans	-59.1	-45.6	173.6	179	-171.5	169.8	167.6	3.5	112.7	S31 I36 V37 I109 V110	S31-R33 CarbonylContact O-C 3.56Å; S31-R33 PolarHBondContact O-N 3.36Å; R33-I36 PolarHBondContact O-N 3.43Å; R33-V37 VanDerWaalsContact O-CG2 3.29Å; R33-V37 WeakPolarHBondContact O-CG2 3.41Å; R33-V37 PolarHBondContact O-N 3.48Å; R33-I109 HydrophobicContact CG-CD1 4.44Å; R33-I109 HydrophobicContact CG-CG1 4.49Å; R33-I109 HydrophobicContact CG-CG2 4.19Å; R33-V110 PolarHBondContact NH2-O 3.32Å
34	D	89.7	Confident	75.5	Confident	74 Å²	74	81 Å²	81	40%	0.396	48%	0.475	S	S	.	.	H	α-helix	trans	-70.1	-39.9	-177.5	-59.1	-34.5	0	0	0	109.9	S31 I36 V37 E38	S31-D34 VanDerWaalsContact CB-OD2 3.25Å; S31-D34 WeakPolarHBondContact CB-OD2 3.19Å; S31-D34 WeakPolarHBondContact O-CA 3.42Å; S31-D34 WeakPolarHBondContact O-CB 3.5Å; S31-D34 PolarHBondContact O-N 3.48Å; D34-I36 VanDerWaalsContact C-N 3.34Å; D34-I36 PolarHBondContact O-N 3.34Å; D34-V37 PolarHBondContact O-N 3.05Å; D34-E38 WeakPolarHBondContact O-CG 3.44Å; D34-E38 PolarHBondContact O-N 2.98Å
35	E	91.3	Very high	78.2	Confident	48 Å²	48	80 Å²	80	22%	0.224	46%	0.458	C	S	.	.	H	α-helix	trans	-60.1	-40.9	172.9	-65.5	-175.3	-162.9	0	0	112.7	S30 S31 I32 T39 K101 F102	S30-E35 PolarHBondContact OG-OE1 3.27Å; S30-E35 VanDerWaalsContact OG-OE1 3.12Å; S31-E35 PolarHBondContact O-N 3.23Å; S31-E35 VanDerWaalsContact O-N 3.09Å; I32-E35 PolarHBondContact O-N 3.05Å; E35-T39 VanDerWaalsContact O-CB 3.32Å; E35-T39 WeakPolarHBondContact O-CB 3.19Å; E35-T39 PolarHBondContact O-N 3.44Å; E35-T39 PolarHBondContact O-OG1 3.24Å; E35-K101 WeakPolarHBondContact OE2-CE 3.38Å; E35-K101 IonicContact OE2-NZ 3.33Å; E35-K101 PolarHBondContact OE2-NZ 3.34Å; E35-F102 HydrophobicContact CB-CE1 4.02Å; E35-F102 HydrophobicContact CB-CZ 4.04Å
36	I	91.4	Very high	80.6	Confident	0 Å²	0	78.8 Å²	78.8	0%	0	44%	0.444	C	S	.	.	H	α-helix	trans	-62.1	-48.7	174.7	-69.6	163.9	0	0	0	109.9	I32 R33 D34 T39 L40 W96 F102 Y105 I109	I32-I36 HydrophobicContact CG2-CD1 4.01Å; I32-I36 VanDerWaalsContact O-CG1 3.26Å; I32-I36 WeakPolarHBondContact O-CG1 3.38Å; I32-I36 PolarHBondContact O-N 2.91Å; R33-I36 PolarHBondContact O-N 3.43Å; D34-I36 VanDerWaalsContact C-N 3.34Å; D34-I36 PolarHBondContact O-N 3.34Å; I36-T39 PolarHBondContact O-N 3.27Å; I36-L40 HydrophobicContact CG2-CD1 3.58Å; I36-L40 HydrophobicContact CG2-CG 4.09Å; I36-L40 WeakPolarHBondContact O-CB 3.38Å; I36-L40 VanDerWaalsContact O-CG 3.24Å; I36-L40 WeakPolarHBondContact O-CG 3.49Å; I36-L40 PolarHBondContact O-N 3.04Å; I36-W96 HydrophobicContact CG2-CB 4.19Å; I36-W96 HydrophobicContact CG2-CD2 4Å; I36-W96 HydrophobicContact CG2-CE3 4.18Å; I36-W96 HydrophobicContact CG2-CG 4.03Å; I36-F102 HydrophobicContact CD1-CB 4.11Å; I36-F102 HydrophobicContact CD1-CD1 4.03Å; I36-F102 HydrophobicContact CD1-CG 4.11Å; I36-F102 HydrophobicContact CG1-CB 3.94Å; I36-F102 HydrophobicContact CG1-CD1 3.4Å; I36-F102 VanDerWaalsContact CG1-CD1 3.4Å; I36-F102 HydrophobicContact CG1-CD2 3.81Å; I36-F102 HydrophobicContact CG1-CE1 3.72Å; I36-F102 HydrophobicContact CG1-CE2 4.09Å; I36-F102 HydrophobicContact CG1-CG 3.44Å; I36-F102 VanDerWaalsContact CG1-CG 3.44Å; I36-F102 HydrophobicContact CG1-CZ 4.05Å; I36-Y105 HydrophobicContact CD1-CD1 3.58Å; I36-Y105 HydrophobicContact CD1-CD2 4.46Å; I36-Y105 HydrophobicContact CD1-CE1 4.16Å; I36-Y105 HydrophobicContact CD1-CG 3.75Å; I36-I109 HydrophobicContact CB-CD1 4.08Å; I36-I109 HydrophobicContact CD1-CD1 4.4Å; I36-I109 HydrophobicContact CG2-CD1 3.58Å
37	V	91.4	Very high	82.8	Confident	26 Å²	26	79.1 Å²	79.1	16%	0.158	44%	0.437	C	S	.	.	H	α-helix	trans	-60.3	-49.8	-179.6	169.9	0	0	0	0	110.1	R33 D34 T39 L40 F41 I109 F114	R33-V37 VanDerWaalsContact O-CG2 3.29Å; R33-V37 WeakPolarHBondContact O-CG2 3.41Å; R33-V37 PolarHBondContact O-N 3.48Å; D34-V37 PolarHBondContact O-N 3.05Å; V37-T39 VanDerWaalsContact C-N 3.33Å; V37-T39 PolarHBondContact O-N 3.48Å; V37-L40 PolarHBondContact O-N 2.87Å; V37-F41 HydrophobicContact CB-CD2 4.4Å; V37-F41 HydrophobicContact CG1-CD2 3.62Å; V37-F41 HydrophobicContact CG1-CE2 3.94Å; V37-F41 WeakPolarHBondContact O-CB 3.48Å; V37-F41 WeakPolarHBondContact O-CD2 3.49Å; V37-F41 PolarHBondContact O-N 3.37Å; V37-I109 HydrophobicContact CG2-CD1 4.37Å; V37-I109 HydrophobicContact CG2-CG2 4.1Å; V37-F114 HydrophobicContact CG1-CE1 4.13Å; V37-F114 HydrophobicContact CG2-CE1 4.21Å; V37-F114 HydrophobicContact CG2-CZ 3.95Å
38	E	91.5	Very high	85.2	Confident	134 Å²	134	72.8 Å²	72.8	63%	0.626	41%	0.405	S	S	*	.	H	α-helix	trans	-58.9	-43.8	178	-72.3	178.6	176.8	0	0	112.3	D34 A42	D34-E38 WeakPolarHBondContact O-CG 3.44Å; D34-E38 PolarHBondContact O-N 2.98Å; E38-A42 WeakPolarHBondContact O-CB 3.25Å; E38-A42 PolarHBondContact O-N 2.91Å; E38-A42 VanDerWaalsContact O-N 3.08Å
39	T	91.7	Very high	87.3	Confident	74 Å²	74	66.5 Å²	66.5	45%	0.454	37%	0.369	S	S	.	.	H	α-helix	trans	-64.6	-45.8	179.3	-54.2	0	0	0	0	111.9	E35 I36 V37 F102	E35-T39 VanDerWaalsContact O-CB 3.32Å; E35-T39 WeakPolarHBondContact O-CB 3.19Å; E35-T39 PolarHBondContact O-N 3.44Å; E35-T39 PolarHBondContact O-OG1 3.24Å; I36-T39 PolarHBondContact O-N 3.27Å; V37-T39 VanDerWaalsContact C-N 3.33Å; V37-T39 PolarHBondContact O-N 3.48Å; T39-F102 HydrophobicContact CG2-CE2 4.21Å
40	L	91.1	Very high	89.3	Confident	18 Å²	18	62.6 Å²	62.6	9%	0.094	34%	0.336	C	S	.	.	H	α-helix	trans	-69.1	-38	-178.1	-69.8	178.1	0	0	0	112.2	I36 V37 L94 W96 I99	I36-L40 HydrophobicContact CG2-CD1 3.58Å; I36-L40 HydrophobicContact CG2-CG 4.09Å; I36-L40 WeakPolarHBondContact O-CB 3.38Å; I36-L40 VanDerWaalsContact O-CG 3.24Å; I36-L40 WeakPolarHBondContact O-CG 3.49Å; I36-L40 PolarHBondContact O-N 3.04Å; V37-L40 PolarHBondContact O-N 2.87Å; L40-L94 HydrophobicContact CB-CD2 4.22Å; L40-W96 HydrophobicContact CD1-CB 4.48Å; L40-W96 HydrophobicContact CD1-CE3 3.74Å; L40-W96 HydrophobicContact CD1-CZ3 4.39Å; L40-W96 HydrophobicContact CD2-CB 4.42Å; L40-I99 HydrophobicContact CD2-CD1 4.28Å
41	F	92.1	Very high	90.3	Very high	33 Å²	33	60.9 Å²	60.9	15%	0.145	33%	0.328	C	S	.	.	H	α-helix	trans	-87.5	-12.5	-175.6	-74.4	-74.5	0	0	0	114.4	V37 N43 Y44 L94 F114 K117 I118	V37-F41 HydrophobicContact CB-CD2 4.4Å; V37-F41 HydrophobicContact CG1-CD2 3.62Å; V37-F41 HydrophobicContact CG1-CE2 3.94Å; V37-F41 WeakPolarHBondContact O-CB 3.48Å; V37-F41 WeakPolarHBondContact O-CD2 3.49Å; V37-F41 PolarHBondContact O-N 3.37Å; F41-N43 VanDerWaalsContact C-N 3.28Å; F41-N43 PolarHBondContact O-N 3.26Å; F41-Y44 HydrophobicContact CD1-CG 4.49Å; F41-Y44 PolarHBondContact O-N 3.46Å; F41-L94 HydrophobicContact CE1-CD2 4.31Å; F41-L94 HydrophobicContact CZ-CD2 4.31Å; F41-F114 AromaticContact CE2-CD1 3.79Å; F41-F114 HydrophobicContact CE2-CD1 3.79Å; F41-F114 AromaticContact CE2-CE1 3.61Å; F41-F114 HydrophobicContact CE2-CE1 3.61Å; F41-F114 HydrophobicContact CE2-CZ 4.35Å; F41-F114 AromaticContact CZ-CD1 3.68Å; F41-F114 HydrophobicContact CZ-CD1 3.68Å; F41-F114 HydrophobicContact CZ-CE1 4Å; F41-F114 HydrophobicContact CZ-CG 4.28Å; F41-K117 HydrophobicContact CD1-CB 3.88Å; F41-K117 HydrophobicContact CD1-CD 4.41Å; F41-K117 HydrophobicContact CE1-CB 3.55Å; F41-K117 HydrophobicContact CZ-CB 4.28Å; F41-I118 HydrophobicContact CE1-CG2 3.56Å; F41-I118 HydrophobicContact CZ-CG2 3.71Å
42	A	90.1	Very high	90.4	Very high	76 Å²	76	62.1 Å²	62.1	63%	0.628	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-39.5	-177.2	0	0	0	0	0	114.1	E38	E38-A42 WeakPolarHBondContact O-CB 3.25Å; E38-A42 PolarHBondContact O-N 2.91Å; E38-A42 VanDerWaalsContact O-N 3.08Å
43	N	87.4	Confident	90.2	Very high	154 Å²	154	65.5 Å²	65.5	82%	0.824	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.1	14.2	-179.3	-72.1	-26.9	0	0	0	113.1	F41 Q45	F41-N43 VanDerWaalsContact C-N 3.28Å; F41-N43 PolarHBondContact O-N 3.26Å; N43-Q45 PolarHBondContact O-N 3.47Å
44	Y	92.9	Very high	90	Very high	28 Å²	28	66.7 Å²	66.7	11%	0.11	36%	0.357	C	S	.	.			trans	-77.3	122.7	-175.4	-171.5	-89.5	0	0	0	111.4	F41 D91 R93 L94 K117 I118 W119	F41-Y44 HydrophobicContact CD1-CG 4.49Å; F41-Y44 PolarHBondContact O-N 3.46Å; Y44-D91 WeakPolarHBondContact CE2-OD2 3.28Å; Y44-D91 PolarHBondContact OH-OD2 3.49Å; Y44-R93 HydrophobicContact CD2-CB 3.99Å; Y44-R93 HydrophobicContact CE2-CB 3.92Å; Y44-R93 PolarHBondContact OH-NH2 3.03Å; Y44-R93 VanDerWaalsContact OH-NH2 3.14Å; Y44-L94 HydrophobicContact CD2-CD1 4.38Å; Y44-L94 HydrophobicContact CD2-CD2 3.75Å; Y44-L94 HydrophobicContact CD2-CG 3.97Å; Y44-L94 HydrophobicContact CE2-CD1 3.65Å; Y44-L94 HydrophobicContact CE2-CD2 3.86Å; Y44-L94 HydrophobicContact CE2-CG 3.58Å; Y44-L94 HydrophobicContact CG-CD2 4.41Å; Y44-K117 VanDerWaalsContact CD1-O 3.31Å; Y44-K117 WeakPolarHBondContact CD1-O 3.23Å; Y44-K117 WeakPolarHBondContact CE1-O 3.23Å; Y44-I118 HydrophobicContact CE1-CB 4.31Å; Y44-W119 PolarHBondContact OH-N 3.36Å; Y44-W119 VanDerWaalsContact OH-N 3.17Å
45	Q	91.2	Very high	89.8	Confident	108 Å²	108	73.8 Å²	73.8	51%	0.505	38%	0.378	S	S	.	.			trans	-98.3	104.3	176.3	-67.6	178.6	-16.3	0	0	110.4	N43 H47 V48 R93	N43-Q45 PolarHBondContact O-N 3.47Å; Q45-H47 VanDerWaalsContact C-N 3.28Å; Q45-H47 PolarHBondContact O-N 2.64Å; Q45-V48 HydrophobicContact CB-CB 4.35Å; Q45-V48 HydrophobicContact CB-CG2 3.98Å; Q45-V48 PolarHBondContact O-N 3.07Å; Q45-R93 PolarHBondContact O-NH1 2.93Å
46	S	90.7	Very high	89.8	Confident	53 Å²	53	76.2 Å²	76.2	37%	0.371	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-19.3	-176.8	57.4	0	0	0	0	115.2	W119	S46-W119 WeakPolarHBondContact O-CA 3.45Å; S46-W119 WeakPolarHBondContact O-CB 3.48Å
47	H	89.8	Confident	89.9	Confident	136 Å²	136	79.1 Å²	79.1	63%	0.63	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-12.3	178.3	58.9	-86	0	0	0	113.6	Q45	Q45-H47 VanDerWaalsContact C-N 3.28Å; Q45-H47 PolarHBondContact O-N 2.64Å
48	V	92.2	Very high	90.1	Very high	23 Å²	23	78.2 Å²	78.2	14%	0.139	41%	0.405	C	S	.	.	S	Bend	trans	-98.4	128.3	-177.6	179.2	0	0	0	0	109.8	Q45 E52 R93	Q45-V48 HydrophobicContact CB-CB 4.35Å; Q45-V48 HydrophobicContact CB-CG2 3.98Å; Q45-V48 PolarHBondContact O-N 3.07Å; V48-E52 HydrophobicContact CG1-CB 3.94Å; V48-E52 HydrophobicContact CG1-CG 4.47Å; V48-E52 WeakPolarHBondContact CG1-OE2 3.34Å; V48-R93 PolarHBondContact O-NH1 3.25Å; V48-R93 PolarHBondContact O-NH2 3.47Å
49	R	92.7	Very high	90.3	Very high	21 Å²	21	75.5 Å²	75.5	8%	0.079	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-71.4	146.8	-179.9	67.9	-180	178.2	98.4	4	111.4	G51 E52 N56 W119 Q190	R49-G51 PolarHBondContact O-N 2.92Å; R49-E52 HydrophobicContact CG-CB 3.75Å; R49-E52 HydrophobicContact CG-CG 4.33Å; R49-E52 PolarHBondContact N-OE2 3Å; R49-E52 WeakPolarHBondContact O-CB 3.4Å; R49-E52 PolarHBondContact O-N 3.25Å; R49-N56 PolarHBondContact NH1-O 3.43Å; R49-W119 HydrophobicContact CB-CD2 4.4Å; R49-W119 HydrophobicContact CB-CZ2 3.77Å; R49-Q190 PolarHBondContact NH1-O 3.09Å
50	P	91.8	Very high	90.5	Very high	4 Å²	4	72 Å²	72	3%	0.026	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	124.3	173.7	-18.5	28.4	0	0	0	111	T58 D91 W119	P50-T58 HydrophobicContact CB-CG2 4.18Å; P50-T58 HydrophobicContact CG-CG2 4.19Å; P50-T58 PolarHBondContact O-OG1 2.96Å; P50-D91 HydrophobicContact CB-CB 4.14Å; P50-D91 HydrophobicContact CG-CB 3.98Å; P50-W119 VanDerWaalsContact CD-CD2 3.5Å; P50-W119 HydrophobicContact CG-CD2 4.38Å; P50-W119 HydrophobicContact CG-CE3 3.78Å; P50-W119 HydrophobicContact CG-CZ3 4.1Å
51	G	87.2	Confident	90.9	Very high	20 Å²	20	73.3 Å²	73.3	21%	0.206	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.9	2	179.5	0	0	0	0	0	115.7	R49 L53 I54 R55 N56	R49-G51 PolarHBondContact O-N 2.92Å; G51-L53 PolarHBondContact O-N 2.96Å; G51-I54 CarbonylContact O-C 3.57Å; G51-I54 PolarHBondContact O-N 2.87Å; G51-I54 VanDerWaalsContact O-N 3.15Å; G51-R55 PolarHBondContact O-N 2.9Å; G51-N56 PolarHBondContact O-N 3.18Å; G51-N56 VanDerWaalsContact O-N 3.15Å
52	E	87	Confident	91.1	Very high	88 Å²	88	71.8 Å²	71.8	41%	0.411	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-45.2	177.5	-169.9	153	-166.1	0	0	113	V48 R49 I54 R55	V48-E52 HydrophobicContact CG1-CB 3.94Å; V48-E52 HydrophobicContact CG1-CG 4.47Å; V48-E52 WeakPolarHBondContact CG1-OE2 3.34Å; R49-E52 HydrophobicContact CG-CB 3.75Å; R49-E52 HydrophobicContact CG-CG 4.33Å; R49-E52 PolarHBondContact N-OE2 3Å; R49-E52 WeakPolarHBondContact O-CB 3.4Å; R49-E52 PolarHBondContact O-N 3.25Å; E52-I54 VanDerWaalsContact C-N 3.26Å; E52-I54 PolarHBondContact O-N 3.38Å; E52-R55 PolarHBondContact O-N 2.96Å
53	L	82.9	Confident	91.4	Very high	168 Å²	168	69.6 Å²	69.6	88%	0.88	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-32.1	177.2	-73.4	155.3	0	0	0	113	G51	G51-L53 PolarHBondContact O-N 2.96Å
54	I	84.8	Confident	91.9	Very high	114 Å²	114	62.3 Å²	62.3	59%	0.585	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-7.7	-176.8	-56.6	164.2	0	0	0	110.7	G51 E52 N56	G51-I54 CarbonylContact O-C 3.57Å; G51-I54 PolarHBondContact O-N 2.87Å; G51-I54 VanDerWaalsContact O-N 3.15Å; E52-I54 VanDerWaalsContact C-N 3.26Å; E52-I54 PolarHBondContact O-N 3.38Å; I54-N56 HydrophobicContact CG2-CB 4.49Å; I54-N56 PolarHBondContact O-N 3.07Å
55	R	83.9	Confident	92	Very high	224 Å²	224	62.3 Å²	62.3	85%	0.845	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	28.8	-171.8	-57.1	-176.2	177.5	-170.2	-1.1	113.9	G51 E52	G51-R55 PolarHBondContact O-N 2.9Å; E52-R55 PolarHBondContact O-N 2.96Å
56	N	92	Very high	92.2	Very high	99 Å²	99	57.4 Å²	57.4	53%	0.529	30%	0.296	S	S	.	.			trans	-89	148.3	172.7	-78.3	-4.4	0	0	0	110.6	R49 G51 I54	R49-N56 PolarHBondContact NH1-O 3.43Å; G51-N56 PolarHBondContact O-N 3.18Å; G51-N56 VanDerWaalsContact O-N 3.15Å; I54-N56 HydrophobicContact CG2-CB 4.49Å; I54-N56 PolarHBondContact O-N 3.07Å
57	T	93.3	Very high	92.3	Very high	61 Å²	61	57.4 Å²	57.4	37%	0.374	30%	0.296	S	S	.	.			trans	-72.5	130.4	171.8	-53.1	0	0	0	0	109.7	V59 L188 E189	T57-V59 PolarHBondContact O-N 2.87Å; T57-L188 WeakPolarHBondContact CG2-O 3.41Å; T57-E189 WeakPolarHBondContact CA-O 3.49Å; T57-E189 WeakPolarHBondContact CB-O 3.17Å; T57-E189 PolarHBondContact OG1-O 3.22Å
58	T	95.3	Very high	92.5	Very high	7 Å²	7	52.4 Å²	52.4	4%	0.043	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	111.1	173.6	-41	0	0	0	0	108.4	P50 W119 Q190 V191 S192	P50-T58 HydrophobicContact CB-CG2 4.18Å; P50-T58 HydrophobicContact CG-CG2 4.19Å; P50-T58 PolarHBondContact O-OG1 2.96Å; T58-W119 HydrophobicContact CG2-CH2 4.21Å; T58-W119 HydrophobicContact CG2-CZ3 4.16Å; T58-Q190 PolarHBondContact N-O 3.49Å; T58-Q190 PolarHBondContact OG1-O 3.28Å; T58-V191 WeakPolarHBondContact O-CA 3.27Å; T58-S192 PolarHBondContact O-N 3.11Å
59	V	96	Very high	92.6	Very high	76 Å²	76	51.5 Å²	51.5	46%	0.461	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	121.7	176.8	-177.8	0	0	0	0	109.2	T57 S192 V194	T57-V59 PolarHBondContact O-N 2.87Å; V59-S192 CarbonylContact C-O 3.6Å; V59-S192 WeakPolarHBondContact CA-O 3.35Å; V59-V194 HydrophobicContact CG1-CG1 4.22Å; V59-V194 HydrophobicContact CG1-CG2 3.62Å
60	V	97.2	Very high	92.6	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	116.6	176.3	-171.8	0	0	0	0	108.6	Q87 A88 W89 P121 V191 S192 F193 V194	V60-Q87 HydrophobicContact CG1-CB 3.93Å; V60-A88 CarbonylContact C-O 3.53Å; V60-A88 WeakPolarHBondContact CA-O 3.13Å; V60-W89 HydrophobicContact CB-CB 4.42Å; V60-W89 HydrophobicContact CG1-CB 4.38Å; V60-W89 HydrophobicContact CG1-CE3 4.42Å; V60-W89 HydrophobicContact CG2-CB 4.02Å; V60-P121 HydrophobicContact CG1-CG 4.22Å; V60-P121 HydrophobicContact CG2-CB 4.14Å; V60-P121 HydrophobicContact CG2-CG 4.37Å; V60-V191 HydrophobicContact CG2-CG1 4.08Å; V60-S192 PolarHBondContact N-O 3.47Å; V60-F193 HydrophobicContact CB-CD1 3.75Å; V60-F193 HydrophobicContact CB-CE1 3.97Å; V60-F193 HydrophobicContact CG1-CD1 4.44Å; V60-F193 HydrophobicContact CG1-CE1 4.45Å; V60-F193 HydrophobicContact CG2-CD1 4.12Å; V60-F193 HydrophobicContact CG2-CE1 3.96Å; V60-F193 WeakPolarHBondContact O-CA 3.36Å; V60-V194 PolarHBondContact O-N 2.94Å
61	T	97.6	Very high	92.6	Very high	47 Å²	47	56.8 Å²	56.8	29%	0.288	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	118.9	174.6	-58.8	0	0	0	0	109.9	Q87 A88 V194 R196	T61-Q87 CarbonylContact O-C 3.6Å; T61-Q87 WeakPolarHBondContact O-CA 3.28Å; T61-A88 PolarHBondContact N-O 3.49Å; T61-A88 PolarHBondContact O-N 3.17Å; T61-V194 CarbonylContact C-O 3.55Å; T61-V194 WeakPolarHBondContact CA-O 3.23Å; T61-R196 HydrophobicContact CG2-CB 3.89Å; T61-R196 HydrophobicContact CG2-CG 4.35Å
62	V	97.4	Very high	92.9	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	136.3	-179.6	-176.2	0	0	0	0	109.9	L85 R86 L123 F193 V194 W195 R196 L237	V62-L85 HydrophobicContact CG1-CD1 3.95Å; V62-R86 WeakPolarHBondContact CA-O 3.34Å; V62-L123 HydrophobicContact CG1-CD1 4.09Å; V62-L123 HydrophobicContact CG2-CD1 3.86Å; V62-F193 HydrophobicContact CG2-CB 4.28Å; V62-F193 HydrophobicContact CG2-CG 4.42Å; V62-V194 PolarHBondContact N-O 2.84Å; V62-W195 HydrophobicContact CG1-CZ3 4.16Å; V62-R196 PolarHBondContact O-N 3.21Å; V62-L237 HydrophobicContact CB-CD1 4.08Å; V62-L237 HydrophobicContact CG2-CD1 4.22Å
63	Y	96.9	Very high	93.2	Very high	30 Å²	30	55.1 Å²	55.1	12%	0.118	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	150.5	170.9	58.6	-73.8	0	0	0	110.9	R86 L152 R196 P200	Y63-R86 HydrophobicContact CD1-CB 3.92Å; Y63-R86 HydrophobicContact CD2-CB 3.91Å; Y63-R86 HydrophobicContact CD2-CG 4.46Å; Y63-R86 HydrophobicContact CE1-CB 3.56Å; Y63-R86 HydrophobicContact CE2-CB 3.6Å; Y63-R86 HydrophobicContact CE2-CG 3.96Å; Y63-R86 HydrophobicContact CG-CB 4.06Å; Y63-R86 VanDerWaalsContact CZ-CD 3.46Å; Y63-R86 PolarHBondContact N-O 3.27Å; Y63-R86 WeakPolarHBondContact O-CB 3.27Å; Y63-R86 PolarHBondContact O-N 3.29Å; Y63-L152 HydrophobicContact CE1-CD1 4.35Å; Y63-L152 WeakPolarHBondContact OH-CD1 3.46Å; Y63-R196 HydrophobicContact CD1-CB 4.39Å; Y63-R196 HydrophobicContact CG-CB 4.3Å; Y63-P200 CarbonylContact C-O 3.59Å; Y63-P200 VanDerWaalsContact CA-O 3.3Å; Y63-P200 WeakPolarHBondContact CA-O 3.31Å
64	I	96.8	Very high	93.7	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	139	-167.7	-61	176.9	0	0	0	109.4	V66 M83 L84 L85 M179 I181 W195 P200 V201 T202	I64-V66 HydrophobicContact CG2-CG2 4.24Å; I64-M83 HydrophobicContact CD1-SD 4.34Å; I64-M83 HydrophobicContact CG2-CB 3.89Å; I64-M83 HydrophobicContact CG2-CG 4.23Å; I64-M83 HydrophobicContact CG2-SD 3.6Å; I64-L84 WeakPolarHBondContact CA-O 3.42Å; I64-L85 HydrophobicContact CD1-CD1 4.33Å; I64-L85 HydrophobicContact CG1-CD1 3.99Å; I64-M179 HydrophobicContact CD1-SD 3.46Å; I64-M179 WeakPolarHBondContact CD1-SD 3.48Å; I64-I181 HydrophobicContact CD1-CD1 3.66Å; I64-W195 HydrophobicContact CD1-CH2 3.88Å; I64-W195 HydrophobicContact CD1-CZ3 3.98Å; I64-W195 HydrophobicContact CG1-CZ3 4.19Å; I64-P200 PolarHBondContact N-O 3.42Å; I64-V201 HydrophobicContact CB-CG2 4.42Å; I64-V201 WeakPolarHBondContact O-CA 3.49Å; I64-T202 PolarHBondContact O-N 2.93Å; I64-T202 PolarHBondContact O-OG1 3.16Å
65	S	95.6	Very high	94	Very high	29 Å²	29	49.8 Å²	49.8	20%	0.203	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	107.9	168.5	-168.3	0	0	0	0	109.2	M83 L84 T202	S65-M83 CarbonylContact O-C 3.55Å; S65-M83 VanDerWaalsContact O-CA 3.29Å; S65-M83 WeakPolarHBondContact O-CA 3.29Å; S65-L84 PolarHBondContact N-O 3.03Å; S65-L84 PolarHBondContact O-N 3Å; S65-T202 VanDerWaalsContact CA-OG1 3.22Å; S65-T202 WeakPolarHBondContact CA-OG1 3.42Å; S65-T202 VanDerWaalsContact CB-OG1 3.24Å; S65-T202 WeakPolarHBondContact CB-OG1 3.49Å; S65-T202 PolarHBondContact OG-OG1 3.45Å
66	V	95.3	Very high	94.5	Very high	4 Å²	4	43 Å²	43	2%	0.024	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	129.3	178.7	-179.6	0	0	0	0	107.9	I64 I69 I81 V201 T202 L203 P204 F241	I64-V66 HydrophobicContact CG2-CG2 4.24Å; V66-I69 HydrophobicContact CG1-CG1 4.35Å; V66-I81 HydrophobicContact CB-CD1 4.41Å; V66-I81 HydrophobicContact CG1-CD1 3.8Å; V66-I81 HydrophobicContact CG1-CG1 3.82Å; V66-I81 HydrophobicContact CG2-CD1 3.73Å; V66-I81 HydrophobicContact CG2-CG1 4.5Å; V66-V201 HydrophobicContact CG2-CG1 4.01Å; V66-T202 PolarHBondContact N-O 2.88Å; V66-L203 HydrophobicContact CB-CD2 3.76Å; V66-L203 HydrophobicContact CG1-CD2 4.15Å; V66-L203 HydrophobicContact CG2-CD2 3.78Å; V66-P204 WeakPolarHBondContact O-CD 3.23Å; V66-F241 HydrophobicContact CG2-CE1 4.13Å; V66-F241 HydrophobicContact CG2-CZ 4.34Å
67	S	93.5	Very high	94.6	Very high	54 Å²	54	39.9 Å²	39.9	38%	0.378	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-42.9	173.5	-58.1	0	0	0	0	111	D82	S67-D82 PolarHBondContact N-O 3.39Å
68	A	93.7	Very high	94.7	Very high	31 Å²	31	37.7 Å²	37.7	26%	0.256	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	152.9	177.2	0	0	0	0	0	110.9	D82	A68-D82 HydrophobicContact CB-CB 4.47Å; A68-D82 PolarHBondContact N-O 3.37Å; A68-D82 PolarHBondContact O-N 3.46Å
69	I	94	Very high	94.7	Very high	4 Å²	4	37.4 Å²	37.4	2%	0.021	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	96.7	160.6	-64.1	174.1	0	0	0	105.4	V66 V72 T80 I81 L207 I209 F241 L243	V66-I69 HydrophobicContact CG1-CG1 4.35Å; I69-V72 HydrophobicContact CG2-CG2 3.99Å; I69-T80 CarbonylContact C-O 3.18Å; I69-I81 HydrophobicContact CG1-CD1 4.2Å; I69-I81 HydrophobicContact CG1-CG1 4.06Å; I69-L207 HydrophobicContact CD1-CD2 4.23Å; I69-L207 HydrophobicContact CG1-CD2 4.47Å; I69-I209 HydrophobicContact CB-CD1 3.91Å; I69-I209 HydrophobicContact CB-CG1 4.09Å; I69-I209 HydrophobicContact CD1-CD1 3.75Å; I69-I209 HydrophobicContact CG1-CD1 4.34Å; I69-I209 HydrophobicContact CG2-CD1 4.17Å; I69-I209 HydrophobicContact CG2-CG2 4.25Å; I69-F241 HydrophobicContact CD1-CD1 4.34Å; I69-L243 HydrophobicContact CD1-CD2 4.3Å
70	T	91.8	Very high	94.7	Very high	82 Å²	82	34.9 Å²	34.9	50%	0.503	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	-41.2	-165.7	-53.3	0	0	0	0	112.4	T80	T70-T80 PolarHBondContact N-O 3.42Å
71	S	91.8	Very high	94.6	Very high	53 Å²	53	34.9 Å²	34.9	37%	0.371	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	140.7	-179.5	64.9	0	0	0	0	111	Y79 T80	S71-Y79 CarbonylContact O-C 3.56Å; S71-Y79 WeakPolarHBondContact O-CA 3.22Å; S71-T80 PolarHBondContact O-N 2.92Å
72	V	93.7	Very high	94.5	Very high	22 Å²	22	34 Å²	34	13%	0.133	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	105.2	169.6	-177.7	0	0	0	0	107	I69 V74 M165 I209 F212 L243	I69-V72 HydrophobicContact CG2-CG2 3.99Å; V72-V74 PolarHBondContact O-N 3.26Å; V72-M165 HydrophobicContact CG1-CE 3.54Å; V72-I209 HydrophobicContact CG2-CG2 3.96Å; V72-F212 HydrophobicContact CB-CD2 4.03Å; V72-F212 HydrophobicContact CB-CE2 3.67Å; V72-F212 HydrophobicContact CB-CZ 4.44Å; V72-F212 HydrophobicContact CG1-CD2 4.25Å; V72-F212 HydrophobicContact CG1-CE2 3.54Å; V72-F212 HydrophobicContact CG1-CZ 3.81Å; V72-F212 HydrophobicContact CG2-CD2 4.18Å; V72-F212 HydrophobicContact CG2-CE2 4.27Å; V72-L243 HydrophobicContact CG1-CD1 4.46Å; V72-L243 HydrophobicContact CG2-CD1 3.92Å
73	D	93.7	Very high	94.5	Very high	51 Å²	51	34 Å²	34	27%	0.273	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	98	-179	-173.4	-18.2	0	0	0	109.7	R75 N76 M77 E78	D73-R75 VanDerWaalsContact C-N 3.27Å; D73-R75 PolarHBondContact O-N 2.84Å; D73-R75 WeakPolarHBondContact OD1-CA 3.23Å; D73-R75 WeakPolarHBondContact OD1-CB 3.36Å; D73-R75 PolarHBondContact OD1-N 3.04Å; D73-N76 HydrophobicContact CB-CB 4.46Å; D73-N76 PolarHBondContact OD1-N 2.81Å; D73-N76 PolarHBondContact OD2-ND2 3.36Å; D73-M77 PolarHBondContact O-N 3.44Å; D73-M77 VanDerWaalsContact O-N 3.08Å; D73-E78 HydrophobicContact CB-CG 3.94Å; D73-E78 PolarHBondContact N-O 3.42Å; D73-E78 PolarHBondContact O-N 3.35Å; D73-E78 VanDerWaalsContact O-N 3.09Å
74	V	92.7	Very high	94.5	Very high	10 Å²	10	34.6 Å²	34.6	6%	0.061	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-32.1	178.1	-171.8	0	0	0	0	111.1	V72 M165 L167 F212 L301 P302	V72-V74 PolarHBondContact O-N 3.26Å; V74-M165 HydrophobicContact CB-SD 4.22Å; V74-M165 HydrophobicContact CG1-SD 4.03Å; V74-M165 HydrophobicContact CG2-SD 4.09Å; V74-L167 HydrophobicContact CG1-CD1 3.97Å; V74-L167 HydrophobicContact CG1-CD2 3.9Å; V74-F212 HydrophobicContact CG2-CZ 4.29Å; V74-L301 HydrophobicContact CG1-CD2 4.21Å; V74-P302 HydrophobicContact CG1-CG 4.38Å; V74-P302 VanDerWaalsContact O-CD 3.26Å; V74-P302 WeakPolarHBondContact O-CD 3.43Å; V74-P302 WeakPolarHBondContact O-CG 3.43Å
75	R	92.4	Very high	94.5	Very high	160 Å²	160	34.6 Å²	34.6	60%	0.604	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-40.4	-178.4	-179.3	-177.7	171.3	-168.3	-1.8	111.8	D73	D73-R75 VanDerWaalsContact C-N 3.27Å; D73-R75 PolarHBondContact O-N 2.84Å; D73-R75 WeakPolarHBondContact OD1-CA 3.23Å; D73-R75 WeakPolarHBondContact OD1-CB 3.36Å; D73-R75 PolarHBondContact OD1-N 3.04Å
76	N	93.8	Very high	94.5	Very high	82 Å²	82	36.6 Å²	36.6	44%	0.439	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	3.6	-179.6	-69.1	-43	0	0	0	113.9	D73 E78 K129	D73-N76 HydrophobicContact CB-CB 4.46Å; D73-N76 PolarHBondContact OD1-N 2.81Å; D73-N76 PolarHBondContact OD2-ND2 3.36Å; N76-E78 VanDerWaalsContact C-N 3.33Å; N76-E78 HydrophobicContact CB-CG 3.78Å; N76-E78 PolarHBondContact O-N 3.41Å; N76-K129 PolarHBondContact O-NZ 2.92Å
77	M	94.3	Very high	94.7	Very high	34 Å²	34	36.6 Å²	36.6	17%	0.167	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	50.8	-178.2	-61.3	-63	-162.1	0	0	111.4	D73 C163 M165 L167 P302 V304	D73-M77 PolarHBondContact O-N 3.44Å; D73-M77 VanDerWaalsContact O-N 3.08Å; M77-C163 CarbonylContact C-O 3.52Å; M77-C163 WeakPolarHBondContact CB-O 3.4Å; M77-C163 PolarHBondContact O-N 3.45Å; M77-M165 HydrophobicContact SD-CB 3.81Å; M77-M165 HydrophobicContact SD-CG 4.17Å; M77-M165 HydrophobicContact SD-SD 4.4Å; M77-L167 HydrophobicContact CE-CD1 4.02Å; M77-P302 HydrophobicContact CE-CB 3.91Å; M77-P302 HydrophobicContact CE-CG 3.48Å; M77-P302 VanDerWaalsContact CE-CG 3.48Å; M77-P302 HydrophobicContact SD-CG 4.22Å; M77-V304 HydrophobicContact CE-CG1 4.23Å
78	E	95.5	Very high	94.8	Very high	14 Å²	14	34.5 Å²	34.5	7%	0.065	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	158.2	-177	63.6	-169.8	-152.9	0	0	112.6	D73 N76 K129 R160 M161	D73-E78 HydrophobicContact CB-CG 3.94Å; D73-E78 PolarHBondContact N-O 3.42Å; D73-E78 PolarHBondContact O-N 3.35Å; D73-E78 VanDerWaalsContact O-N 3.09Å; N76-E78 VanDerWaalsContact C-N 3.33Å; N76-E78 HydrophobicContact CB-CG 3.78Å; N76-E78 PolarHBondContact O-N 3.41Å; E78-K129 HydrophobicContact CB-CD 4.35Å; E78-K129 WeakPolarHBondContact OE2-CD 3.31Å; E78-K129 IonicContact OE2-NZ 3.32Å; E78-K129 PolarHBondContact OE2-NZ 3.16Å; E78-R160 HydrophobicContact CB-CG 4.4Å; E78-R160 HydrophobicContact CG-CG 4.38Å; E78-R160 VanDerWaalsContact OE1-CD 3.31Å; E78-R160 WeakPolarHBondContact OE1-CD 3.28Å; E78-R160 IonicContact OE1-CZ 3.72Å; E78-R160 IonicContact OE1-NE 3.76Å; E78-R160 IonicContact OE1-NH1 2.77Å; E78-R160 PolarHBondContact OE1-NH1 3.09Å; E78-R160 IonicContact OE2-NH1 3.35Å; E78-R160 PolarHBondContact OE2-NH1 3.37Å; E78-M161 CarbonylContact C-O 3.55Å; E78-M161 WeakPolarHBondContact CA-O 3.4Å; E78-M161 VanDerWaalsContact CB-O 3.29Å; E78-M161 WeakPolarHBondContact CB-O 3.31Å
79	Y	95.3	Very high	95	Very high	1 Å²	1	33.3 Å²	33.3	0%	0.004	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	148.1	172.8	72.8	-76.8	0	0	0	110	S71 I81 R160 M161 C163 C177 D178 F241	S71-Y79 CarbonylContact O-C 3.56Å; S71-Y79 WeakPolarHBondContact O-CA 3.22Å; Y79-I81 HydrophobicContact CD2-CB 4.49Å; Y79-I81 HydrophobicContact CE2-CB 4.33Å; Y79-R160 WeakPolarHBondContact O-CA 3.19Å; Y79-M161 HydrophobicContact CD1-CB 4.05Å; Y79-M161 HydrophobicContact CD2-CE 4.34Å; Y79-M161 HydrophobicContact CE1-CB 3.49Å; Y79-M161 VanDerWaalsContact CE1-CB 3.49Å; Y79-M161 HydrophobicContact CE1-CE 4.28Å; Y79-M161 HydrophobicContact CE2-CE 3.37Å; Y79-M161 PolarHBondContact N-O 2.93Å; Y79-M161 PolarHBondContact O-N 3.4Å; Y79-M161 WeakPolarHBondContact OH-CE 3.13Å; Y79-M161 PolarHBondContact OH-SD 3.19Å; Y79-M161 VanDerWaalsContact OH-SD 3.37Å; Y79-C163 HydrophobicContact CD1-CB 3.65Å; Y79-C163 HydrophobicContact CE1-CB 4.03Å; Y79-C177 HydrophobicContact CD1-CB 3.91Å; Y79-C177 HydrophobicContact CE1-CB 3.72Å; Y79-C177 HydrophobicContact CG-CB 4.47Å; Y79-D178 VanDerWaalsContact OH-C 3.29Å; Y79-D178 PolarHBondContact OH-O 3.24Å; Y79-F241 HydrophobicContact CE2-CD2 4.44Å
80	T	96	Very high	95.1	Very high	23 Å²	23	39.2 Å²	39.2	14%	0.141	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	124.9	178.8	-59.1	0	0	0	0	109.3	I69 T70 S71 T158 M159	I69-T80 CarbonylContact C-O 3.18Å; T70-T80 PolarHBondContact N-O 3.42Å; S71-T80 PolarHBondContact O-N 2.92Å; T80-T158 HydrophobicContact CG2-CG2 3.52Å; T80-M159 WeakPolarHBondContact CA-O 3.43Å
81	I	95.5	Very high	95.2	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	137.3	178.3	-161	169.1	0	0	0	110.6	V66 I69 Y79 M83 T158 M159 M161 M179 F241	V66-I81 HydrophobicContact CB-CD1 4.41Å; V66-I81 HydrophobicContact CG1-CD1 3.8Å; V66-I81 HydrophobicContact CG1-CG1 3.82Å; V66-I81 HydrophobicContact CG2-CD1 3.73Å; V66-I81 HydrophobicContact CG2-CG1 4.5Å; I69-I81 HydrophobicContact CG1-CD1 4.2Å; I69-I81 HydrophobicContact CG1-CG1 4.06Å; Y79-I81 HydrophobicContact CD2-CB 4.49Å; Y79-I81 HydrophobicContact CE2-CB 4.33Å; I81-M83 HydrophobicContact CG2-CE 4.33Å; I81-M83 HydrophobicContact CG2-SD 4.1Å; I81-T158 CarbonylContact O-C 3.5Å; I81-T158 WeakPolarHBondContact O-CA 3.22Å; I81-M159 HydrophobicContact CG2-CB 4.19Å; I81-M159 PolarHBondContact N-O 3.44Å; I81-M159 PolarHBondContact O-N 3.22Å; I81-M161 HydrophobicContact CB-CE 4.18Å; I81-M161 HydrophobicContact CG2-CE 3.24Å; I81-M179 HydrophobicContact CD1-CE 3.91Å; I81-M179 HydrophobicContact CG2-CE 3.92Å; I81-F241 HydrophobicContact CD1-CE1 4.06Å; I81-F241 HydrophobicContact CD1-CE2 4.25Å; I81-F241 HydrophobicContact CD1-CZ 3.7Å
82	D	95.7	Very high	95.3	Very high	28 Å²	28	35.7 Å²	35.7	15%	0.15	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	123.4	169.1	-74.5	-9.6	0	0	0	108.2	S67 A68 T158	S67-D82 PolarHBondContact N-O 3.39Å; A68-D82 HydrophobicContact CB-CB 4.47Å; A68-D82 PolarHBondContact N-O 3.37Å; A68-D82 PolarHBondContact O-N 3.46Å; D82-T158 WeakPolarHBondContact OD1-CB 3.25Å; D82-T158 WeakPolarHBondContact OD1-CG2 3.28Å; D82-T158 PolarHBondContact OD1-OG1 2.86Å
83	M	96	Very high	95.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	157.4	-175.5	64.1	-174.9	174.2	0	0	113.5	I64 S65 I81 F125 I157 M159 M179	I64-M83 HydrophobicContact CD1-SD 4.34Å; I64-M83 HydrophobicContact CG2-CB 3.89Å; I64-M83 HydrophobicContact CG2-CG 4.23Å; I64-M83 HydrophobicContact CG2-SD 3.6Å; S65-M83 CarbonylContact O-C 3.55Å; S65-M83 VanDerWaalsContact O-CA 3.29Å; S65-M83 WeakPolarHBondContact O-CA 3.29Å; I81-M83 HydrophobicContact CG2-CE 4.33Å; I81-M83 HydrophobicContact CG2-SD 4.1Å; M83-F125 HydrophobicContact CE-CD1 4.44Å; M83-F125 HydrophobicContact CE-CE1 3.45Å; M83-F125 VanDerWaalsContact CE-CE1 3.45Å; M83-F125 HydrophobicContact CE-CE2 4.27Å; M83-F125 HydrophobicContact CE-CZ 3.35Å; M83-I157 HydrophobicContact CE-CD1 3.58Å; M83-I157 HydrophobicContact CE-CG1 4.02Å; M83-I157 HydrophobicContact CG-CD1 4.38Å; M83-I157 HydrophobicContact CG-CG1 3.84Å; M83-I157 PolarHBondContact N-O 3.22Å; M83-I157 PolarHBondContact O-N 2.76Å; M83-M159 HydrophobicContact CE-CB 4.26Å; M83-M179 HydrophobicContact CE-CE 3.71Å; M83-M179 HydrophobicContact CE-SD 4.03Å; M83-M179 HydrophobicContact SD-CE 3.37Å; M83-M179 WeakPolarHBondContact SD-CE 3.34Å; M83-M179 HydrophobicContact SD-SD 3.96Å
84	L	96.7	Very high	95.2	Very high	44 Å²	44	35.8 Å²	35.8	23%	0.23	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	107.8	163.8	-59	174.5	0	0	0	108	I64 S65 Q155 K156	I64-L84 WeakPolarHBondContact CA-O 3.42Å; S65-L84 PolarHBondContact N-O 3.03Å; S65-L84 PolarHBondContact O-N 3Å; L84-Q155 WeakPolarHBondContact CA-O 3.44Å; L84-K156 HydrophobicContact CD2-CB 3.64Å; L84-K156 HydrophobicContact CD2-CD 4.49Å; L84-K156 HydrophobicContact CD2-CG 3.89Å
85	L	97.1	Very high	95.2	Very high	1 Å²	1	36 Å²	36	1%	0.005	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	126.5	171	177	67	0	0	0	108.5	V62 I64 Q87 L123 F125 S154 Q155 I157	V62-L85 HydrophobicContact CG1-CD1 3.95Å; I64-L85 HydrophobicContact CD1-CD1 4.33Å; I64-L85 HydrophobicContact CG1-CD1 3.99Å; L85-Q87 HydrophobicContact CG-CG 4.4Å; L85-L123 HydrophobicContact CD1-CD1 4.23Å; L85-L123 HydrophobicContact CD2-CD1 4.28Å; L85-L123 HydrophobicContact CD2-CD2 3.85Å; L85-F125 HydrophobicContact CD1-CZ 4.5Å; L85-F125 HydrophobicContact CD2-CE2 4.27Å; L85-F125 HydrophobicContact CD2-CZ 4.08Å; L85-S154 WeakPolarHBondContact O-CA 3.46Å; L85-Q155 HydrophobicContact CB-CG 4.06Å; L85-Q155 HydrophobicContact CD2-CG 4.43Å; L85-Q155 PolarHBondContact N-O 3.35Å; L85-Q155 PolarHBondContact O-N 3.46Å; L85-I157 HydrophobicContact CB-CD1 3.96Å; L85-I157 HydrophobicContact CB-CG1 4.4Å; L85-I157 HydrophobicContact CD2-CD1 4.15Å
86	R	97.2	Very high	95.3	Very high	70 Å²	70	28.4 Å²	28.4	26%	0.264	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	134.8	178	-67.5	173.9	-178.7	145.2	-4.1	110.6	V62 Y63 L152 Y153 S154	V62-R86 WeakPolarHBondContact CA-O 3.34Å; Y63-R86 HydrophobicContact CD1-CB 3.92Å; Y63-R86 HydrophobicContact CD2-CB 3.91Å; Y63-R86 HydrophobicContact CD2-CG 4.46Å; Y63-R86 HydrophobicContact CE1-CB 3.56Å; Y63-R86 HydrophobicContact CE2-CB 3.6Å; Y63-R86 HydrophobicContact CE2-CG 3.96Å; Y63-R86 HydrophobicContact CG-CB 4.06Å; Y63-R86 VanDerWaalsContact CZ-CD 3.46Å; Y63-R86 PolarHBondContact N-O 3.27Å; Y63-R86 WeakPolarHBondContact O-CB 3.27Å; Y63-R86 PolarHBondContact O-N 3.29Å; R86-L152 HydrophobicContact CB-CD1 4.26Å; R86-Y153 CarbonylContact C-O 3.6Å; R86-Y153 WeakPolarHBondContact CA-O 3.37Å; R86-S154 VanDerWaalsContact CG-OG 3.29Å; R86-S154 WeakPolarHBondContact CG-OG 3.3Å
87	Q	97.6	Very high	95.2	Very high	5 Å²	5	26.9 Å²	26.9	2%	0.023	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	126.9	-178.4	-57.3	-179.6	64.1	0	0	107.2	V60 T61 L85 W89 L123 Y153	V60-Q87 HydrophobicContact CG1-CB 3.93Å; T61-Q87 CarbonylContact O-C 3.6Å; T61-Q87 WeakPolarHBondContact O-CA 3.28Å; L85-Q87 HydrophobicContact CG-CG 4.4Å; Q87-W89 HydrophobicContact CB-CZ3 4.38Å; Q87-L123 HydrophobicContact CG-CD1 4.02Å; Q87-Y153 PolarHBondContact N-O 2.94Å; Q87-Y153 PolarHBondContact O-N 3.43Å
88	A	97.3	Very high	94.9	Very high	10 Å²	10	32.6 Å²	32.6	8%	0.083	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	127.1	178.2	0	0	0	0	0	109.9	V60 T61 I151	V60-A88 CarbonylContact C-O 3.53Å; V60-A88 WeakPolarHBondContact CA-O 3.13Å; T61-A88 PolarHBondContact N-O 3.49Å; T61-A88 PolarHBondContact O-N 3.17Å; A88-I151 VanDerWaalsContact CA-O 3.26Å; A88-I151 WeakPolarHBondContact CA-O 3.4Å
89	W	96.7	Very high	94.6	Very high	5 Å²	5	34.7 Å²	34.7	2%	0.019	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	165.9	175.9	72	96.1	0	0	0	110.4	V60 Q87 I118 W119 L120 P121 I151	V60-W89 HydrophobicContact CB-CB 4.42Å; V60-W89 HydrophobicContact CG1-CB 4.38Å; V60-W89 HydrophobicContact CG1-CE3 4.42Å; V60-W89 HydrophobicContact CG2-CB 4.02Å; Q87-W89 HydrophobicContact CB-CZ3 4.38Å; W89-I118 HydrophobicContact CH2-CD1 4.33Å; W89-I118 HydrophobicContact CZ2-CD1 4.09Å; W89-W119 WeakPolarHBondContact CZ2-O 3.44Å; W89-W119 AromaticContact NE1-CE3 4Å; W89-L120 HydrophobicContact CH2-CD2 3.71Å; W89-L120 HydrophobicContact CZ2-CD2 4.23Å; W89-P121 HydrophobicContact CE3-CG 4.38Å; W89-P121 HydrophobicContact CZ3-CG 4.35Å; W89-I151 HydrophobicContact CD2-CB 4.19Å; W89-I151 HydrophobicContact CH2-CB 4.23Å; W89-I151 HydrophobicContact CH2-CG2 3.57Å; W89-I151 HydrophobicContact CZ2-CB 3.9Å; W89-I151 HydrophobicContact CZ2-CD1 3.99Å; W89-I151 HydrophobicContact CZ2-CG2 3.55Å; W89-I151 HydrophobicContact CZ3-CG2 4.11Å; W89-I151 PolarHBondContact N-O 3.36Å; W89-I151 VanDerWaalsContact N-O 3.09Å; W89-I151 PolarHBondContact O-N 3.12Å
90	Y	95.7	Very high	94.3	Very high	129 Å²	129	43 Å²	43	51%	0.506	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	125.7	179.2	179.9	-100.1	0	0	0	110.3	P92 N148	Y90-P92 HydrophobicContact CE1-CB 3.8Å; Y90-P92 HydrophobicContact CE1-CG 4.1Å; Y90-N148 WeakPolarHBondContact CE2-O 3.1Å
91	D	95	Very high	94	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.229	C	C	.	.			trans	-124.5	102.8	171.6	-168.4	-11.8	0	0	0	110.2	Y44 P50 R93 L94 G149 I151	Y44-D91 WeakPolarHBondContact CE2-OD2 3.28Å; Y44-D91 PolarHBondContact OH-OD2 3.49Å; P50-D91 HydrophobicContact CB-CB 4.14Å; P50-D91 HydrophobicContact CG-CB 3.98Å; D91-R93 PolarHBondContact O-N 3.35Å; D91-R93 VanDerWaalsContact O-N 3.11Å; D91-R93 WeakPolarHBondContact OD1-CB 3.43Å; D91-R93 WeakPolarHBondContact OD1-CG 3.31Å; D91-R93 IonicContact OD1-CZ 3.87Å; D91-R93 PolarHBondContact OD1-N 3.3Å; D91-R93 VanDerWaalsContact OD1-N 3.13Å; D91-R93 IonicContact OD1-NE 2.79Å; D91-R93 PolarHBondContact OD1-NE 2.96Å; D91-R93 IonicContact OD1-NH2 3.43Å; D91-R93 IonicContact OD2-CZ 3.68Å; D91-R93 IonicContact OD2-NE 2.87Å; D91-R93 PolarHBondContact OD2-NE 2.68Å; D91-R93 IonicContact OD2-NH2 3.61Å; D91-R93 PolarHBondContact OD2-NH2 3.22Å; D91-L94 HydrophobicContact CB-CD1 4.41Å; D91-L94 PolarHBondContact O-N 3.02Å; D91-G149 PolarHBondContact N-O 3.12Å; D91-I151 HydrophobicContact CB-CD1 3.77Å
92	P	92.8	Very high	93.7	Very high	61 Å²	61	49 Å²	49	40%	0.396	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-63.6	-20	-177.7	25.6	-33.5	0	0	0	113.1	Y90 L94 A95	Y90-P92 HydrophobicContact CE1-CB 3.8Å; Y90-P92 HydrophobicContact CE1-CG 4.1Å; P92-L94 PolarHBondContact O-N 3.47Å; P92-A95 PolarHBondContact O-N 2.98Å
93	R	92.5	Very high	93.3	Very high	74 Å²	74	54.2 Å²	54.2	28%	0.279	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-69.6	-18.5	177.5	-57.8	172.1	-67	179.9	1.9	112.5	Y44 Q45 V48 D91	Y44-R93 HydrophobicContact CD2-CB 3.99Å; Y44-R93 HydrophobicContact CE2-CB 3.92Å; Y44-R93 PolarHBondContact OH-NH2 3.03Å; Y44-R93 VanDerWaalsContact OH-NH2 3.14Å; Q45-R93 PolarHBondContact O-NH1 2.93Å; V48-R93 PolarHBondContact O-NH1 3.25Å; V48-R93 PolarHBondContact O-NH2 3.47Å; D91-R93 PolarHBondContact O-N 3.35Å; D91-R93 VanDerWaalsContact O-N 3.11Å; D91-R93 WeakPolarHBondContact OD1-CB 3.43Å; D91-R93 WeakPolarHBondContact OD1-CG 3.31Å; D91-R93 IonicContact OD1-CZ 3.87Å; D91-R93 PolarHBondContact OD1-N 3.3Å; D91-R93 VanDerWaalsContact OD1-N 3.13Å; D91-R93 IonicContact OD1-NE 2.79Å; D91-R93 PolarHBondContact OD1-NE 2.96Å; D91-R93 IonicContact OD1-NH2 3.43Å; D91-R93 IonicContact OD2-CZ 3.68Å; D91-R93 IonicContact OD2-NE 2.87Å; D91-R93 PolarHBondContact OD2-NE 2.68Å; D91-R93 IonicContact OD2-NH2 3.61Å; D91-R93 PolarHBondContact OD2-NH2 3.22Å
94	L	93.4	Very high	92.9	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-109.3	12.1	-179.2	-65.1	171.2	0	0	0	112	L40 F41 Y44 D91 P92 I118 I145 I151	L40-L94 HydrophobicContact CB-CD2 4.22Å; F41-L94 HydrophobicContact CE1-CD2 4.31Å; F41-L94 HydrophobicContact CZ-CD2 4.31Å; Y44-L94 HydrophobicContact CD2-CD1 4.38Å; Y44-L94 HydrophobicContact CD2-CD2 3.75Å; Y44-L94 HydrophobicContact CD2-CG 3.97Å; Y44-L94 HydrophobicContact CE2-CD1 3.65Å; Y44-L94 HydrophobicContact CE2-CD2 3.86Å; Y44-L94 HydrophobicContact CE2-CG 3.58Å; Y44-L94 HydrophobicContact CG-CD2 4.41Å; D91-L94 HydrophobicContact CB-CD1 4.41Å; D91-L94 PolarHBondContact O-N 3.02Å; P92-L94 PolarHBondContact O-N 3.47Å; L94-I118 HydrophobicContact CD1-CB 4.36Å; L94-I118 HydrophobicContact CD1-CG2 3.79Å; L94-I145 HydrophobicContact CB-CG2 4.19Å; L94-I145 HydrophobicContact CD1-CD1 4.41Å; L94-I151 HydrophobicContact CB-CD1 4.46Å; L94-I151 HydrophobicContact CD1-CD1 3.44Å; L94-I151 VanDerWaalsContact CD1-CD1 3.44Å
95	A	93.5	Very high	92.5	Very high	15 Å²	15	63.1 Å²	63.1	12%	0.124	29%	0.289	C	S	.	.			trans	-84.2	133.7	171.3	0	0	0	0	0	110.5	P92 N148	P92-A95 PolarHBondContact O-N 2.98Å; A95-N148 WeakPolarHBondContact CB-O 3.12Å
96	W	93.2	Very high	92.2	Very high	1 Å²	1	68.3 Å²	68.3	0%	0.004	32%	0.322	C	S	.	.			trans	-120.5	-1.6	177	65.9	85.1	0	0	0	113.2	I36 L40 Q98 I99 F102 Y105 I109 I145 Q146 P147	I36-W96 HydrophobicContact CG2-CB 4.19Å; I36-W96 HydrophobicContact CG2-CD2 4Å; I36-W96 HydrophobicContact CG2-CE3 4.18Å; I36-W96 HydrophobicContact CG2-CG 4.03Å; L40-W96 HydrophobicContact CD1-CB 4.48Å; L40-W96 HydrophobicContact CD1-CE3 3.74Å; L40-W96 HydrophobicContact CD1-CZ3 4.39Å; L40-W96 HydrophobicContact CD2-CB 4.42Å; W96-Q98 PolarHBondContact O-N 3.1Å; W96-I99 HydrophobicContact CB-CD1 4.21Å; W96-I99 PolarHBondContact O-N 3.34Å; W96-I99 VanDerWaalsContact O-N 3.11Å; W96-F102 HydrophobicContact CB-CB 4.3Å; W96-F102 HydrophobicContact CG-CB 4.43Å; W96-Y105 HydrophobicContact CZ2-CD1 4.24Å; W96-Y105 AromaticContact NE1-CD1 3.8Å; W96-Y105 PolarHBondContact NE1-O 3.36Å; W96-I109 HydrophobicContact CH2-CB 4.38Å; W96-I109 HydrophobicContact CH2-CD1 3.95Å; W96-I109 HydrophobicContact CH2-CG1 3.82Å; W96-I109 HydrophobicContact CZ2-CD1 4.15Å; W96-I109 HydrophobicContact CZ2-CG1 4.07Å; W96-I109 HydrophobicContact CZ3-CD1 4.22Å; W96-I109 HydrophobicContact CZ3-CG1 4.48Å; W96-I145 HydrophobicContact CH2-CB 4.49Å; W96-I145 HydrophobicContact CH2-CG2 4.34Å; W96-I145 WeakPolarHBondContact CH2-O 3.5Å; W96-I145 HydrophobicContact CZ3-CB 4.16Å; W96-I145 HydrophobicContact CZ3-CG2 3.64Å; W96-Q146 VanDerWaalsContact CH2-C 3.46Å; W96-Q146 WeakPolarHBondContact CZ3-O 3.21Å; W96-P147 HydrophobicContact CD2-CB 4.46Å; W96-P147 VanDerWaalsContact CE2-CA 3.47Å; W96-P147 HydrophobicContact CH2-CG 4.42Å; W96-P147 VanDerWaalsContact CZ2-CA 3.42Å; W96-P147 HydrophobicContact CZ2-CB 3.85Å; W96-P147 HydrophobicContact CZ2-CG 3.66Å; W96-P147 PolarHBondContact N-O 2.88Å; W96-P147 VanDerWaalsContact N-O 3.1Å
97	D	91.5	Very high	91.9	Very high	50 Å²	50	72 Å²	72	27%	0.267	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-28.1	176.2	65.9	-16.1	0	0	0	113.1	P147	D97-P147 HydrophobicContact CB-CB 4.34Å; D97-P147 WeakPolarHBondContact CB-O 3.43Å; D97-P147 PolarHBondContact N-O 3.48Å
98	Q	88	Confident	91.7	Very high	154 Å²	154	74.8 Å²	74.8	72%	0.72	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-13.6	174.9	-54.9	-48.9	-50.7	0	0	113.9	W96 E100	W96-Q98 PolarHBondContact O-N 3.1Å; Q98-E100 PolarHBondContact O-N 2.86Å
99	I	90.2	Very high	91.4	Very high	57 Å²	57	74.5 Å²	74.5	29%	0.292	35%	0.352	S	S	.	.	S	Bend	trans	-85.5	112.6	-179.7	-56.3	174.2	0	0	0	107.9	L40 W96 K101 F102 K103	L40-I99 HydrophobicContact CD2-CD1 4.28Å; W96-I99 HydrophobicContact CB-CD1 4.21Å; W96-I99 PolarHBondContact O-N 3.34Å; W96-I99 VanDerWaalsContact O-N 3.11Å; I99-K101 HydrophobicContact CG2-CB 4.21Å; I99-K101 PolarHBondContact O-N 2.91Å; I99-F102 HydrophobicContact CB-CD2 4.07Å; I99-F102 HydrophobicContact CD1-CD2 4.2Å; I99-F102 HydrophobicContact CG2-CD2 3.68Å; I99-F102 HydrophobicContact CG2-CE2 4.19Å; I99-F102 HydrophobicContact CG2-CG 4.5Å; I99-F102 CarbonylContact O-C 3.59Å; I99-F102 PolarHBondContact O-N 2.85Å; I99-K103 PolarHBondContact O-N 3.27Å
100	E	88.8	Confident	91.3	Very high	176 Å²	176	76.8 Å²	76.8	82%	0.822	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	-38.9	-175.5	-66.7	-173.3	165.5	0	0	113.1	Q98 F102	Q98-E100 PolarHBondContact O-N 2.86Å; E100-F102 VanDerWaalsContact C-N 3.28Å; E100-F102 PolarHBondContact O-N 3.03Å
101	K	88.9	Confident	91	Very high	143 Å²	143	71.6 Å²	71.6	62%	0.622	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-34	177.5	-171.5	179.4	173.8	-170.5	0	113.4	E35 I99	E35-K101 WeakPolarHBondContact OE2-CE 3.38Å; E35-K101 IonicContact OE2-NZ 3.33Å; E35-K101 PolarHBondContact OE2-NZ 3.34Å; I99-K101 HydrophobicContact CG2-CB 4.21Å; I99-K101 PolarHBondContact O-N 2.91Å
102	F	89.7	Confident	90.8	Very high	6 Å²	6	75.4 Å²	75.4	3%	0.026	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.7	1.7	-171.5	-53.5	-53.4	0	0	0	113.9	I32 E35 I36 T39 W96 I99 E100 H104 Y105	I32-F102 HydrophobicContact CG2-CD1 4.28Å; E35-F102 HydrophobicContact CB-CE1 4.02Å; E35-F102 HydrophobicContact CB-CZ 4.04Å; I36-F102 HydrophobicContact CD1-CB 4.11Å; I36-F102 HydrophobicContact CD1-CD1 4.03Å; I36-F102 HydrophobicContact CD1-CG 4.11Å; I36-F102 HydrophobicContact CG1-CB 3.94Å; I36-F102 HydrophobicContact CG1-CD1 3.4Å; I36-F102 VanDerWaalsContact CG1-CD1 3.4Å; I36-F102 HydrophobicContact CG1-CD2 3.81Å; I36-F102 HydrophobicContact CG1-CE1 3.72Å; I36-F102 HydrophobicContact CG1-CE2 4.09Å; I36-F102 HydrophobicContact CG1-CG 3.44Å; I36-F102 VanDerWaalsContact CG1-CG 3.44Å; I36-F102 HydrophobicContact CG1-CZ 4.05Å; T39-F102 HydrophobicContact CG2-CE2 4.21Å; W96-F102 HydrophobicContact CB-CB 4.3Å; W96-F102 HydrophobicContact CG-CB 4.43Å; I99-F102 HydrophobicContact CB-CD2 4.07Å; I99-F102 HydrophobicContact CD1-CD2 4.2Å; I99-F102 HydrophobicContact CG2-CD2 3.68Å; I99-F102 HydrophobicContact CG2-CE2 4.19Å; I99-F102 HydrophobicContact CG2-CG 4.5Å; I99-F102 CarbonylContact O-C 3.59Å; I99-F102 PolarHBondContact O-N 2.85Å; E100-F102 VanDerWaalsContact C-N 3.28Å; E100-F102 PolarHBondContact O-N 3.03Å; F102-H104 PolarHBondContact O-N 2.86Å; F102-Y105 WeakPolarHBondContact O-CB 3.36Å; F102-Y105 PolarHBondContact O-N 2.98Å
103	K	86.7	Confident	90.6	Very high	137 Å²	137	76.4 Å²	76.4	60%	0.596	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-30.8	-177.5	-174.2	172.1	-177.8	175	0	114.2	I99 Y105	I99-K103 PolarHBondContact O-N 3.27Å; K103-Y105 VanDerWaalsContact C-N 3.35Å
104	H	87.9	Confident	90.6	Very high	176 Å²	176	73.3 Å²	73.3	82%	0.815	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-8.7	179.2	-62.5	-62.6	0	0	0	114.2	F102 T106	F102-H104 PolarHBondContact O-N 2.86Å; H104-T106 PolarHBondContact O-N 3.02Å
105	Y	88.7	Confident	90.5	Very high	55 Å²	55	76.2 Å²	76.2	22%	0.216	38%	0.38	C	S	.	.			trans	-88.9	94.5	179.7	-168.2	-91.8	0	0	0	111.1	I32 I36 W96 F102 K103 K107 I109	I32-Y105 HydrophobicContact CG2-CD2 3.99Å; I32-Y105 HydrophobicContact CG2-CG 4.43Å; I36-Y105 HydrophobicContact CD1-CD1 3.58Å; I36-Y105 HydrophobicContact CD1-CD2 4.46Å; I36-Y105 HydrophobicContact CD1-CE1 4.16Å; I36-Y105 HydrophobicContact CD1-CG 3.75Å; W96-Y105 HydrophobicContact CZ2-CD1 4.24Å; W96-Y105 AromaticContact NE1-CD1 3.8Å; W96-Y105 PolarHBondContact NE1-O 3.36Å; F102-Y105 WeakPolarHBondContact O-CB 3.36Å; F102-Y105 PolarHBondContact O-N 2.98Å; K103-Y105 VanDerWaalsContact C-N 3.35Å; Y105-K107 HydrophobicContact CE1-CB 3.92Å; Y105-K107 WeakPolarHBondContact CE1-O 3.27Å; Y105-K107 HydrophobicContact CE2-CB 4.47Å; Y105-I109 HydrophobicContact CE1-CD1 4.37Å; Y105-I109 HydrophobicContact CE1-CG1 4.02Å
106	T	89.7	Confident	90.4	Very high	111 Å²	111	83.8 Å²	83.8	68%	0.681	41%	0.412	S	S	*	.			trans	-94.1	1.3	-175.9	57.5	0	0	0	0	114.5	H104	H104-T106 PolarHBondContact O-N 3.02Å
107	K	91.8	Very high	90.3	Very high	146 Å²	146	88.6 Å²	88.6	64%	0.635	43%	0.433	S	S	*	.	S	Bend	trans	-84	140.5	-177.7	-65.1	-176	-179.1	178	0	110.9	Y105	Y105-K107 HydrophobicContact CE1-CB 3.92Å; Y105-K107 WeakPolarHBondContact CE1-O 3.27Å; Y105-K107 HydrophobicContact CE2-CB 4.47Å
108	N	92.6	Very high	90.5	Very high	65 Å²	65	86.5 Å²	86.5	35%	0.348	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-66.8	140.7	175.3	-59.9	-27.4	0	0	0	111.2	R144 I145	N108-R144 HydrophobicContact CB-CG 3.78Å; N108-I145 WeakPolarHBondContact CA-O 3.45Å
109	I	92.9	Very high	90.8	Very high	4 Å²	4	79.5 Å²	79.5	2%	0.021	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	122.7	174	-54.9	179.9	0	0	0	108	R33 I36 V37 W96 Y105 F114 I145	R33-I109 HydrophobicContact CG-CD1 4.44Å; R33-I109 HydrophobicContact CG-CG1 4.49Å; R33-I109 HydrophobicContact CG-CG2 4.19Å; I36-I109 HydrophobicContact CB-CD1 4.08Å; I36-I109 HydrophobicContact CD1-CD1 4.4Å; I36-I109 HydrophobicContact CG2-CD1 3.58Å; V37-I109 HydrophobicContact CG2-CD1 4.37Å; V37-I109 HydrophobicContact CG2-CG2 4.1Å; W96-I109 HydrophobicContact CH2-CB 4.38Å; W96-I109 HydrophobicContact CH2-CD1 3.95Å; W96-I109 HydrophobicContact CH2-CG1 3.82Å; W96-I109 HydrophobicContact CZ2-CD1 4.15Å; W96-I109 HydrophobicContact CZ2-CG1 4.07Å; W96-I109 HydrophobicContact CZ3-CD1 4.22Å; W96-I109 HydrophobicContact CZ3-CG1 4.48Å; Y105-I109 HydrophobicContact CE1-CD1 4.37Å; Y105-I109 HydrophobicContact CE1-CG1 4.02Å; I109-F114 HydrophobicContact CB-CE2 4.49Å; I109-F114 HydrophobicContact CG2-CE2 3.74Å; I109-F114 HydrophobicContact CG2-CZ 3.62Å; I109-I145 PolarHBondContact N-O 2.92Å; I109-I145 PolarHBondContact O-N 2.94Å
110	V	92.9	Very high	91.1	Very high	53 Å²	53	79 Å²	79	32%	0.321	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	119.7	-175.2	177.7	0	0	0	0	109.7	R33 L142 I143 R144	R33-V110 PolarHBondContact NH2-O 3.32Å; V110-L142 HydrophobicContact CG1-CD1 3.24Å; V110-L142 HydrophobicContact CG1-CG 4.45Å; V110-I143 WeakPolarHBondContact CA-O 3.43Å; V110-R144 HydrophobicContact CG2-CB 4.02Å; V110-R144 HydrophobicContact CG2-CG 3.91Å
111	S	90.8	Very high	91.4	Very high	20 Å²	20	71.1 Å²	71.1	14%	0.14	35%	0.351	C	S	.	.			trans	-154.8	134.4	174.7	-173.9	0	0	0	0	111.5	V113 F114 I143	S111-V113 PolarHBondContact O-N 3.26Å; S111-V113 PolarHBondContact OG-N 3.43Å; S111-F114 WeakPolarHBondContact O-CD2 3.49Å; S111-I143 PolarHBondContact N-O 3.02Å
112	P	89.6	Confident	91.6	Very high	80 Å²	80	66.4 Å²	66.4	52%	0.519	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-68.9	-24.1	172.3	29.2	-34.2	0	0	0	112.5	F114 K115 L141	P112-F114 PolarHBondContact O-N 3.21Å; P112-F114 VanDerWaalsContact O-N 3.15Å; P112-K115 WeakPolarHBondContact O-CB 3.4Å; P112-K115 PolarHBondContact O-N 3.45Å; P112-L141 HydrophobicContact CB-CD1 3.78Å
113	V	89.5	Confident	91.9	Very high	82 Å²	82	67.3 Å²	67.3	50%	0.497	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-62.6	-22.3	179.9	-177.2	0	0	0	0	112	S111 K115 E116	S111-V113 PolarHBondContact O-N 3.26Å; S111-V113 PolarHBondContact OG-N 3.43Å; V113-K115 PolarHBondContact O-N 3.48Å; V113-K115 VanDerWaalsContact O-N 3.17Å; V113-E116 PolarHBondContact O-N 3.28Å
114	F	92.4	Very high	92.3	Very high	8 Å²	8	63.7 Å²	63.7	4%	0.035	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-63.8	-20.4	178.9	-62.6	-29.5	0	0	0	113.5	V37 F41 I109 S111 P112 E116 K117 I118 I143 I145	V37-F114 HydrophobicContact CG1-CE1 4.13Å; V37-F114 HydrophobicContact CG2-CE1 4.21Å; V37-F114 HydrophobicContact CG2-CZ 3.95Å; F41-F114 AromaticContact CE2-CD1 3.79Å; F41-F114 HydrophobicContact CE2-CD1 3.79Å; F41-F114 AromaticContact CE2-CE1 3.61Å; F41-F114 HydrophobicContact CE2-CE1 3.61Å; F41-F114 HydrophobicContact CE2-CZ 4.35Å; F41-F114 AromaticContact CZ-CD1 3.68Å; F41-F114 HydrophobicContact CZ-CD1 3.68Å; F41-F114 HydrophobicContact CZ-CE1 4Å; F41-F114 HydrophobicContact CZ-CG 4.28Å; I109-F114 HydrophobicContact CB-CE2 4.49Å; I109-F114 HydrophobicContact CG2-CE2 3.74Å; I109-F114 HydrophobicContact CG2-CZ 3.62Å; S111-F114 WeakPolarHBondContact O-CD2 3.49Å; P112-F114 PolarHBondContact O-N 3.21Å; P112-F114 VanDerWaalsContact O-N 3.15Å; F114-E116 PolarHBondContact O-N 3.04Å; F114-E116 VanDerWaalsContact O-N 3.14Å; F114-K117 PolarHBondContact O-N 2.85Å; F114-I118 HydrophobicContact CB-CG2 4.35Å; F114-I118 WeakPolarHBondContact O-CG1 3.48Å; F114-I118 PolarHBondContact O-N 2.94Å; F114-I143 HydrophobicContact CB-CB 4.17Å; F114-I143 HydrophobicContact CB-CD1 3.92Å; F114-I143 HydrophobicContact CB-CG2 3.88Å; F114-I143 HydrophobicContact CD2-CB 4.44Å; F114-I143 HydrophobicContact CD2-CG2 3.99Å; F114-I143 HydrophobicContact CG-CG2 4.46Å; F114-I145 HydrophobicContact CD2-CD1 3.98Å; F114-I145 HydrophobicContact CD2-CG1 4.35Å; F114-I145 HydrophobicContact CE2-CD1 4.06Å; F114-I145 HydrophobicContact CE2-CG1 4.47Å
115	K	91.1	Very high	92.6	Very high	62 Å²	62	56.4 Å²	56.4	27%	0.27	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-54.2	-36.4	-179.2	176.3	-177	176	-173.2	0	113	P112 V113 L120 E139 L141 I143	P112-K115 WeakPolarHBondContact O-CB 3.4Å; P112-K115 PolarHBondContact O-N 3.45Å; V113-K115 PolarHBondContact O-N 3.48Å; V113-K115 VanDerWaalsContact O-N 3.17Å; K115-L120 HydrophobicContact CG-CD1 4.02Å; K115-E139 IonicContact NZ-OE2 2.8Å; K115-E139 PolarHBondContact NZ-OE2 3.32Å; K115-L141 HydrophobicContact CB-CD1 4.38Å; K115-L141 HydrophobicContact CD-CD1 4.33Å; K115-L141 HydrophobicContact CD-CD2 3.51Å; K115-I143 HydrophobicContact CB-CD1 3.78Å
116	E	91	Very high	92.9	Very high	173 Å²	173	56.3 Å²	56.3	81%	0.808	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-89.4	-12.3	-178.6	-63	176.1	-179.4	0	0	112.7	V113 F114	V113-E116 PolarHBondContact O-N 3.28Å; F114-E116 PolarHBondContact O-N 3.04Å; F114-E116 VanDerWaalsContact O-N 3.14Å
117	K	92.1	Very high	93.1	Very high	102 Å²	102	52.5 Å²	52.5	44%	0.443	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-23.7	-173.6	-62.2	-171	176.2	-172.3	0	114	F41 Y44 F114	F41-K117 HydrophobicContact CD1-CB 3.88Å; F41-K117 HydrophobicContact CD1-CD 4.41Å; F41-K117 HydrophobicContact CE1-CB 3.55Å; F41-K117 HydrophobicContact CZ-CB 4.28Å; Y44-K117 VanDerWaalsContact CD1-O 3.31Å; Y44-K117 WeakPolarHBondContact CD1-O 3.23Å; Y44-K117 WeakPolarHBondContact CE1-O 3.23Å; F114-K117 PolarHBondContact O-N 2.85Å
118	I	94.6	Very high	93.3	Very high	7 Å²	7	46.9 Å²	46.9	4%	0.036	25%	0.246	C	C	.	.	S	Bend	trans	-102.5	158.3	-178.7	71.9	177.2	0	0	0	112.2	F41 Y44 W89 L94 F114 L120 I143 I151	F41-I118 HydrophobicContact CE1-CG2 3.56Å; F41-I118 HydrophobicContact CZ-CG2 3.71Å; Y44-I118 HydrophobicContact CE1-CB 4.31Å; W89-I118 HydrophobicContact CH2-CD1 4.33Å; W89-I118 HydrophobicContact CZ2-CD1 4.09Å; L94-I118 HydrophobicContact CD1-CB 4.36Å; L94-I118 HydrophobicContact CD1-CG2 3.79Å; F114-I118 HydrophobicContact CB-CG2 4.35Å; F114-I118 WeakPolarHBondContact O-CG1 3.48Å; F114-I118 PolarHBondContact O-N 2.94Å; I118-L120 HydrophobicContact CD1-CD2 3.86Å; I118-L120 HydrophobicContact CG1-CD2 3.82Å; I118-L120 HydrophobicContact CG1-CG 4.29Å; I118-I143 HydrophobicContact CD1-CD1 4Å; I118-I143 HydrophobicContact CD1-CG1 4.47Å; I118-I143 HydrophobicContact CD1-CG2 3.75Å; I118-I143 HydrophobicContact CG1-CD1 4.48Å; I118-I151 HydrophobicContact CD1-CG2 4.08Å
119	W	95.5	Very high	93.4	Very high	7 Å²	7	48.8 Å²	48.8	3%	0.027	25%	0.251	C	S	.	.			trans	-68	135	165.7	177.9	87.8	0	0	0	109.7	Y44 S46 R49 P50 T58 W89 P121 Y186 V191	Y44-W119 PolarHBondContact OH-N 3.36Å; Y44-W119 VanDerWaalsContact OH-N 3.17Å; S46-W119 WeakPolarHBondContact O-CA 3.45Å; S46-W119 WeakPolarHBondContact O-CB 3.48Å; R49-W119 HydrophobicContact CB-CD2 4.4Å; R49-W119 HydrophobicContact CB-CZ2 3.77Å; P50-W119 VanDerWaalsContact CD-CD2 3.5Å; P50-W119 HydrophobicContact CG-CD2 4.38Å; P50-W119 HydrophobicContact CG-CE3 3.78Å; P50-W119 HydrophobicContact CG-CZ3 4.1Å; T58-W119 HydrophobicContact CG2-CH2 4.21Å; T58-W119 HydrophobicContact CG2-CZ3 4.16Å; W89-W119 WeakPolarHBondContact CZ2-O 3.44Å; W89-W119 AromaticContact NE1-CE3 4Å; W119-P121 HydrophobicContact CH2-CB 3.89Å; W119-P121 HydrophobicContact CZ3-CB 4.17Å; W119-P121 HydrophobicContact CZ3-CG 4.47Å; W119-Y186 HydrophobicContact CZ2-CD2 4.38Å; W119-Y186 AromaticContact CZ2-CE2 3.78Å; W119-Y186 HydrophobicContact CZ2-CE2 3.78Å; W119-Y186 AromaticContact NE1-CZ 3.77Å; W119-Y186 PolarHBondContact NE1-OH 3.25Å; W119-V191 HydrophobicContact CH2-CG2 4.11Å; W119-V191 HydrophobicContact CZ2-CG2 4.11Å
120	L	95.1	Very high	93.5	Very high	46 Å²	46	54 Å²	54	24%	0.241	28%	0.275	C	S	.	.			trans	-121.8	137.9	175.3	-63.9	176.8	0	0	0	109.7	W89 K115 I118 Y153	W89-L120 HydrophobicContact CH2-CD2 3.71Å; W89-L120 HydrophobicContact CZ2-CD2 4.23Å; K115-L120 HydrophobicContact CG-CD1 4.02Å; I118-L120 HydrophobicContact CD1-CD2 3.86Å; I118-L120 HydrophobicContact CG1-CD2 3.82Å; I118-L120 HydrophobicContact CG1-CG 4.29Å; L120-Y153 HydrophobicContact CD2-CD1 4.4Å; L120-Y153 HydrophobicContact CD2-CG 4.35Å
121	P	95.7	Very high	93.5	Very high	11 Å²	11	53.6 Å²	53.6	7%	0.071	28%	0.282	C	S	.	.			trans	-64.2	144.4	171.9	27.6	-35.8	0	0	0	111.7	V60 W89 W119 L123 F193	V60-P121 HydrophobicContact CG1-CG 4.22Å; V60-P121 HydrophobicContact CG2-CB 4.14Å; V60-P121 HydrophobicContact CG2-CG 4.37Å; W89-P121 HydrophobicContact CE3-CG 4.38Å; W89-P121 HydrophobicContact CZ3-CG 4.35Å; W119-P121 HydrophobicContact CH2-CB 3.89Å; W119-P121 HydrophobicContact CZ3-CB 4.17Å; W119-P121 HydrophobicContact CZ3-CG 4.47Å; P121-L123 PolarHBondContact O-N 2.86Å; P121-L123 VanDerWaalsContact O-N 3.11Å; P121-F193 HydrophobicContact CB-CE1 3.95Å; P121-F193 HydrophobicContact CB-CZ 4.19Å
122	D	93.9	Very high	93.7	Very high	44 Å²	44	59.7 Å²	59.7	24%	0.235	30%	0.302	C	S	.	.			trans	-87.9	46.7	-176.5	65.7	-16.4	0	0	0	112.8	F124 S183 Y184 G185 Y186	D122-F124 PolarHBondContact O-N 2.87Å; D122-S183 PolarHBondContact OD1-OG 3.29Å; D122-Y184 PolarHBondContact OD2-N 2.86Å; D122-G185 WeakPolarHBondContact OD2-CA 3.28Å; D122-G185 PolarHBondContact OD2-N 2.83Å; D122-Y186 WeakPolarHBondContact OD1-CD2 3.48Å
123	L	95.5	Very high	93.9	Very high	25 Å²	25	59.1 Å²	59.1	13%	0.131	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	120	177.9	-173.2	161.3	0	0	0	110.2	V62 L85 Q87 P121 F125 I181 F193	V62-L123 HydrophobicContact CG1-CD1 4.09Å; V62-L123 HydrophobicContact CG2-CD1 3.86Å; L85-L123 HydrophobicContact CD1-CD1 4.23Å; L85-L123 HydrophobicContact CD2-CD1 4.28Å; L85-L123 HydrophobicContact CD2-CD2 3.85Å; Q87-L123 HydrophobicContact CG-CD1 4.02Å; P121-L123 PolarHBondContact O-N 2.86Å; P121-L123 VanDerWaalsContact O-N 3.11Å; L123-F125 HydrophobicContact CD2-CD2 4.5Å; L123-F125 HydrophobicContact CD2-CE2 3.97Å; L123-F125 HydrophobicContact CD2-CZ 4.06Å; L123-I181 HydrophobicContact CD1-CG2 3.69Å; L123-I181 HydrophobicContact CD2-CG2 3.61Å; L123-I181 HydrophobicContact CG-CG2 3.47Å; L123-I181 VanDerWaalsContact CG-CG2 3.47Å; L123-F193 HydrophobicContact CB-CE2 3.96Å; L123-F193 HydrophobicContact CB-CZ 3.89Å; L123-F193 HydrophobicContact CG-CE2 4.07Å; L123-F193 HydrophobicContact CG-CZ 4.43Å
124	F	94.1	Very high	94.1	Very high	60 Å²	60	57 Å²	57	26%	0.263	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	154.6	176.7	85.7	-74	0	0	0	112	D122 R126 G182 S183 Y184	D122-F124 PolarHBondContact O-N 2.87Å; F124-R126 HydrophobicContact CD2-CG 4.21Å; F124-R126 HydrophobicContact CE1-CG 4.13Å; F124-R126 HydrophobicContact CE2-CB 4.21Å; F124-R126 HydrophobicContact CE2-CG 3.34Å; F124-R126 HydrophobicContact CZ-CG 3.3Å; F124-G182 WeakPolarHBondContact CD1-O 3.39Å; F124-G182 PolarHBondContact N-O 3.26Å; F124-G182 PolarHBondContact O-N 2.97Å; F124-S183 VanDerWaalsContact CE1-C 3.41Å; F124-S183 VanDerWaalsContact CE1-O 3.28Å; F124-S183 WeakPolarHBondContact CE1-O 3.41Å; F124-Y184 HydrophobicContact CD1-CD2 4.29Å; F124-Y184 HydrophobicContact CD2-CD2 4.33Å; F124-Y184 HydrophobicContact CE1-CD2 4.28Å; F124-Y184 HydrophobicContact CE2-CD2 4.24Å; F124-Y184 HydrophobicContact CG-CD2 4.33Å; F124-Y184 HydrophobicContact CZ-CD2 4.22Å
125	F	95.9	Very high	94	Very high	24 Å²	24	63.4 Å²	63.4	11%	0.105	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	111	177.3	-64.2	-88.5	0	0	0	109.4	M83 L85 L123 N127 G128 I157 M159 M161 M179 N180 I181	M83-F125 HydrophobicContact CE-CD1 4.44Å; M83-F125 HydrophobicContact CE-CE1 3.45Å; M83-F125 VanDerWaalsContact CE-CE1 3.45Å; M83-F125 HydrophobicContact CE-CE2 4.27Å; M83-F125 HydrophobicContact CE-CZ 3.35Å; L85-F125 HydrophobicContact CD1-CZ 4.5Å; L85-F125 HydrophobicContact CD2-CE2 4.27Å; L85-F125 HydrophobicContact CD2-CZ 4.08Å; L123-F125 HydrophobicContact CD2-CD2 4.5Å; L123-F125 HydrophobicContact CD2-CE2 3.97Å; L123-F125 HydrophobicContact CD2-CZ 4.06Å; F125-N127 VanDerWaalsContact C-N 3.35Å; F125-N127 PolarHBondContact O-N 3.31Å; F125-G128 PolarHBondContact O-N 3.4Å; F125-G128 VanDerWaalsContact O-N 3.12Å; F125-I157 HydrophobicContact CE2-CD1 3.73Å; F125-I157 HydrophobicContact CZ-CD1 3.81Å; F125-M159 HydrophobicContact CB-SD 4.47Å; F125-M159 HydrophobicContact CD2-CE 3.45Å; F125-M159 VanDerWaalsContact CD2-CE 3.45Å; F125-M159 HydrophobicContact CD2-SD 4.21Å; F125-M159 HydrophobicContact CE2-CE 3.74Å; F125-M159 HydrophobicContact CG-CE 4.18Å; F125-M159 HydrophobicContact CG-CG 4.36Å; F125-M159 HydrophobicContact CG-SD 4.41Å; F125-M161 HydrophobicContact CD1-SD 4.46Å; F125-M179 HydrophobicContact CD1-CG 4.01Å; F125-M179 HydrophobicContact CE1-CG 4Å; F125-M179 HydrophobicContact CE1-SD 3.95Å; F125-N180 CarbonylContact C-O 3.54Å; F125-N180 WeakPolarHBondContact CA-O 3.31Å; F125-I181 HydrophobicContact CD1-CG1 3.83Å; F125-I181 HydrophobicContact CE1-CD1 3.84Å; F125-I181 HydrophobicContact CE1-CG1 3.65Å
126	R	93.2	Very high	93.9	Very high	52 Å²	52	68 Å²	68	20%	0.196	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-36.2	-174.5	-75	177.9	-176.5	169.9	1.2	113.4	F124 N180 Y227 T235	F124-R126 HydrophobicContact CD2-CG 4.21Å; F124-R126 HydrophobicContact CE1-CG 4.13Å; F124-R126 HydrophobicContact CE2-CB 4.21Å; F124-R126 HydrophobicContact CE2-CG 3.34Å; F124-R126 HydrophobicContact CZ-CG 3.3Å; R126-N180 HydrophobicContact CB-CB 4.2Å; R126-N180 WeakPolarHBondContact CD-OD1 3.42Å; R126-N180 PolarHBondContact N-O 3.18Å; R126-Y227 VanDerWaalsContact NH1-CE2 3.31Å; R126-Y227 VanDerWaalsContact NH1-CG 3.26Å; R126-T235 PolarHBondContact NH2-O 3.47Å
127	N	95.5	Very high	93.9	Very high	31 Å²	31	65.9 Å²	65.9	17%	0.166	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	12.1	175.5	67.3	-34.9	0	0	0	112.7	F125 K129 M161 A162 D178 N180	F125-N127 VanDerWaalsContact C-N 3.35Å; F125-N127 PolarHBondContact O-N 3.31Å; N127-K129 PolarHBondContact O-N 3.49Å; N127-M161 CarbonylContact O-C 3.49Å; N127-M161 VanDerWaalsContact O-CA 3.32Å; N127-M161 WeakPolarHBondContact O-CA 3.25Å; N127-A162 PolarHBondContact ND2-O 3.19Å; N127-A162 VanDerWaalsContact ND2-O 3.13Å; N127-A162 PolarHBondContact O-N 3.17Å; N127-D178 PolarHBondContact ND2-O 3.07Å; N127-N180 PolarHBondContact OD1-N 3.29Å
128	G	95.2	Very high	93.7	Very high	29 Å²	29	65.5 Å²	65.5	30%	0.299	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	121.1	172.6	0	0	0	0	0	110.8	F125	F125-G128 PolarHBondContact O-N 3.4Å; F125-G128 VanDerWaalsContact O-N 3.12Å
129	K	94.3	Very high	93.5	Very high	105 Å²	105	69 Å²	69	46%	0.457	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	-43.2	170.9	-75.2	176.8	167.4	173.9	0	111.1	N76 E78 N127 R160 A162	N76-K129 PolarHBondContact O-NZ 2.92Å; E78-K129 HydrophobicContact CB-CD 4.35Å; E78-K129 WeakPolarHBondContact OE2-CD 3.31Å; E78-K129 IonicContact OE2-NZ 3.32Å; E78-K129 PolarHBondContact OE2-NZ 3.16Å; N127-K129 PolarHBondContact O-N 3.49Å; K129-R160 PolarHBondContact N-O 2.92Å; K129-A162 HydrophobicContact CD-CB 4.49Å; K129-A162 HydrophobicContact CG-CB 4.39Å
130	E	95.2	Very high	93.4	Very high	112 Å²	112	71.5 Å²	71.5	52%	0.523	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	137	-177.8	-174.5	179.5	175.8	0	0	109.8	M159 R160	E130-M159 VanDerWaalsContact O-SD 3.36Å; E130-R160 HydrophobicContact CB-CB 4.38Å; E130-R160 PolarHBondContact N-O 2.96Å; E130-R160 PolarHBondContact O-N 3.43Å; E130-R160 IonicContact OE2-CZ 2.66Å; E130-R160 IonicContact OE2-NE 3.45Å; E130-R160 IonicContact OE2-NH2 2.84Å; E130-R160 PolarHBondContact OE2-NH2 3.11Å
131	G	94	Very high	93.3	Very high	45 Å²	45	70.1 Å²	70.1	46%	0.464	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	141	177.9	0	0	0	0	0	111	T158 M159	G131-T158 WeakPolarHBondContact CA-O 3.18Å; G131-M159 WeakPolarHBondContact CA-SD 3.49Å
132	R	94.5	Very high	93.2	Very high	148 Å²	148	72.4 Å²	72.4	56%	0.558	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131	138.1	174.7	62.3	179.3	-173.5	143.4	5.2	111.1	I157 T158	R132-I157 WeakPolarHBondContact O-CA 3.15Å; R132-T158 HydrophobicContact CG-CG2 4.4Å; R132-T158 PolarHBondContact N-O 3.24Å; R132-T158 PolarHBondContact O-N 3.41Å
133	L	93.2	Very high	93.3	Very high	68 Å²	68	70.3 Å²	70.3	36%	0.356	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	140.3	166.5	-69.4	93.3	0	0	0	109.2	I157	L133-I157 HydrophobicContact CG-CG2 4.03Å
134	H	93.6	Very high	93.3	Very high	39 Å²	39	73.5 Å²	73.5	18%	0.181	37%	0.373	C	S	.	.			trans	-73.9	130	173.4	-69.2	-108.5	0	0	0	109.2	N140 K156 T158	H134-N140 HydrophobicContact CB-CB 3.98Å; H134-N140 PolarHBondContact O-N 3.48Å; H134-N140 PolarHBondContact O-OD1 3.16Å; H134-N140 VanDerWaalsContact O-OD1 3.08Å; H134-K156 HydrophobicContact CB-CD 4.36Å; H134-K156 HydrophobicContact CB-CG 4.49Å; H134-K156 PolarHBondContact CD2-O 2.98Å; H134-K156 PolarHBondContact N-O 3.44Å; H134-T158 PolarHBondContact CE1-OG1 3.06Å; H134-T158 PolarHBondContact NE2-OG1 2.99Å
135	K	91.1	Very high	93.4	Very high	141 Å²	141	70.8 Å²	70.8	61%	0.613	36%	0.361	S	S	*	.			trans	-117.5	1.3	-173.4	-63.8	-170.8	175.3	-173.4	0	115	T137 C138 E139	K135-T137 CarbonylContact O-C 3.29Å; K135-C138 CarbonylContact C-O 3.51Å; K135-C138 CarbonylContact O-C 3.51Å; K135-C138 VanDerWaalsContact O-C 3.29Å; K135-C138 PolarHBondContact O-N 2.84Å; K135-E139 WeakPolarHBondContact CE-OE1 3.41Å; K135-E139 HydrophobicContact CG-CG 4.27Å; K135-E139 IonicContact NZ-OE1 3.71Å
136	M	89.1	Confident	93.4	Very high	159 Å²	159	72.3 Å²	72.3	78%	0.783	37%	0.368	S	S	*	.	S	Bend	trans	-112.3	128	-172	-174.8	65.2	70.6	0	0	110.2	N140	M136-N140 PolarHBondContact O-OD1 3.11Å
137	T	90.7	Very high	93.5	Very high	128 Å²	128	70.9 Å²	70.9	79%	0.785	37%	0.366	S	S	*	.	S	Bend	cis	-78.9	-19.1	-4.9	49.3	0	0	0	0	114.3	K135	K135-T137 CarbonylContact O-C 3.29Å
138	C	88.8	Confident	93.4	Very high	94 Å²	94	72.2 Å²	72.2	64%	0.635	37%	0.373	S	S	*	.	S	Bend	trans	-129.4	168	170.2	-64.3	0	0	0	0	108.5	K135 N140	K135-C138 CarbonylContact C-O 3.51Å; K135-C138 CarbonylContact O-C 3.51Å; K135-C138 VanDerWaalsContact O-C 3.29Å; K135-C138 PolarHBondContact O-N 2.84Å; C138-N140 PolarHBondContact O-N 2.91Å; C138-N140 VanDerWaalsContact O-N 3.15Å; C138-N140 PolarHBondContact O-OD1 3.33Å
139	E	90.2	Very high	93.3	Very high	80 Å²	80	70.9 Å²	70.9	37%	0.374	36%	0.359	S	S	.	.			trans	-56.4	122.3	172.4	-57.4	-155.9	143.1	0	0	111	K115 K135 L141	K115-E139 IonicContact NZ-OE2 2.8Å; K115-E139 PolarHBondContact NZ-OE2 3.32Å; K135-E139 WeakPolarHBondContact CE-OE1 3.41Å; K135-E139 HydrophobicContact CG-CG 4.27Å; K135-E139 IonicContact NZ-OE1 3.71Å; E139-L141 HydrophobicContact CB-CD2 3.79Å; E139-L141 HydrophobicContact CB-CG 4.34Å; E139-L141 PolarHBondContact O-N 2.89Å; E139-L141 WeakPolarHBondContact OE2-CD2 3.2Å
140	N	92.5	Very high	93.4	Very high	60 Å²	60	69.2 Å²	69.2	32%	0.321	35%	0.353	S	S	.	.			trans	-77.9	67.1	-176.7	-64.8	62.2	0	0	0	110.6	H134 M136 C138 Q155 K156	H134-N140 HydrophobicContact CB-CB 3.98Å; H134-N140 PolarHBondContact O-N 3.48Å; H134-N140 PolarHBondContact O-OD1 3.16Å; H134-N140 VanDerWaalsContact O-OD1 3.08Å; M136-N140 PolarHBondContact O-OD1 3.11Å; C138-N140 PolarHBondContact O-N 2.91Å; C138-N140 VanDerWaalsContact O-N 3.15Å; C138-N140 PolarHBondContact O-OD1 3.33Å; N140-Q155 WeakPolarHBondContact O-CA 3.28Å; N140-K156 HydrophobicContact CB-CB 3.73Å; N140-K156 PolarHBondContact O-N 3.04Å
141	L	94.1	Very high	93.5	Very high	18 Å²	18	63.9 Å²	63.9	9%	0.094	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	153.5	175.4	69	92.8	0	0	0	111	P112 K115 E139 Y153 S154 Q155	P112-L141 HydrophobicContact CB-CD1 3.78Å; K115-L141 HydrophobicContact CB-CD1 4.38Å; K115-L141 HydrophobicContact CD-CD1 4.33Å; K115-L141 HydrophobicContact CD-CD2 3.51Å; E139-L141 HydrophobicContact CB-CD2 3.79Å; E139-L141 HydrophobicContact CB-CG 4.34Å; E139-L141 PolarHBondContact O-N 2.89Å; E139-L141 WeakPolarHBondContact OE2-CD2 3.2Å; L141-Y153 HydrophobicContact CB-CE2 4.39Å; L141-S154 CarbonylContact C-O 3.59Å; L141-S154 VanDerWaalsContact CA-O 3.27Å; L141-S154 WeakPolarHBondContact CA-O 3.37Å; L141-Q155 HydrophobicContact CB-CB 4.43Å
142	L	93.1	Very high	93.7	Very high	58 Å²	58	62.8 Å²	62.8	30%	0.304	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	123.8	-177.3	176.5	75.1	0	0	0	108	V110 Y153 S154	V110-L142 HydrophobicContact CG1-CD1 3.24Å; V110-L142 HydrophobicContact CG1-CG 4.45Å; L142-Y153 WeakPolarHBondContact O-CA 3.49Å; L142-S154 PolarHBondContact N-O 3.06Å; L142-S154 PolarHBondContact O-N 2.63Å
143	I	95.9	Very high	93.8	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	125.4	166	-66.3	164.4	0	0	0	107.5	V110 S111 F114 K115 I118 I145 I151 L152 Y153	V110-I143 WeakPolarHBondContact CA-O 3.43Å; S111-I143 PolarHBondContact N-O 3.02Å; F114-I143 HydrophobicContact CB-CB 4.17Å; F114-I143 HydrophobicContact CB-CD1 3.92Å; F114-I143 HydrophobicContact CB-CG2 3.88Å; F114-I143 HydrophobicContact CD2-CB 4.44Å; F114-I143 HydrophobicContact CD2-CG2 3.99Å; F114-I143 HydrophobicContact CG-CG2 4.46Å; K115-I143 HydrophobicContact CB-CD1 3.78Å; I118-I143 HydrophobicContact CD1-CD1 4Å; I118-I143 HydrophobicContact CD1-CG1 4.47Å; I118-I143 HydrophobicContact CD1-CG2 3.75Å; I118-I143 HydrophobicContact CG1-CD1 4.48Å; I143-I145 HydrophobicContact CG2-CG1 4.26Å; I143-I151 HydrophobicContact CG2-CG2 4.13Å; I143-L152 WeakPolarHBondContact CA-O 3.33Å; I143-Y153 HydrophobicContact CD1-CD2 4.17Å; I143-Y153 HydrophobicContact CD1-CE2 4.34Å; I143-Y153 HydrophobicContact CG1-CD2 3.53Å; I143-Y153 HydrophobicContact CG1-CE2 4.08Å
144	R	96.1	Very high	93.9	Very high	93 Å²	93	53.9 Å²	53.9	35%	0.351	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	118.9	177.1	175.2	-172.6	-65.6	176.4	1.4	108.2	N108 V110 I151 L152	N108-R144 HydrophobicContact CB-CG 3.78Å; V110-R144 HydrophobicContact CG2-CB 4.02Å; V110-R144 HydrophobicContact CG2-CG 3.91Å; R144-I151 WeakPolarHBondContact O-CA 3.35Å; R144-L152 HydrophobicContact CB-CB 4.28Å; R144-L152 PolarHBondContact N-O 2.93Å; R144-L152 PolarHBondContact O-N 3.13Å
145	I	96	Very high	94	Very high	3 Å²	3	53.1 Å²	53.1	2%	0.015	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	128.4	173.7	-47.5	177.4	0	0	0	107.3	L94 W96 N108 I109 F114 I143 I151	L94-I145 HydrophobicContact CB-CG2 4.19Å; L94-I145 HydrophobicContact CD1-CD1 4.41Å; W96-I145 HydrophobicContact CH2-CB 4.49Å; W96-I145 HydrophobicContact CH2-CG2 4.34Å; W96-I145 WeakPolarHBondContact CH2-O 3.5Å; W96-I145 HydrophobicContact CZ3-CB 4.16Å; W96-I145 HydrophobicContact CZ3-CG2 3.64Å; N108-I145 WeakPolarHBondContact CA-O 3.45Å; I109-I145 PolarHBondContact N-O 2.92Å; I109-I145 PolarHBondContact O-N 2.94Å; F114-I145 HydrophobicContact CD2-CD1 3.98Å; F114-I145 HydrophobicContact CD2-CG1 4.35Å; F114-I145 HydrophobicContact CE2-CD1 4.06Å; F114-I145 HydrophobicContact CE2-CG1 4.47Å; I143-I145 HydrophobicContact CG2-CG1 4.26Å; I145-I151 HydrophobicContact CG1-CG1 4.37Å; I145-I151 HydrophobicContact CG2-CG1 4.24Å
146	Q	95.6	Very high	94.3	Very high	55 Å²	55	49.5 Å²	49.5	26%	0.257	26%	0.256	S	S	.	.			trans	-91.6	156.8	174.3	-66.3	-173.2	60.5	0	0	110.6	W96 N148 G149 E150	W96-Q146 VanDerWaalsContact CH2-C 3.46Å; W96-Q146 WeakPolarHBondContact CZ3-O 3.21Å; Q146-N148 WeakPolarHBondContact CB-OD1 3.23Å; Q146-N148 PolarHBondContact O-N 3.05Å; Q146-N148 VanDerWaalsContact O-N 3.12Å; Q146-G149 PolarHBondContact O-N 3.32Å; Q146-E150 HydrophobicContact CB-CB 4.24Å; Q146-E150 WeakPolarHBondContact CB-O 3.15Å; Q146-E150 HydrophobicContact CG-CB 4.45Å; Q146-E150 PolarHBondContact N-O 3.42Å; Q146-E150 VanDerWaalsContact NE2-CD 3.27Å; Q146-E150 PolarHBondContact NE2-OE2 3.45Å
147	P	94.4	Very high	94.6	Very high	23 Å²	23	42.1 Å²	42.1	15%	0.149	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-31.3	-177.7	-24.8	31.9	0	0	0	115.4	W96 D97 G149	W96-P147 HydrophobicContact CD2-CB 4.46Å; W96-P147 VanDerWaalsContact CE2-CA 3.47Å; W96-P147 HydrophobicContact CH2-CG 4.42Å; W96-P147 VanDerWaalsContact CZ2-CA 3.42Å; W96-P147 HydrophobicContact CZ2-CB 3.85Å; W96-P147 HydrophobicContact CZ2-CG 3.66Å; W96-P147 PolarHBondContact N-O 2.88Å; W96-P147 VanDerWaalsContact N-O 3.1Å; D97-P147 HydrophobicContact CB-CB 4.34Å; D97-P147 WeakPolarHBondContact CB-O 3.43Å; D97-P147 PolarHBondContact N-O 3.48Å; P147-G149 VanDerWaalsContact C-N 3.27Å; P147-G149 PolarHBondContact O-N 3.09Å
148	N	94.4	Very high	94.9	Very high	59 Å²	59	36.5 Å²	36.5	32%	0.316	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-9.1	177.7	64.7	-10.8	0	0	0	113.7	Y90 A95 Q146 E150	Y90-N148 WeakPolarHBondContact CE2-O 3.1Å; A95-N148 WeakPolarHBondContact CB-O 3.12Å; Q146-N148 WeakPolarHBondContact CB-OD1 3.23Å; Q146-N148 PolarHBondContact O-N 3.05Å; Q146-N148 VanDerWaalsContact O-N 3.12Å; N148-E150 WeakPolarHBondContact OD1-CB 3.48Å; N148-E150 PolarHBondContact OD1-N 3.04Å
149	G	93.6	Very high	95.3	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.16	C	C	.	.	S	Bend	trans	93.4	6.9	-174.3	0	0	0	0	0	114.9	D91 Q146 P147 I151	D91-G149 PolarHBondContact N-O 3.12Å; Q146-G149 PolarHBondContact O-N 3.32Å; P147-G149 VanDerWaalsContact C-N 3.27Å; P147-G149 PolarHBondContact O-N 3.09Å; G149-I151 PolarHBondContact O-N 2.89Å
150	E	96.2	Very high	95.6	Very high	71 Å²	71	32.9 Å²	32.9	33%	0.332	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	126.1	169	-171.4	-177.2	-173.2	0	0	110.3	Q146 N148	Q146-E150 HydrophobicContact CB-CB 4.24Å; Q146-E150 WeakPolarHBondContact CB-O 3.15Å; Q146-E150 HydrophobicContact CG-CB 4.45Å; Q146-E150 PolarHBondContact N-O 3.42Å; Q146-E150 VanDerWaalsContact NE2-CD 3.27Å; Q146-E150 PolarHBondContact NE2-OE2 3.45Å; N148-E150 WeakPolarHBondContact OD1-CB 3.48Å; N148-E150 PolarHBondContact OD1-N 3.04Å
151	I	97	Very high	95.8	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	125.5	-178.8	-56.6	176.6	0	0	0	108.6	A88 W89 D91 L94 I118 I143 R144 I145 G149	A88-I151 VanDerWaalsContact CA-O 3.26Å; A88-I151 WeakPolarHBondContact CA-O 3.4Å; W89-I151 HydrophobicContact CD2-CB 4.19Å; W89-I151 HydrophobicContact CH2-CB 4.23Å; W89-I151 HydrophobicContact CH2-CG2 3.57Å; W89-I151 HydrophobicContact CZ2-CB 3.9Å; W89-I151 HydrophobicContact CZ2-CD1 3.99Å; W89-I151 HydrophobicContact CZ2-CG2 3.55Å; W89-I151 HydrophobicContact CZ3-CG2 4.11Å; W89-I151 PolarHBondContact N-O 3.36Å; W89-I151 VanDerWaalsContact N-O 3.09Å; W89-I151 PolarHBondContact O-N 3.12Å; D91-I151 HydrophobicContact CB-CD1 3.77Å; L94-I151 HydrophobicContact CB-CD1 4.46Å; L94-I151 HydrophobicContact CD1-CD1 3.44Å; L94-I151 VanDerWaalsContact CD1-CD1 3.44Å; I118-I151 HydrophobicContact CD1-CG2 4.08Å; I143-I151 HydrophobicContact CG2-CG2 4.13Å; R144-I151 WeakPolarHBondContact O-CA 3.35Å; I145-I151 HydrophobicContact CG1-CG1 4.37Å; I145-I151 HydrophobicContact CG2-CG1 4.24Å; G149-I151 PolarHBondContact O-N 2.89Å
152	L	97.1	Very high	95.9	Very high	22 Å²	22	31 Å²	31	12%	0.115	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	117.8	168.4	172.2	64.7	0	0	0	109.2	Y63 R86 I143 R144	Y63-L152 HydrophobicContact CE1-CD1 4.35Å; Y63-L152 WeakPolarHBondContact OH-CD1 3.46Å; R86-L152 HydrophobicContact CB-CD1 4.26Å; I143-L152 WeakPolarHBondContact CA-O 3.33Å; R144-L152 HydrophobicContact CB-CB 4.28Å; R144-L152 PolarHBondContact N-O 2.93Å; R144-L152 PolarHBondContact O-N 3.13Å
153	Y	97	Very high	96.1	Very high	14 Å²	14	28.4 Å²	28.4	6%	0.055	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	118.9	168.8	-178.4	-132.7	0	0	0	109.8	R86 Q87 L120 L141 L142 I143 Q155	R86-Y153 CarbonylContact C-O 3.6Å; R86-Y153 WeakPolarHBondContact CA-O 3.37Å; Q87-Y153 PolarHBondContact N-O 2.94Å; Q87-Y153 PolarHBondContact O-N 3.43Å; L120-Y153 HydrophobicContact CD2-CD1 4.4Å; L120-Y153 HydrophobicContact CD2-CG 4.35Å; L141-Y153 HydrophobicContact CB-CE2 4.39Å; L142-Y153 WeakPolarHBondContact O-CA 3.49Å; I143-Y153 HydrophobicContact CD1-CD2 4.17Å; I143-Y153 HydrophobicContact CD1-CE2 4.34Å; I143-Y153 HydrophobicContact CG1-CD2 3.53Å; I143-Y153 HydrophobicContact CG1-CE2 4.08Å; Y153-Q155 HydrophobicContact CE1-CG 4.49Å; Y153-Q155 PolarHBondContact OH-OE1 3.31Å
154	S	96.3	Very high	96	Very high	14 Å²	14	35.9 Å²	35.9	10%	0.098	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	132.3	177.5	-172.1	0	0	0	0	109.7	L85 R86 L141 L142	L85-S154 WeakPolarHBondContact O-CA 3.46Å; R86-S154 VanDerWaalsContact CG-OG 3.29Å; R86-S154 WeakPolarHBondContact CG-OG 3.3Å; L141-S154 CarbonylContact C-O 3.59Å; L141-S154 VanDerWaalsContact CA-O 3.27Å; L141-S154 WeakPolarHBondContact CA-O 3.37Å; L142-S154 PolarHBondContact N-O 3.06Å; L142-S154 PolarHBondContact O-N 2.63Å
155	Q	95.6	Very high	95.9	Very high	24 Å²	24	31.5 Å²	31.5	11%	0.112	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	140.6	177.2	57.3	178.7	46.9	0	0	111	L84 L85 N140 L141 Y153 I157	L84-Q155 WeakPolarHBondContact CA-O 3.44Å; L85-Q155 HydrophobicContact CB-CG 4.06Å; L85-Q155 HydrophobicContact CD2-CG 4.43Å; L85-Q155 PolarHBondContact N-O 3.35Å; L85-Q155 PolarHBondContact O-N 3.46Å; N140-Q155 WeakPolarHBondContact O-CA 3.28Å; L141-Q155 HydrophobicContact CB-CB 4.43Å; Y153-Q155 HydrophobicContact CE1-CG 4.49Å; Y153-Q155 PolarHBondContact OH-OE1 3.31Å; Q155-I157 HydrophobicContact CB-CG2 4.41Å; Q155-I157 HydrophobicContact CG-CG2 4Å
156	K	96.2	Very high	95.7	Very high	65 Å²	65	35.5 Å²	35.5	28%	0.283	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	118.6	170.4	-171.3	-179.9	177.6	178.8	0	109.4	L84 H134 N140	L84-K156 HydrophobicContact CD2-CB 3.64Å; L84-K156 HydrophobicContact CD2-CD 4.49Å; L84-K156 HydrophobicContact CD2-CG 3.89Å; H134-K156 HydrophobicContact CB-CD 4.36Å; H134-K156 HydrophobicContact CB-CG 4.49Å; H134-K156 PolarHBondContact CD2-O 2.98Å; H134-K156 PolarHBondContact N-O 3.44Å; N140-K156 HydrophobicContact CB-CB 3.73Å; N140-K156 PolarHBondContact O-N 3.04Å
157	I	96.3	Very high	95.6	Very high	4 Å²	4	32.9 Å²	32.9	2%	0.021	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	144.2	-177.7	59.9	176	0	0	0	111.2	M83 L85 F125 R132 L133 Q155 M159	M83-I157 HydrophobicContact CE-CD1 3.58Å; M83-I157 HydrophobicContact CE-CG1 4.02Å; M83-I157 HydrophobicContact CG-CD1 4.38Å; M83-I157 HydrophobicContact CG-CG1 3.84Å; M83-I157 PolarHBondContact N-O 3.22Å; M83-I157 PolarHBondContact O-N 2.76Å; L85-I157 HydrophobicContact CB-CD1 3.96Å; L85-I157 HydrophobicContact CB-CG1 4.4Å; L85-I157 HydrophobicContact CD2-CD1 4.15Å; F125-I157 HydrophobicContact CE2-CD1 3.73Å; F125-I157 HydrophobicContact CZ-CD1 3.81Å; R132-I157 WeakPolarHBondContact O-CA 3.15Å; L133-I157 HydrophobicContact CG-CG2 4.03Å; Q155-I157 HydrophobicContact CB-CG2 4.41Å; Q155-I157 HydrophobicContact CG-CG2 4Å; I157-M159 HydrophobicContact CD1-CE 4.23Å
158	T	97.1	Very high	95.5	Very high	9 Å²	9	38.7 Å²	38.7	6%	0.055	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	125.9	161.4	-62	0	0	0	0	107	T80 I81 D82 G131 R132 H134	T80-T158 HydrophobicContact CG2-CG2 3.52Å; I81-T158 CarbonylContact O-C 3.5Å; I81-T158 WeakPolarHBondContact O-CA 3.22Å; D82-T158 WeakPolarHBondContact OD1-CB 3.25Å; D82-T158 WeakPolarHBondContact OD1-CG2 3.28Å; D82-T158 PolarHBondContact OD1-OG1 2.86Å; G131-T158 WeakPolarHBondContact CA-O 3.18Å; R132-T158 HydrophobicContact CG-CG2 4.4Å; R132-T158 PolarHBondContact N-O 3.24Å; R132-T158 PolarHBondContact O-N 3.41Å; H134-T158 PolarHBondContact CE1-OG1 3.06Å; H134-T158 PolarHBondContact NE2-OG1 2.99Å
159	M	96	Very high	95.4	Very high	20 Å²	20	37.4 Å²	37.4	10%	0.099	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	131	179.2	-167.4	63.8	55.3	0	0	109.8	T80 I81 M83 F125 E130 G131 I157 M161	T80-M159 WeakPolarHBondContact CA-O 3.43Å; I81-M159 HydrophobicContact CG2-CB 4.19Å; I81-M159 PolarHBondContact N-O 3.44Å; I81-M159 PolarHBondContact O-N 3.22Å; M83-M159 HydrophobicContact CE-CB 4.26Å; F125-M159 HydrophobicContact CB-SD 4.47Å; F125-M159 HydrophobicContact CD2-CE 3.45Å; F125-M159 VanDerWaalsContact CD2-CE 3.45Å; F125-M159 HydrophobicContact CD2-SD 4.21Å; F125-M159 HydrophobicContact CE2-CE 3.74Å; F125-M159 HydrophobicContact CG-CE 4.18Å; F125-M159 HydrophobicContact CG-CG 4.36Å; F125-M159 HydrophobicContact CG-SD 4.41Å; E130-M159 VanDerWaalsContact O-SD 3.36Å; G131-M159 WeakPolarHBondContact CA-SD 3.49Å; I157-M159 HydrophobicContact CD1-CE 4.23Å; M159-M161 HydrophobicContact CB-CE 4.4Å; M159-M161 HydrophobicContact CB-CG 4.49Å; M159-M161 HydrophobicContact CG-CE 4.4Å; M159-M161 HydrophobicContact CG-CG 3.65Å; M159-M161 HydrophobicContact CG-SD 4.24Å
160	R	97.2	Very high	95.4	Very high	79 Å²	79	37.5 Å²	37.5	30%	0.298	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	113.7	170	-172.5	167.3	67.8	138.1	-11.1	108.2	E78 Y79 K129 E130	E78-R160 HydrophobicContact CB-CG 4.4Å; E78-R160 HydrophobicContact CG-CG 4.38Å; E78-R160 VanDerWaalsContact OE1-CD 3.31Å; E78-R160 WeakPolarHBondContact OE1-CD 3.28Å; E78-R160 IonicContact OE1-CZ 3.72Å; E78-R160 IonicContact OE1-NE 3.76Å; E78-R160 IonicContact OE1-NH1 2.77Å; E78-R160 PolarHBondContact OE1-NH1 3.09Å; E78-R160 IonicContact OE2-NH1 3.35Å; E78-R160 PolarHBondContact OE2-NH1 3.37Å; Y79-R160 WeakPolarHBondContact O-CA 3.19Å; K129-R160 PolarHBondContact N-O 2.92Å; E130-R160 HydrophobicContact CB-CB 4.38Å; E130-R160 PolarHBondContact N-O 2.96Å; E130-R160 PolarHBondContact O-N 3.43Å; E130-R160 IonicContact OE2-CZ 2.66Å; E130-R160 IonicContact OE2-NE 3.45Å; E130-R160 IonicContact OE2-NH2 2.84Å; E130-R160 PolarHBondContact OE2-NH2 3.11Å
161	M	96.7	Very high	95.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	145	-174.8	-70.6	178.4	-81	0	0	111.1	E78 Y79 I81 F125 N127 M159 M179	E78-M161 CarbonylContact C-O 3.55Å; E78-M161 WeakPolarHBondContact CA-O 3.4Å; E78-M161 VanDerWaalsContact CB-O 3.29Å; E78-M161 WeakPolarHBondContact CB-O 3.31Å; Y79-M161 HydrophobicContact CD1-CB 4.05Å; Y79-M161 HydrophobicContact CD2-CE 4.34Å; Y79-M161 HydrophobicContact CE1-CB 3.49Å; Y79-M161 VanDerWaalsContact CE1-CB 3.49Å; Y79-M161 HydrophobicContact CE1-CE 4.28Å; Y79-M161 HydrophobicContact CE2-CE 3.37Å; Y79-M161 PolarHBondContact N-O 2.93Å; Y79-M161 PolarHBondContact O-N 3.4Å; Y79-M161 WeakPolarHBondContact OH-CE 3.13Å; Y79-M161 PolarHBondContact OH-SD 3.19Å; Y79-M161 VanDerWaalsContact OH-SD 3.37Å; I81-M161 HydrophobicContact CB-CE 4.18Å; I81-M161 HydrophobicContact CG2-CE 3.24Å; F125-M161 HydrophobicContact CD1-SD 4.46Å; N127-M161 CarbonylContact O-C 3.49Å; N127-M161 VanDerWaalsContact O-CA 3.32Å; N127-M161 WeakPolarHBondContact O-CA 3.25Å; M159-M161 HydrophobicContact CB-CE 4.4Å; M159-M161 HydrophobicContact CB-CG 4.49Å; M159-M161 HydrophobicContact CG-CE 4.4Å; M159-M161 HydrophobicContact CG-CG 3.65Å; M159-M161 HydrophobicContact CG-SD 4.24Å; M161-M179 HydrophobicContact CE-CB 4.36Å; M161-M179 HydrophobicContact CE-CE 3.38Å; M161-M179 HydrophobicContact CE-CG 4.27Å; M161-M179 HydrophobicContact SD-CB 3.83Å; M161-M179 HydrophobicContact SD-CE 4.04Å; M161-M179 HydrophobicContact SD-CG 3.65Å
162	A	97	Very high	94.9	Very high	37 Å²	37	35.3 Å²	35.3	31%	0.306	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	134.1	170.4	0	0	0	0	0	110	N127 K129	N127-A162 PolarHBondContact ND2-O 3.19Å; N127-A162 VanDerWaalsContact ND2-O 3.13Å; N127-A162 PolarHBondContact O-N 3.17Å; K129-A162 HydrophobicContact CD-CB 4.49Å; K129-A162 HydrophobicContact CG-CB 4.39Å
163	C	96	Very high	94.6	Very high	4 Å²	4	34.3 Å²	34.3	3%	0.027	16%	0.161	C	C	.	.			trans	-133.4	116.1	174.1	173.5	0	0	0	0	108.9	M77 Y79 M165 C177	M77-C163 CarbonylContact C-O 3.52Å; M77-C163 WeakPolarHBondContact CB-O 3.4Å; M77-C163 PolarHBondContact O-N 3.45Å; Y79-C163 HydrophobicContact CD1-CB 3.65Å; Y79-C163 HydrophobicContact CE1-CB 4.03Å; C163-M165 HydrophobicContact CB-CE 4.37Å; C163-M165 PolarHBondContact O-N 3.45Å; C163-M165 VanDerWaalsContact O-N 3.16Å; C163-C177 HydrophobicContact CB-CB 3.76Å; C163-C177 WeakPolarHBondContact CB-SG 3.31Å; C163-C177 WeakPolarHBondContact SG-CA 3.48Å; C163-C177 WeakPolarHBondContact SG-CB 3.48Å; C163-C177 CovalentContact SG-SG 2.05Å; C163-C177 PolarHBondContact SG-SG 2.99Å
164	Q	93.8	Very high	94.4	Very high	157 Å²	157	37.4 Å²	37.4	73%	0.734	18%	0.181	S	C	*	.			trans	-81.1	94.5	179.6	-177.1	61.7	34.6	0	0	109.3
165	M	93.4	Very high	94.2	Very high	1 Å²	1	37 Å²	37	1%	0.005	18%	0.178	C	C	.	.			trans	-81.9	140.7	-176.9	-60.5	176.9	-165.9	0	0	112.1	V72 V74 M77 C163 L167 Q175	V72-M165 HydrophobicContact CG1-CE 3.54Å; V74-M165 HydrophobicContact CB-SD 4.22Å; V74-M165 HydrophobicContact CG1-SD 4.03Å; V74-M165 HydrophobicContact CG2-SD 4.09Å; M77-M165 HydrophobicContact SD-CB 3.81Å; M77-M165 HydrophobicContact SD-CG 4.17Å; M77-M165 HydrophobicContact SD-SD 4.4Å; C163-M165 HydrophobicContact CB-CE 4.37Å; C163-M165 PolarHBondContact O-N 3.45Å; C163-M165 VanDerWaalsContact O-N 3.16Å; M165-L167 HydrophobicContact CB-CD2 4.09Å; M165-L167 HydrophobicContact CB-CG 4.39Å; M165-Q175 HydrophobicContact CB-CG 4.37Å; M165-Q175 HydrophobicContact CG-CG 4.22Å; M165-Q175 HydrophobicContact SD-CG 4.49Å
166	E	92.9	Very high	94.1	Very high	87 Å²	87	40.7 Å²	40.7	41%	0.407	20%	0.195	S	C	.	.			trans	-101.7	106.8	174.4	-173.2	62.2	-138.8	0	0	109.7	R168 Q175	E166-R168 WeakPolarHBondContact OE1-CD 3.3Å; E166-R168 WeakPolarHBondContact OE1-CG 3.38Å; E166-R168 IonicContact OE1-CZ 3.89Å; E166-R168 IonicContact OE1-NE 2.84Å; E166-R168 PolarHBondContact OE1-NE 3.05Å; E166-Q175 PolarHBondContact O-NE2 3.41Å
167	L	93.2	Very high	94	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.182	C	C	.	.			trans	-101.2	12.9	-168.7	-57.7	177.2	0	0	0	113.7	V74 M77 M165 T169 F170 P302 V304 Y306 K308	V74-L167 HydrophobicContact CG1-CD1 3.97Å; V74-L167 HydrophobicContact CG1-CD2 3.9Å; M77-L167 HydrophobicContact CE-CD1 4.02Å; M165-L167 HydrophobicContact CB-CD2 4.09Å; M165-L167 HydrophobicContact CB-CG 4.39Å; L167-T169 PolarHBondContact O-N 3.34Å; L167-F170 HydrophobicContact CB-CB 4.17Å; L167-F170 HydrophobicContact CD2-CD2 3.99Å; L167-F170 WeakPolarHBondContact O-CB 3.19Å; L167-F170 PolarHBondContact O-N 3.17Å; L167-F170 VanDerWaalsContact O-N 3.16Å; L167-P302 HydrophobicContact CD1-CG 3.43Å; L167-P302 VanDerWaalsContact CD1-CG 3.43Å; L167-V304 HydrophobicContact CD1-CG1 4.15Å; L167-Y306 HydrophobicContact CB-CE2 4.15Å; L167-Y306 PolarHBondContact N-OH 2.75Å; L167-K308 HydrophobicContact CB-CD 4.15Å; L167-K308 HydrophobicContact CB-CG 4.47Å; L167-K308 WeakPolarHBondContact O-CG 3.4Å
168	R	92.4	Very high	94	Very high	145 Å²	145	40.3 Å²	40.3	55%	0.547	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-37.3	179.8	-80	171.6	-160.7	-100.1	0.8	112.6	E166 Y306 K308 A309	E166-R168 WeakPolarHBondContact OE1-CD 3.3Å; E166-R168 WeakPolarHBondContact OE1-CG 3.38Å; E166-R168 IonicContact OE1-CZ 3.89Å; E166-R168 IonicContact OE1-NE 2.84Å; E166-R168 PolarHBondContact OE1-NE 3.05Å; R168-Y306 HydrophobicContact CG-CD2 3.82Å; R168-Y306 HydrophobicContact CG-CE2 3.94Å; R168-Y306 HydrophobicContact CG-CG 4.47Å; R168-K308 CarbonylContact O-C 3.58Å; R168-A309 PolarHBondContact O-N 2.94Å
169	T	92.3	Very high	93.9	Very high	33 Å²	33	39.9 Å²	39.9	20%	0.202	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	7.2	-173.9	60.6	0	0	0	0	112.7	L167 M172 D173 V508	L167-T169 PolarHBondContact O-N 3.34Å; T169-M172 CarbonylContact O-C 3.42Å; T169-M172 WeakPolarHBondContact O-CA 3.45Å; T169-M172 PolarHBondContact O-N 3.04Å; T169-D173 WeakPolarHBondContact OG1-CA 3.32Å; T169-D173 WeakPolarHBondContact OG1-CB 3.25Å; T169-V508 HydrophobicContact CG2-CG1 3.26Å
170	F	93.3	Very high	93.8	Very high	1 Å²	1	40.8 Å²	40.8	0%	0.004	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	130.7	-178.5	-178	-84.5	0	0	0	112.5	L167 R245 W250 L301 K308 A309 I310	L167-F170 HydrophobicContact CB-CB 4.17Å; L167-F170 HydrophobicContact CD2-CD2 3.99Å; L167-F170 WeakPolarHBondContact O-CB 3.19Å; L167-F170 PolarHBondContact O-N 3.17Å; L167-F170 VanDerWaalsContact O-N 3.16Å; F170-R245 VanDerWaalsContact CE2-CZ 3.47Å; F170-W250 HydrophobicContact CE1-CD2 4.33Å; F170-W250 HydrophobicContact CE1-CE3 4.19Å; F170-W250 AromaticContact CE1-CH2 3.72Å; F170-W250 HydrophobicContact CE1-CH2 3.72Å; F170-W250 AromaticContact CE1-CZ2 3.9Å; F170-W250 HydrophobicContact CE1-CZ2 3.9Å; F170-W250 AromaticContact CE1-CZ3 3.87Å; F170-W250 HydrophobicContact CE1-CZ3 3.87Å; F170-W250 HydrophobicContact CE2-CZ2 4.38Å; F170-W250 HydrophobicContact CZ-CD2 4.32Å; F170-W250 AromaticContact CZ-CE2 3.67Å; F170-W250 AromaticContact CZ-CH2 3.56Å; F170-W250 HydrophobicContact CZ-CH2 3.56Å; F170-W250 AromaticContact CZ-CZ2 3.31Å; F170-W250 HydrophobicContact CZ-CZ2 3.31Å; F170-W250 HydrophobicContact CZ-CZ3 4.16Å; F170-L301 HydrophobicContact CD1-CD1 4.01Å; F170-L301 HydrophobicContact CD2-CD2 4.41Å; F170-L301 HydrophobicContact CE1-CD1 3.53Å; F170-L301 HydrophobicContact CE1-CD2 3.89Å; F170-L301 HydrophobicContact CE1-CG 4.33Å; F170-L301 HydrophobicContact CE2-CD2 3.63Å; F170-L301 HydrophobicContact CZ-CD1 3.91Å; F170-L301 HydrophobicContact CZ-CD2 3.33Å; F170-L301 HydrophobicContact CZ-CG 4.22Å; F170-K308 HydrophobicContact CB-CD 4.49Å; F170-A309 WeakPolarHBondContact O-CB 3.31Å; F170-I310 HydrophobicContact CD1-CB 4.3Å; F170-I310 HydrophobicContact CD1-CG2 3.83Å; F170-I310 HydrophobicContact CE1-CD1 4.2Å; F170-I310 HydrophobicContact CE1-CG2 4.38Å; F170-I310 PolarHBondContact O-N 3.23Å; F170-I310 VanDerWaalsContact O-N 3.14Å
171	P	92.6	Very high	93.8	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	cis	-97.7	15.7	8.8	38.3	-36.3	0	0	0	114.9	D173 R245 L247 W250 Y255	P171-D173 WeakPolarHBondContact CA-OD1 3.33Å; P171-D173 PolarHBondContact O-N 3.1Å; P171-R245 WeakPolarHBondContact O-CD 3.47Å; P171-L247 HydrophobicContact CG-CD1 3.88Å; P171-W250 HydrophobicContact CB-CB 4.15Å; P171-W250 HydrophobicContact CB-CD2 3.89Å; P171-W250 HydrophobicContact CB-CG 3.59Å; P171-W250 HydrophobicContact CG-CB 3.8Å; P171-W250 HydrophobicContact CG-CD2 4.2Å; P171-W250 HydrophobicContact CG-CG 3.77Å; P171-Y255 WeakPolarHBondContact CD-OH 3.49Å; P171-Y255 HydrophobicContact CG-CE2 4.07Å
172	M	90.4	Very high	93.6	Very high	26 Å²	26	37 Å²	37	13%	0.128	19%	0.185	C	C	.	.	S	Bend	trans	-95.6	35	179.2	-63.6	161	-77.3	0	0	110.9	T169 L247 A309 Y500 W501 Y504 L505	T169-M172 CarbonylContact O-C 3.42Å; T169-M172 WeakPolarHBondContact O-CA 3.45Å; T169-M172 PolarHBondContact O-N 3.04Å; M172-L247 HydrophobicContact CG-CD1 3.94Å; M172-L247 HydrophobicContact CG-CD2 4.29Å; M172-A309 HydrophobicContact CE-CB 4.29Å; M172-Y500 HydrophobicContact CE-CE1 4.19Å; M172-W501 HydrophobicContact SD-CE3 4.37Å; M172-W501 HydrophobicContact SD-CZ3 4.01Å; M172-Y504 HydrophobicContact CE-CD1 4.29Å; M172-Y504 HydrophobicContact CE-CD2 4.21Å; M172-Y504 HydrophobicContact CE-CG 3.71Å; M172-Y504 VanDerWaalsContact SD-CB 3.53Å; M172-L505 HydrophobicContact CG-CD2 4.01Å; M172-L505 HydrophobicContact SD-CD2 3.66Å; M172-L505 HydrophobicContact SD-CG 4.07Å
173	D	91.5	Very high	93.4	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	17%	0.17	C	C	.	.			trans	-97	149.3	-171.6	55.6	-45.2	0	0	0	112.6	T169 P171 Q175 R245	T169-D173 WeakPolarHBondContact OG1-CA 3.32Å; T169-D173 WeakPolarHBondContact OG1-CB 3.25Å; P171-D173 WeakPolarHBondContact CA-OD1 3.33Å; P171-D173 PolarHBondContact O-N 3.1Å; D173-Q175 PolarHBondContact OD2-NE2 3.38Å; D173-R245 PolarHBondContact O-N 3.45Å; D173-R245 WeakPolarHBondContact OD1-CD 3.21Å; D173-R245 IonicContact OD1-CZ 3.22Å; D173-R245 IonicContact OD1-NE 2.68Å; D173-R245 PolarHBondContact OD1-NE 2.9Å; D173-R245 IonicContact OD1-NH2 3.55Å; D173-R245 IonicContact OD2-CZ 3.58Å; D173-R245 IonicContact OD2-NE 2.8Å; D173-R245 PolarHBondContact OD2-NE 3.21Å; D173-R245 IonicContact OD2-NH2 2.9Å; D173-R245 PolarHBondContact OD2-NH2 2.96Å
174	T	91.5	Very high	93.2	Very high	78 Å²	78	43.6 Å²	43.6	48%	0.479	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	129.2	165.5	-58.1	0	0	0	0	107.4	L243	T174-L243 WeakPolarHBondContact CA-O 3.28Å
175	Q	92.7	Very high	93	Very high	5 Å²	5	38.2 Å²	38.2	2%	0.023	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.7	-178.1	-60.7	-56.3	-28.8	0	0	110.4	M165 E166 D173 F212 L243	M165-Q175 HydrophobicContact CB-CG 4.37Å; M165-Q175 HydrophobicContact CG-CG 4.22Å; M165-Q175 HydrophobicContact SD-CG 4.49Å; E166-Q175 PolarHBondContact O-NE2 3.41Å; D173-Q175 PolarHBondContact OD2-NE2 3.38Å; Q175-F212 HydrophobicContact CG-CE1 4.34Å; Q175-L243 PolarHBondContact N-O 3.4Å; Q175-L243 PolarHBondContact O-N 3.15Å
176	E	93.3	Very high	93	Very high	103 Å²	103	40.6 Å²	40.6	48%	0.481	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	109.2	172.7	-66.4	-168.1	147.3	0	0	108.6	R219 T240 T242	E176-R219 IonicContact OE1-NH1 3.77Å; E176-R219 PolarHBondContact OE1-NH1 3.41Å; E176-T240 HydrophobicContact CB-CG2 3.87Å; E176-T240 HydrophobicContact CG-CG2 4.32Å; E176-T242 HydrophobicContact CG-CG2 4.2Å
177	C	95.1	Very high	93	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	119.5	177.8	-68.8	0	0	0	0	110.3	Y79 C163 F241	Y79-C177 HydrophobicContact CD1-CB 3.91Å; Y79-C177 HydrophobicContact CE1-CB 3.72Å; Y79-C177 HydrophobicContact CG-CB 4.47Å; C163-C177 HydrophobicContact CB-CB 3.76Å; C163-C177 WeakPolarHBondContact CB-SG 3.31Å; C163-C177 WeakPolarHBondContact SG-CA 3.48Å; C163-C177 WeakPolarHBondContact SG-CB 3.48Å; C163-C177 CovalentContact SG-SG 2.05Å; C163-C177 PolarHBondContact SG-SG 2.99Å; C177-F241 PolarHBondContact N-O 2.62Å; C177-F241 WeakPolarHBondContact O-CD2 3.47Å; C177-F241 PolarHBondContact O-N 3.14Å
178	D	95	Very high	92.9	Very high	61 Å²	61	40.6 Å²	40.6	33%	0.326	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	153.8	-177.9	-71.2	-44	0	0	0	112.8	Y79 N127 N238 A239 T240	Y79-D178 VanDerWaalsContact OH-C 3.29Å; Y79-D178 PolarHBondContact OH-O 3.24Å; N127-D178 PolarHBondContact ND2-O 3.07Å; D178-N238 WeakPolarHBondContact CB-OD1 3.26Å; D178-N238 PolarHBondContact OD1-ND2 3.29Å; D178-A239 CarbonylContact C-O 3.54Å; D178-T240 WeakPolarHBondContact OD1-CB 3.42Å; D178-T240 WeakPolarHBondContact OD1-CG2 3.38Å; D178-T240 PolarHBondContact OD1-OG1 3.25Å
179	M	95.8	Very high	92.8	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	104.7	166.1	173.6	-173.5	-65.2	0	0	107.7	I64 I81 M83 F125 M161 I181 N238 A239 F241	I64-M179 HydrophobicContact CD1-SD 3.46Å; I64-M179 WeakPolarHBondContact CD1-SD 3.48Å; I81-M179 HydrophobicContact CD1-CE 3.91Å; I81-M179 HydrophobicContact CG2-CE 3.92Å; M83-M179 HydrophobicContact CE-CE 3.71Å; M83-M179 HydrophobicContact CE-SD 4.03Å; M83-M179 HydrophobicContact SD-CE 3.37Å; M83-M179 WeakPolarHBondContact SD-CE 3.34Å; M83-M179 HydrophobicContact SD-SD 3.96Å; F125-M179 HydrophobicContact CD1-CG 4.01Å; F125-M179 HydrophobicContact CE1-CG 4Å; F125-M179 HydrophobicContact CE1-SD 3.95Å; M161-M179 HydrophobicContact CE-CB 4.36Å; M161-M179 HydrophobicContact CE-CE 3.38Å; M161-M179 HydrophobicContact CE-CG 4.27Å; M161-M179 HydrophobicContact SD-CB 3.83Å; M161-M179 HydrophobicContact SD-CE 4.04Å; M161-M179 HydrophobicContact SD-CG 3.65Å; M179-I181 HydrophobicContact CG-CD1 4.3Å; M179-I181 HydrophobicContact CG-CG1 4.19Å; M179-I181 HydrophobicContact SD-CD1 4.11Å; M179-N238 PolarHBondContact N-OD1 3.07Å; M179-N238 WeakPolarHBondContact O-CA 3.25Å; M179-N238 PolarHBondContact O-OD1 3.32Å; M179-N238 VanDerWaalsContact O-OD1 3.07Å; M179-A239 HydrophobicContact CB-CB 4.35Å; M179-A239 PolarHBondContact N-O 2.86Å; M179-A239 PolarHBondContact O-N 2.94Å; M179-F241 HydrophobicContact CB-CE2 3.97Å; M179-F241 HydrophobicContact CE-CE2 3.91Å; M179-F241 HydrophobicContact CE-CZ 4.04Å
180	N	94.5	Very high	92.9	Very high	38 Å²	38	42.6 Å²	42.6	20%	0.203	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	116.7	-175.2	-167.7	-34.3	0	0	0	110.6	F125 R126 N127	F125-N180 CarbonylContact C-O 3.54Å; F125-N180 WeakPolarHBondContact CA-O 3.31Å; R126-N180 HydrophobicContact CB-CB 4.2Å; R126-N180 WeakPolarHBondContact CD-OD1 3.42Å; R126-N180 PolarHBondContact N-O 3.18Å; N127-N180 PolarHBondContact OD1-N 3.29Å
181	I	95.5	Very high	92.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	132.8	-176.8	-62.1	174.5	0	0	0	108.6	I64 L123 F125 M179 F193 W195 L237	I64-I181 HydrophobicContact CD1-CD1 3.66Å; L123-I181 HydrophobicContact CD1-CG2 3.69Å; L123-I181 HydrophobicContact CD2-CG2 3.61Å; L123-I181 HydrophobicContact CG-CG2 3.47Å; L123-I181 VanDerWaalsContact CG-CG2 3.47Å; F125-I181 HydrophobicContact CD1-CG1 3.83Å; F125-I181 HydrophobicContact CE1-CD1 3.84Å; F125-I181 HydrophobicContact CE1-CG1 3.65Å; M179-I181 HydrophobicContact CG-CD1 4.3Å; M179-I181 HydrophobicContact CG-CG1 4.19Å; M179-I181 HydrophobicContact SD-CD1 4.11Å; I181-F193 HydrophobicContact CG2-CD2 4.48Å; I181-W195 HydrophobicContact CD1-CH2 3.93Å; I181-L237 HydrophobicContact CB-CB 4.22Å; I181-L237 PolarHBondContact N-O 3.02Å; I181-L237 PolarHBondContact O-N 3.49Å
182	G	93.9	Very high	93	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	173.9	174.4	0	0	0	0	0	112.2	F124 F193 T235	F124-G182 WeakPolarHBondContact CD1-O 3.39Å; F124-G182 PolarHBondContact N-O 3.26Å; F124-G182 PolarHBondContact O-N 2.97Å; G182-F193 VanDerWaalsContact C-CE2 3.41Å; G182-F193 WeakPolarHBondContact O-CE2 3.5Å; G182-T235 WeakPolarHBondContact CA-O 3.41Å
183	S	93.2	Very high	93.3	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.007	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	137.1	170.7	163	0	0	0	0	110	D122 F124 Y186 Y234	D122-S183 PolarHBondContact OD1-OG 3.29Å; F124-S183 VanDerWaalsContact CE1-C 3.41Å; F124-S183 VanDerWaalsContact CE1-O 3.28Å; F124-S183 WeakPolarHBondContact CE1-O 3.41Å; S183-Y186 WeakPolarHBondContact CB-O 3.29Å; S183-Y186 WeakPolarHBondContact OG-CA 3.45Å; S183-Y186 WeakPolarHBondContact OG-CB 3.42Å; S183-Y186 PolarHBondContact OG-N 3.46Å; S183-Y186 VanDerWaalsContact OG-N 3.13Å; S183-Y186 PolarHBondContact OG-O 2.91Å; S183-Y234 WeakPolarHBondContact O-CD1 3.4Å
184	Y	90.7	Very high	93.5	Very high	178 Å²	178	44.4 Å²	44.4	70%	0.698	23%	0.229	S	C	*	.	S	Bend	trans	-84.5	-52.8	-175.3	-174.8	-99.1	0	0	0	112.2	D122 F124 Y234	D122-Y184 PolarHBondContact OD2-N 2.86Å; F124-Y184 HydrophobicContact CD1-CD2 4.29Å; F124-Y184 HydrophobicContact CD2-CD2 4.33Å; F124-Y184 HydrophobicContact CE1-CD2 4.28Å; F124-Y184 HydrophobicContact CE2-CD2 4.24Å; F124-Y184 HydrophobicContact CG-CD2 4.33Å; F124-Y184 HydrophobicContact CZ-CD2 4.22Å; Y184-Y234 WeakPolarHBondContact O-CE1 3.4Å
185	G	90.8	Very high	93.7	Very high	44 Å²	44	42 Å²	42	45%	0.454	21%	0.211	S	C	.	.	S	Bend	trans	-102.5	-31.5	-175.1	0	0	0	0	0	113.7	D122	D122-G185 WeakPolarHBondContact OD2-CA 3.28Å; D122-G185 PolarHBondContact OD2-N 2.83Å
186	Y	92.5	Very high	93.9	Very high	52 Å²	52	47.6 Å²	47.6	20%	0.204	23%	0.232	C	C	.	.			trans	-88.8	128	-176	-61.1	-69.9	0	0	0	113	W119 D122 S183 Q190 V191 Y234	W119-Y186 HydrophobicContact CZ2-CD2 4.38Å; W119-Y186 AromaticContact CZ2-CE2 3.78Å; W119-Y186 HydrophobicContact CZ2-CE2 3.78Å; W119-Y186 AromaticContact NE1-CZ 3.77Å; W119-Y186 PolarHBondContact NE1-OH 3.25Å; D122-Y186 WeakPolarHBondContact OD1-CD2 3.48Å; S183-Y186 WeakPolarHBondContact CB-O 3.29Å; S183-Y186 WeakPolarHBondContact OG-CA 3.45Å; S183-Y186 WeakPolarHBondContact OG-CB 3.42Å; S183-Y186 PolarHBondContact OG-N 3.46Å; S183-Y186 VanDerWaalsContact OG-N 3.13Å; S183-Y186 PolarHBondContact OG-O 2.91Å; Y186-Q190 HydrophobicContact CD1-CB 4.1Å; Y186-Q190 HydrophobicContact CG-CB 4.49Å; Y186-V191 HydrophobicContact CD1-CG2 4.16Å; Y186-V191 HydrophobicContact CD2-CB 4.47Å; Y186-V191 HydrophobicContact CD2-CG2 3.73Å; Y186-V191 HydrophobicContact CE2-CG2 4.47Å; Y186-V191 HydrophobicContact CG-CB 4.24Å; Y186-V191 HydrophobicContact CG-CG2 3.55Å; Y186-Y234 WeakPolarHBondContact O-CD1 3.47Å; Y186-Y234 WeakPolarHBondContact O-CE1 3.38Å
187	T	92.8	Very high	93.8	Very high	34 Å²	34	50.7 Å²	50.7	21%	0.209	25%	0.252	C	S	.	.			trans	-71.6	166.7	173.7	62.5	0	0	0	0	111.6	E189 Q190 V191 Q233 Y234	T187-E189 PolarHBondContact O-N 3.13Å; T187-E189 VanDerWaalsContact O-N 3.16Å; T187-Q190 WeakPolarHBondContact O-CB 3.36Å; T187-Q190 PolarHBondContact O-N 3.16Å; T187-V191 PolarHBondContact O-N 3.3Å; T187-Q233 CarbonylContact C-O 3.51Å; T187-Q233 WeakPolarHBondContact CA-O 3.5Å; T187-Q233 WeakPolarHBondContact CB-O 3.33Å; T187-Y234 HydrophobicContact CG2-CE1 4.48Å
188	L	92	Very high	93.6	Very high	53 Å²	53	57 Å²	57	28%	0.277	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-35	178.9	-178.5	62.4	0	0	0	113.3	T57 Q190 T224 Q233 T235	T57-L188 WeakPolarHBondContact CG2-O 3.41Å; L188-Q190 VanDerWaalsContact C-N 3.28Å; L188-Q190 PolarHBondContact O-N 3.43Å; L188-T224 HydrophobicContact CD1-CG2 3.88Å; L188-T224 HydrophobicContact CD2-CG2 3.91Å; L188-Q233 PolarHBondContact N-O 3.39Å; L188-T235 HydrophobicContact CD1-CG2 3.34Å
189	E	90	Very high	93.4	Very high	157 Å²	157	57.6 Å²	57.6	73%	0.734	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-27.2	177.9	-62.3	-179.9	-178.7	0	0	112.5	T57 T187	T57-E189 WeakPolarHBondContact CA-O 3.49Å; T57-E189 WeakPolarHBondContact CB-O 3.17Å; T57-E189 PolarHBondContact OG1-O 3.22Å; T187-E189 PolarHBondContact O-N 3.13Å; T187-E189 VanDerWaalsContact O-N 3.16Å
190	Q	92.9	Very high	93.3	Very high	62 Å²	62	59.1 Å²	59.1	29%	0.29	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-51.7	-177.1	-65.1	173.1	-35	0	0	111.6	R49 T58 Y186 T187 L188	R49-Q190 PolarHBondContact NH1-O 3.09Å; T58-Q190 PolarHBondContact N-O 3.49Å; T58-Q190 PolarHBondContact OG1-O 3.28Å; Y186-Q190 HydrophobicContact CD1-CB 4.1Å; Y186-Q190 HydrophobicContact CG-CB 4.49Å; T187-Q190 WeakPolarHBondContact O-CB 3.36Å; T187-Q190 PolarHBondContact O-N 3.16Å; L188-Q190 VanDerWaalsContact C-N 3.28Å; L188-Q190 PolarHBondContact O-N 3.43Å
191	V	94.1	Very high	93.3	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	126.6	-177.7	178.3	0	0	0	0	110	T58 V60 W119 Y186 T187 F193	T58-V191 WeakPolarHBondContact O-CA 3.27Å; V60-V191 HydrophobicContact CG2-CG1 4.08Å; W119-V191 HydrophobicContact CH2-CG2 4.11Å; W119-V191 HydrophobicContact CZ2-CG2 4.11Å; Y186-V191 HydrophobicContact CD1-CG2 4.16Å; Y186-V191 HydrophobicContact CD2-CB 4.47Å; Y186-V191 HydrophobicContact CD2-CG2 3.73Å; Y186-V191 HydrophobicContact CE2-CG2 4.47Å; Y186-V191 HydrophobicContact CG-CB 4.24Å; Y186-V191 HydrophobicContact CG-CG2 3.55Å; T187-V191 PolarHBondContact O-N 3.3Å; V191-F193 HydrophobicContact CG1-CD1 3.9Å; V191-F193 HydrophobicContact CG1-CE1 3.46Å; V191-F193 VanDerWaalsContact CG1-CE1 3.46Å; V191-F193 HydrophobicContact CG1-CZ 4.18Å
192	S	94.4	Very high	93.2	Very high	23 Å²	23	60.6 Å²	60.6	16%	0.161	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	118.6	176.6	-175.3	0	0	0	0	111.4	T58 V59 V60	T58-S192 PolarHBondContact O-N 3.11Å; V59-S192 CarbonylContact C-O 3.6Å; V59-S192 WeakPolarHBondContact CA-O 3.35Å; V60-S192 PolarHBondContact N-O 3.47Å
193	F	96.2	Very high	93.1	Very high	0 Å²	0	63 Å²	63	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	127.6	171.5	-62.3	-21.8	0	0	0	110.2	V60 V62 P121 L123 I181 G182 V191 L237	V60-F193 HydrophobicContact CB-CD1 3.75Å; V60-F193 HydrophobicContact CB-CE1 3.97Å; V60-F193 HydrophobicContact CG1-CD1 4.44Å; V60-F193 HydrophobicContact CG1-CE1 4.45Å; V60-F193 HydrophobicContact CG2-CD1 4.12Å; V60-F193 HydrophobicContact CG2-CE1 3.96Å; V60-F193 WeakPolarHBondContact O-CA 3.36Å; V62-F193 HydrophobicContact CG2-CB 4.28Å; V62-F193 HydrophobicContact CG2-CG 4.42Å; P121-F193 HydrophobicContact CB-CE1 3.95Å; P121-F193 HydrophobicContact CB-CZ 4.19Å; L123-F193 HydrophobicContact CB-CE2 3.96Å; L123-F193 HydrophobicContact CB-CZ 3.89Å; L123-F193 HydrophobicContact CG-CE2 4.07Å; L123-F193 HydrophobicContact CG-CZ 4.43Å; I181-F193 HydrophobicContact CG2-CD2 4.48Å; G182-F193 VanDerWaalsContact C-CE2 3.41Å; G182-F193 WeakPolarHBondContact O-CE2 3.5Å; V191-F193 HydrophobicContact CG1-CD1 3.9Å; V191-F193 HydrophobicContact CG1-CE1 3.46Å; V191-F193 VanDerWaalsContact CG1-CE1 3.46Å; V191-F193 HydrophobicContact CG1-CZ 4.18Å; F193-L237 HydrophobicContact CB-CD1 3.74Å; F193-L237 HydrophobicContact CB-CG 4.08Å; F193-L237 WeakPolarHBondContact O-CD2 3.31Å
194	V	96.3	Very high	93	Very high	44 Å²	44	65.2 Å²	65.2	27%	0.267	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	141.3	178.2	-63	0	0	0	0	110.1	V59 V60 T61 V62	V59-V194 HydrophobicContact CG1-CG1 4.22Å; V59-V194 HydrophobicContact CG1-CG2 3.62Å; V60-V194 PolarHBondContact O-N 2.94Å; T61-V194 CarbonylContact C-O 3.55Å; T61-V194 WeakPolarHBondContact CA-O 3.23Å; V62-V194 PolarHBondContact N-O 2.84Å
195	W	96.8	Very high	92.8	Very high	28 Å²	28	66 Å²	66	11%	0.106	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	146.2	172	-76.1	121.9	0	0	0	111	V62 I64 I181 N197 P200 V201 A220 Y221 L237 A239	V62-W195 HydrophobicContact CG1-CZ3 4.16Å; I64-W195 HydrophobicContact CD1-CH2 3.88Å; I64-W195 HydrophobicContact CD1-CZ3 3.98Å; I64-W195 HydrophobicContact CG1-CZ3 4.19Å; I181-W195 HydrophobicContact CD1-CH2 3.93Å; W195-N197 PolarHBondContact O-N 2.8Å; W195-P200 HydrophobicContact CB-CB 3.92Å; W195-P200 HydrophobicContact CD2-CB 4Å; W195-P200 HydrophobicContact CE3-CB 3.71Å; W195-P200 HydrophobicContact CG-CB 4.12Å; W195-V201 HydrophobicContact CH2-CG2 4.35Å; W195-V201 HydrophobicContact CZ3-CG2 4.27Å; W195-A220 HydrophobicContact CD2-CB 4.29Å; W195-A220 HydrophobicContact CZ2-CB 4.44Å; W195-Y221 PolarHBondContact NE1-O 3.36Å; W195-L237 HydrophobicContact CD2-CD1 4.06Å; W195-L237 HydrophobicContact CE3-CD1 4.48Å; W195-L237 HydrophobicContact CG-CD1 4.29Å; W195-L237 HydrophobicContact CG-CD2 4.27Å; W195-L237 HydrophobicContact CZ2-CB 3.75Å; W195-A239 HydrophobicContact CH2-CB 4.17Å; W195-A239 HydrophobicContact CZ2-CB 4.03Å
196	R	95.6	Very high	92.6	Very high	121 Å²	121	70.9 Å²	70.9	46%	0.457	37%	0.366	S	S	.	.			trans	-62.7	131	169.5	-172.9	179.4	-171.4	175.2	0.5	110.6	T61 V62 Y63 I198	T61-R196 HydrophobicContact CG2-CB 3.89Å; T61-R196 HydrophobicContact CG2-CG 4.35Å; V62-R196 PolarHBondContact O-N 3.21Å; Y63-R196 HydrophobicContact CD1-CB 4.39Å; Y63-R196 HydrophobicContact CG-CB 4.3Å; R196-I198 PolarHBondContact O-N 3.04Å; R196-I198 VanDerWaalsContact O-N 3.09Å
197	N	91.8	Very high	92.4	Very high	168 Å²	168	69 Å²	69	90%	0.898	36%	0.36	S	S	*	.	S	Bend	trans	-53.8	-33	-177.4	-68.9	-7.2	0	0	0	114.6	W195	W195-N197 PolarHBondContact O-N 2.8Å
198	I	90.7	Very high	92.1	Very high	134 Å²	134	75.7 Å²	75.7	69%	0.687	39%	0.389	S	S	*	.	S	Bend	trans	-118.1	121.1	-178.1	-56.3	171.3	0	0	0	108.3	R196	R196-I198 PolarHBondContact O-N 3.04Å; R196-I198 VanDerWaalsContact O-N 3.09Å
199	S	90.1	Very high	92	Very high	73 Å²	73	73.9 Å²	73.9	51%	0.51	38%	0.379	S	S	.	.			trans	50.7	66.4	177.6	-57.4	0	0	0	0	113.1	V201	S199-V201 PolarHBondContact O-N 3.34Å
200	P	94.1	Very high	91.6	Very high	31 Å²	31	71.1 Å²	71.1	20%	0.201	38%	0.377	C	S	.	.	S	Bend	trans	-60.8	-35.5	-179.8	25.2	-34.7	0	0	0	112.5	Y63 I64 W195 A220	Y63-P200 CarbonylContact C-O 3.59Å; Y63-P200 VanDerWaalsContact CA-O 3.3Å; Y63-P200 WeakPolarHBondContact CA-O 3.31Å; I64-P200 PolarHBondContact N-O 3.42Å; W195-P200 HydrophobicContact CB-CB 3.92Å; W195-P200 HydrophobicContact CD2-CB 4Å; W195-P200 HydrophobicContact CE3-CB 3.71Å; W195-P200 HydrophobicContact CG-CB 4.12Å; P200-A220 HydrophobicContact CB-CB 4.08Å; P200-A220 HydrophobicContact CG-CB 3.61Å
201	V	94.7	Very high	91.3	Very high	19 Å²	19	71.8 Å²	71.8	12%	0.115	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	124.2	173.2	-175.4	0	0	0	0	108.3	I64 V66 W195 S199 V218 A220 A239 F241	I64-V201 HydrophobicContact CB-CG2 4.42Å; I64-V201 WeakPolarHBondContact O-CA 3.49Å; V66-V201 HydrophobicContact CG2-CG1 4.01Å; W195-V201 HydrophobicContact CH2-CG2 4.35Å; W195-V201 HydrophobicContact CZ3-CG2 4.27Å; S199-V201 PolarHBondContact O-N 3.34Å; V201-V218 HydrophobicContact CB-CB 4.28Å; V201-V218 HydrophobicContact CB-CG1 4.13Å; V201-V218 HydrophobicContact CG1-CB 4.28Å; V201-V218 HydrophobicContact CG1-CG1 4.11Å; V201-V218 HydrophobicContact CG1-CG2 4.14Å; V201-V218 HydrophobicContact CG2-CG1 4.22Å; V201-A220 HydrophobicContact CG2-CB 4.23Å; V201-A239 HydrophobicContact CG2-CB 4.05Å; V201-F241 HydrophobicContact CG1-CE1 4.35Å; V201-F241 HydrophobicContact CG1-CZ 4.45Å
202	T	93.4	Very high	91.1	Very high	51 Å²	51	71.9 Å²	71.9	31%	0.313	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	131.7	176	50.1	0	0	0	0	109.5	I64 S65 V66	I64-T202 PolarHBondContact O-N 2.93Å; I64-T202 PolarHBondContact O-OG1 3.16Å; S65-T202 VanDerWaalsContact CA-OG1 3.22Å; S65-T202 WeakPolarHBondContact CA-OG1 3.42Å; S65-T202 VanDerWaalsContact CB-OG1 3.24Å; S65-T202 WeakPolarHBondContact CB-OG1 3.49Å; S65-T202 PolarHBondContact OG-OG1 3.45Å; V66-T202 PolarHBondContact N-O 2.88Å
203	L	92.4	Very high	90.9	Very high	51 Å²	51	73.4 Å²	73.4	27%	0.267	39%	0.387	S	S	.	.			trans	-106.6	149.1	174.6	-62.6	178.3	0	0	0	109.5	V66 L207 P215 V218 F241	V66-L203 HydrophobicContact CB-CD2 3.76Å; V66-L203 HydrophobicContact CG1-CD2 4.15Å; V66-L203 HydrophobicContact CG2-CD2 3.78Å; L203-L207 HydrophobicContact CD2-CD2 4.3Å; L203-P215 HydrophobicContact CD1-CB 4.48Å; L203-P215 HydrophobicContact CD1-CG 3.89Å; L203-P215 VanDerWaalsContact CD1-O 3.26Å; L203-P215 WeakPolarHBondContact CD1-O 3.36Å; L203-V218 HydrophobicContact CD1-CG2 3.64Å; L203-V218 HydrophobicContact CD2-CG2 4Å; L203-V218 HydrophobicContact CG-CG2 3.9Å; L203-F241 HydrophobicContact CD2-CE1 4.25Å
204	P	91.4	Very high	90.3	Very high	47 Å²	47	76.1 Å²	76.1	31%	0.305	41%	0.405	S	S	.	.			trans	-74.7	141.1	171.4	27.1	-21.4	0	0	0	109.8	V66 N206 L207	V66-P204 WeakPolarHBondContact O-CD 3.23Å; P204-N206 PolarHBondContact O-N 3.42Å; P204-L207 HydrophobicContact CG-CB 3.96Å; P204-L207 HydrophobicContact CG-CD1 3.91Å; P204-L207 HydrophobicContact CG-CG 4.44Å; P204-L207 WeakPolarHBondContact O-CB 3.41Å; P204-L207 PolarHBondContact O-N 3.46Å
205	E	85.7	Confident	89.7	Confident	195 Å²	195	74.3 Å²	74.3	91%	0.911	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-35.1	-177.7	-66.1	179.1	175.6	0	0	112.9
206	N	86.3	Confident	88.9	Confident	146 Å²	146	82 Å²	82	78%	0.781	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	38.8	-179.6	-63.1	-38.5	0	0	0	112	P204 Q208	P204-N206 PolarHBondContact O-N 3.42Å; N206-Q208 PolarHBondContact O-N 3Å
207	L	88.6	Confident	88.1	Confident	13 Å²	13	80.9 Å²	80.9	7%	0.068	44%	0.437	C	S	.	.			trans	-65.4	119.5	174.6	-173.2	63.9	0	0	0	109.5	I69 L203 P204 I209 P214	I69-L207 HydrophobicContact CD1-CD2 4.23Å; I69-L207 HydrophobicContact CG1-CD2 4.47Å; L203-L207 HydrophobicContact CD2-CD2 4.3Å; P204-L207 HydrophobicContact CG-CB 3.96Å; P204-L207 HydrophobicContact CG-CD1 3.91Å; P204-L207 HydrophobicContact CG-CG 4.44Å; P204-L207 WeakPolarHBondContact O-CB 3.41Å; P204-L207 PolarHBondContact O-N 3.46Å; L207-I209 HydrophobicContact CD2-CD1 4.36Å; L207-I209 HydrophobicContact CG-CG1 4.3Å; L207-P214 HydrophobicContact CB-CB 4.09Å; L207-P214 HydrophobicContact CD2-CB 4.22Å; L207-P214 HydrophobicContact CG-CB 4.24Å; L207-P214 WeakPolarHBondContact O-CB 3.32Å; L207-P214 WeakPolarHBondContact O-CG 3.31Å
208	Q	87.1	Confident	88	Confident	174 Å²	174	74 Å²	74	81%	0.813	40%	0.401	S	S	*	.			trans	-115	133.3	173.8	-67.4	-176.9	-13.9	0	0	109.2	N206	N206-Q208 PolarHBondContact O-N 3Å
209	I	89.5	Confident	88.1	Confident	14 Å²	14	74.8 Å²	74.8	7%	0.072	40%	0.395	C	S	.	.	B	Isolated β-bridge	trans	-124.5	135.2	178.2	-48.1	176.7	0	0	0	106.8	I69 V72 L207 E211 F212 L243	I69-I209 HydrophobicContact CB-CD1 3.91Å; I69-I209 HydrophobicContact CB-CG1 4.09Å; I69-I209 HydrophobicContact CD1-CD1 3.75Å; I69-I209 HydrophobicContact CG1-CD1 4.34Å; I69-I209 HydrophobicContact CG2-CD1 4.17Å; I69-I209 HydrophobicContact CG2-CG2 4.25Å; V72-I209 HydrophobicContact CG2-CG2 3.96Å; L207-I209 HydrophobicContact CD2-CD1 4.36Å; L207-I209 HydrophobicContact CG-CG1 4.3Å; I209-E211 PolarHBondContact O-N 3.35Å; I209-F212 HydrophobicContact CB-CB 4.35Å; I209-F212 HydrophobicContact CG2-CB 4.15Å; I209-F212 VanDerWaalsContact O-O 3.08Å; I209-L243 HydrophobicContact CD1-CD2 3.8Å
210	S	81.2	Confident	88.4	Confident	99 Å²	99	72.8 Å²	72.8	69%	0.692	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	132.3	174.7	-170.7	0	0	0	0	109.6	F212	S210-F212 WeakPolarHBondContact O-CD2 3.48Å; S210-F212 PolarHBondContact O-N 3.05Å; S210-F212 VanDerWaalsContact O-N 3.15Å
211	E	86.2	Confident	88.3	Confident	77 Å²	77	76.7 Å²	76.7	36%	0.36	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	-7	179.5	-51.4	-174.3	-177.8	0	0	117.6	I209 R245 Q246	I209-E211 PolarHBondContact O-N 3.35Å; E211-R245 WeakPolarHBondContact O-CG 3.17Å; E211-R245 IonicContact OE2-NH1 3.47Å; E211-Q246 PolarHBondContact O-N 3.07Å
212	F	91.5	Very high	88.3	Confident	1 Å²	1	79.9 Å²	79.9	0%	0.004	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	144.8	-177.5	-66.3	-93.1	0	0	0	111.7	V72 V74 Q175 I209 S210 L243 Q244 R245	V72-F212 HydrophobicContact CB-CD2 4.03Å; V72-F212 HydrophobicContact CB-CE2 3.67Å; V72-F212 HydrophobicContact CB-CZ 4.44Å; V72-F212 HydrophobicContact CG1-CD2 4.25Å; V72-F212 HydrophobicContact CG1-CE2 3.54Å; V72-F212 HydrophobicContact CG1-CZ 3.81Å; V72-F212 HydrophobicContact CG2-CD2 4.18Å; V72-F212 HydrophobicContact CG2-CE2 4.27Å; V74-F212 HydrophobicContact CG2-CZ 4.29Å; Q175-F212 HydrophobicContact CG-CE1 4.34Å; I209-F212 HydrophobicContact CB-CB 4.35Å; I209-F212 HydrophobicContact CG2-CB 4.15Å; I209-F212 VanDerWaalsContact O-O 3.08Å; S210-F212 WeakPolarHBondContact O-CD2 3.48Å; S210-F212 PolarHBondContact O-N 3.05Å; S210-F212 VanDerWaalsContact O-N 3.15Å; F212-L243 HydrophobicContact CB-CB 4.5Å; F212-L243 HydrophobicContact CD1-CB 3.83Å; F212-L243 HydrophobicContact CE1-CB 4.35Å; F212-L243 HydrophobicContact CG-CB 4.35Å; F212-Q244 CarbonylContact C-O 3.55Å; F212-Q244 VanDerWaalsContact CA-O 3.26Å; F212-Q244 WeakPolarHBondContact CA-O 3.22Å; F212-R245 HydrophobicContact CD1-CB 4.07Å; F212-R245 HydrophobicContact CE1-CB 3.99Å; F212-R245 HydrophobicContact CE1-CG 4.33Å
213	D	88.5	Confident	88.3	Confident	56 Å²	56	78.6 Å²	78.6	30%	0.299	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	137.6	166.4	-63.1	-43.5	0	0	0	109.2	Q244 Q246	D213-Q244 HydrophobicContact CB-CB 4.43Å; D213-Q244 PolarHBondContact N-O 2.89Å; D213-Q246 VanDerWaalsContact OD1-CG 3.28Å; D213-Q246 WeakPolarHBondContact OD1-CG 3.46Å; D213-Q246 PolarHBondContact OD1-NE2 3.45Å
214	P	85	Confident	88.1	Confident	57 Å²	57	77.1 Å²	77.1	37%	0.37	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-62	145.3	178	27.8	-35.2	0	0	0	110.6	L207 E216	L207-P214 HydrophobicContact CB-CB 4.09Å; L207-P214 HydrophobicContact CD2-CB 4.22Å; L207-P214 HydrophobicContact CG-CB 4.24Å; L207-P214 WeakPolarHBondContact O-CB 3.32Å; L207-P214 WeakPolarHBondContact O-CG 3.31Å; P214-E216 PolarHBondContact O-N 3.45Å
215	P	84.1	Confident	87.7	Confident	6 Å²	6	81 Å²	81	4%	0.039	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-64.6	124.9	177.6	23.5	-28.8	0	0	0	110.1	L203 V217 F241 T242 L243	L203-P215 HydrophobicContact CD1-CB 4.48Å; L203-P215 HydrophobicContact CD1-CG 3.89Å; L203-P215 VanDerWaalsContact CD1-O 3.26Å; L203-P215 WeakPolarHBondContact CD1-O 3.36Å; P215-V217 VanDerWaalsContact C-N 3.32Å; P215-F241 HydrophobicContact CG-CD1 4.35Å; P215-T242 WeakPolarHBondContact CA-O 3.3Å; P215-T242 WeakPolarHBondContact CB-O 3.38Å; P215-L243 HydrophobicContact CG-CD2 4.19Å
216	E	79.8	Confident	87.4	Confident	190 Å²	190	75.2 Å²	75.2	89%	0.888	42%	0.418	S	S	*	.	S	Bend	trans	-67	-35.8	175.1	-66.4	-175.8	176.1	0	0	111.7	P214	P214-E216 PolarHBondContact O-N 3.45Å
217	V	78.3	Confident	87	Confident	97 Å²	97	72.1 Å²	72.1	59%	0.588	40%	0.396	S	S	*	.			trans	-139.4	136.2	-179.1	-177.2	0	0	0	0	110.1	P215	P215-V217 VanDerWaalsContact C-N 3.32Å
218	V	90.2	Very high	86.8	Confident	23 Å²	23	75.7 Å²	75.7	14%	0.139	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	124.7	169.7	-175.5	0	0	0	0	108.7	V201 L203 A220 A239 T240 F241	V201-V218 HydrophobicContact CB-CB 4.28Å; V201-V218 HydrophobicContact CB-CG1 4.13Å; V201-V218 HydrophobicContact CG1-CB 4.28Å; V201-V218 HydrophobicContact CG1-CG1 4.11Å; V201-V218 HydrophobicContact CG1-CG2 4.14Å; V201-V218 HydrophobicContact CG2-CG1 4.22Å; L203-V218 HydrophobicContact CD1-CG2 3.64Å; L203-V218 HydrophobicContact CD2-CG2 4Å; L203-V218 HydrophobicContact CG-CG2 3.9Å; V218-A220 PolarHBondContact O-N 2.96Å; V218-A239 HydrophobicContact CG1-CB 4.1Å; V218-T240 WeakPolarHBondContact CG1-O 3.32Å; V218-F241 HydrophobicContact CG1-CD1 4.14Å; V218-F241 HydrophobicContact CG1-CE1 4Å; V218-F241 HydrophobicContact CG1-CZ 4.3Å; V218-F241 HydrophobicContact CG2-CD1 3.74Å; V218-F241 HydrophobicContact CG2-CE1 3.77Å
219	R	93.2	Very high	86.8	Confident	150 Å²	150	69.6 Å²	69.6	57%	0.566	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85	99.7	175.6	-65.1	-178.7	-175.8	148.1	1.3	109.2	E176 A239 T240	E176-R219 IonicContact OE1-NH1 3.77Å; E176-R219 PolarHBondContact OE1-NH1 3.41Å; R219-A239 WeakPolarHBondContact O-CA 3.3Å; R219-T240 PolarHBondContact N-O 2.92Å; R219-T240 VanDerWaalsContact N-O 3.12Å; R219-T240 PolarHBondContact O-N 3.46Å
220	A	94.5	Very high	86.8	Confident	32 Å²	32	75 Å²	75	26%	0.264	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	123.9	173.5	0	0	0	0	0	110.2	W195 P200 V201 V218 N238	W195-A220 HydrophobicContact CD2-CB 4.29Å; W195-A220 HydrophobicContact CZ2-CB 4.44Å; P200-A220 HydrophobicContact CB-CB 4.08Å; P200-A220 HydrophobicContact CG-CB 3.61Å; V201-A220 HydrophobicContact CG2-CB 4.23Å; V218-A220 PolarHBondContact O-N 2.96Å; A220-N238 WeakPolarHBondContact CA-O 3.38Å
221	Y	93.7	Very high	87.2	Confident	112 Å²	112	75.1 Å²	75.1	44%	0.439	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	162.8	-179.2	65.7	-84	0	0	0	112.1	W195 C223 N238	W195-Y221 PolarHBondContact NE1-O 3.36Å; Y221-C223 HydrophobicContact CD2-CB 4.45Å; Y221-C223 HydrophobicContact CE2-CB 4.04Å; Y221-N238 HydrophobicContact CD1-CB 4.45Å; Y221-N238 HydrophobicContact CE1-CB 3.94Å; Y221-N238 HydrophobicContact CE2-CB 4.16Å; Y221-N238 PolarHBondContact N-O 2.92Å; Y221-N238 PolarHBondContact O-N 3.22Å; Y221-N238 PolarHBondContact OH-ND2 3.49Å
222	D	93.8	Very high	87.4	Confident	86 Å²	86	72.6 Å²	72.6	46%	0.46	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	121.8	175.1	-172.9	-15.4	0	0	0	109.5	T224 L237	D222-T224 WeakPolarHBondContact OD1-CB 3.33Å; D222-T224 PolarHBondContact OD1-N 3.05Å; D222-T224 PolarHBondContact OD1-OG1 3.09Å; D222-L237 HydrophobicContact CB-CD2 4.23Å
223	C	92.8	Very high	87.4	Confident	24 Å²	24	78.3 Å²	78.3	16%	0.162	45%	0.454	C	S	.	.			trans	-105.6	11.6	179.4	47.4	0	0	0	0	113.3	Y221 S225 G226 C236	Y221-C223 HydrophobicContact CD2-CB 4.45Å; Y221-C223 HydrophobicContact CE2-CB 4.04Å; C223-S225 VanDerWaalsContact C-N 3.27Å; C223-S225 PolarHBondContact O-N 3.36Å; C223-G226 PolarHBondContact O-N 2.87Å; C223-C236 HydrophobicContact CB-CB 3.97Å; C223-C236 WeakPolarHBondContact CB-SG 3.29Å; C223-C236 PolarHBondContact N-O 3.37Å; C223-C236 WeakPolarHBondContact SG-CB 3.3Å; C223-C236 PolarHBondContact SG-O 3.4Å; C223-C236 CovalentContact SG-SG 2.04Å; C223-C236 PolarHBondContact SG-SG 2.79Å
224	T	89.8	Confident	87.6	Confident	21 Å²	21	76.7 Å²	76.7	13%	0.129	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-58.7	-36.1	-174.4	-60.1	0	0	0	0	112.7	L188 D222 G226 Y227 C236	L188-T224 HydrophobicContact CD1-CG2 3.88Å; L188-T224 HydrophobicContact CD2-CG2 3.91Å; D222-T224 WeakPolarHBondContact OD1-CB 3.33Å; D222-T224 PolarHBondContact OD1-N 3.05Å; D222-T224 PolarHBondContact OD1-OG1 3.09Å; T224-G226 PolarHBondContact O-N 2.99Å; T224-Y227 PolarHBondContact O-N 2.89Å; T224-C236 PolarHBondContact N-O 3.05Å; T224-C236 PolarHBondContact OG1-N 3.48Å; T224-C236 PolarHBondContact OG1-O 2.95Å
225	S	83.1	Confident	88	Confident	129 Å²	129	74 Å²	74	90%	0.902	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-62.1	-28	-178.7	58.4	0	0	0	0	114.2	C223	C223-S225 VanDerWaalsContact C-N 3.27Å; C223-S225 PolarHBondContact O-N 3.36Å
226	G	77.7	Confident	88.5	Confident	72 Å²	72	73.9 Å²	73.9	74%	0.742	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-94.8	0.5	-178.5	0	0	0	0	0	114.4	C223 T224	C223-G226 PolarHBondContact O-N 2.87Å; T224-G226 PolarHBondContact O-N 2.99Å
227	Y	78.2	Confident	89.2	Confident	81 Å²	81	64.8 Å²	64.8	32%	0.318	38%	0.383	S	S	.	.			trans	-122.7	101.4	-168	-165.6	-92.9	0	0	0	113.1	R126 T224 T229 C236	R126-Y227 VanDerWaalsContact NH1-CE2 3.31Å; R126-Y227 VanDerWaalsContact NH1-CG 3.26Å; T224-Y227 PolarHBondContact O-N 2.89Å; Y227-T229 HydrophobicContact CD1-CG2 4.21Å; Y227-T229 HydrophobicContact CE1-CG2 3.3Å; Y227-T229 WeakPolarHBondContact OH-CG2 3.07Å; Y227-C236 HydrophobicContact CG-CB 4.5Å
228	S	84.5	Confident	90	Very high	88 Å²	88	60.5 Å²	60.5	62%	0.615	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.2	138.6	167.2	58.9	0	0	0	0	110.1
229	T	87.4	Confident	90.3	Very high	46 Å²	46	59.4 Å²	59.4	28%	0.282	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	172	175.7	66.1	0	0	0	0	109.8	Y227 T231 G232 Y234	Y227-T229 HydrophobicContact CD1-CG2 4.21Å; Y227-T229 HydrophobicContact CE1-CG2 3.3Å; Y227-T229 WeakPolarHBondContact OH-CG2 3.07Å; T229-T231 PolarHBondContact O-N 2.89Å; T229-T231 PolarHBondContact OG1-N 3.07Å; T229-T231 PolarHBondContact OG1-OG1 3.25Å; T229-G232 PolarHBondContact N-O 2.97Å; T229-G232 PolarHBondContact O-N 3.44Å; T229-G232 PolarHBondContact OG1-N 3.21Å; T229-G232 PolarHBondContact OG1-O 3.24Å; T229-Y234 HydrophobicContact CG2-CD2 4.31Å; T229-Y234 WeakPolarHBondContact OG1-CD2 3.28Å; T229-Y234 WeakPolarHBondContact OG1-CE2 3.42Å
230	S	89.3	Confident	90.4	Very high	129 Å²	129	52.7 Å²	52.7	90%	0.902	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-24.3	175.6	51.9	0	0	0	0	113.7
231	T	90.4	Very high	90.4	Very high	101 Å²	101	51.2 Å²	51.2	62%	0.62	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-13.4	-179.1	54.2	0	0	0	0	113.5	T229 Y234	T229-T231 PolarHBondContact O-N 2.89Å; T229-T231 PolarHBondContact OG1-N 3.07Å; T229-T231 PolarHBondContact OG1-OG1 3.25Å; T231-Y234 VanDerWaalsContact OG1-CE2 3.31Å; T231-Y234 WeakPolarHBondContact OG1-CE2 3.05Å; T231-Y234 PolarHBondContact OG1-OH 3.45Å
232	G	89.7	Confident	90.4	Very high	23 Å²	23	47.6 Å²	47.6	24%	0.237	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	149.7	-174.2	179.3	0	0	0	0	0	114.1	T229 Y234	T229-G232 PolarHBondContact N-O 2.97Å; T229-G232 PolarHBondContact O-N 3.44Å; T229-G232 PolarHBondContact OG1-N 3.21Å; T229-G232 PolarHBondContact OG1-O 3.24Å; G232-Y234 WeakPolarHBondContact O-CD2 3.37Å
233	Q	92.4	Very high	90.3	Very high	121 Å²	121	43.5 Å²	43.5	57%	0.565	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	131.2	172.1	-69.2	-175.2	-15.8	0	0	110	T187 L188	T187-Q233 CarbonylContact C-O 3.51Å; T187-Q233 WeakPolarHBondContact CA-O 3.5Å; T187-Q233 WeakPolarHBondContact CB-O 3.33Å; L188-Q233 PolarHBondContact N-O 3.39Å
234	Y	92.4	Very high	90.2	Very high	22 Å²	22	46.1 Å²	46.1	9%	0.086	29%	0.291	C	S	.	.			trans	-127.5	151.7	-177.3	-66.4	-95.6	0	0	0	109.3	S183 Y184 Y186 T187 T229 T231 G232	S183-Y234 WeakPolarHBondContact O-CD1 3.4Å; Y184-Y234 WeakPolarHBondContact O-CE1 3.4Å; Y186-Y234 WeakPolarHBondContact O-CD1 3.47Å; Y186-Y234 WeakPolarHBondContact O-CE1 3.38Å; T187-Y234 HydrophobicContact CG2-CE1 4.48Å; T229-Y234 HydrophobicContact CG2-CD2 4.31Å; T229-Y234 WeakPolarHBondContact OG1-CD2 3.28Å; T229-Y234 WeakPolarHBondContact OG1-CE2 3.42Å; T231-Y234 VanDerWaalsContact OG1-CE2 3.31Å; T231-Y234 WeakPolarHBondContact OG1-CE2 3.05Å; T231-Y234 PolarHBondContact OG1-OH 3.45Å; G232-Y234 WeakPolarHBondContact O-CD2 3.37Å
235	T	92.7	Very high	90.3	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	29%	0.286	C	S	.	.			trans	-63.3	146.1	172.4	44.9	0	0	0	0	112.4	R126 G182 L188	R126-T235 PolarHBondContact NH2-O 3.47Å; G182-T235 WeakPolarHBondContact CA-O 3.41Å; L188-T235 HydrophobicContact CD1-CG2 3.34Å
236	C	94.2	Very high	90.7	Very high	4 Å²	4	43.6 Å²	43.6	3%	0.027	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	114.1	178.2	-178.9	0	0	0	0	107.8	C223 T224 Y227	C223-C236 HydrophobicContact CB-CB 3.97Å; C223-C236 WeakPolarHBondContact CB-SG 3.29Å; C223-C236 PolarHBondContact N-O 3.37Å; C223-C236 WeakPolarHBondContact SG-CB 3.3Å; C223-C236 PolarHBondContact SG-O 3.4Å; C223-C236 CovalentContact SG-SG 2.04Å; C223-C236 PolarHBondContact SG-SG 2.79Å; T224-C236 PolarHBondContact N-O 3.05Å; T224-C236 PolarHBondContact OG1-N 3.48Å; T224-C236 PolarHBondContact OG1-O 2.95Å; Y227-C236 HydrophobicContact CG-CB 4.5Å
237	L	95.6	Very high	91.3	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	126.6	170.6	-65.8	-172.4	0	0	0	108.1	V62 I181 F193 W195 D222	V62-L237 HydrophobicContact CB-CD1 4.08Å; V62-L237 HydrophobicContact CG2-CD1 4.22Å; I181-L237 HydrophobicContact CB-CB 4.22Å; I181-L237 PolarHBondContact N-O 3.02Å; I181-L237 PolarHBondContact O-N 3.49Å; F193-L237 HydrophobicContact CB-CD1 3.74Å; F193-L237 HydrophobicContact CB-CG 4.08Å; F193-L237 WeakPolarHBondContact O-CD2 3.31Å; W195-L237 HydrophobicContact CD2-CD1 4.06Å; W195-L237 HydrophobicContact CE3-CD1 4.48Å; W195-L237 HydrophobicContact CG-CD1 4.29Å; W195-L237 HydrophobicContact CG-CD2 4.27Å; W195-L237 HydrophobicContact CZ2-CB 3.75Å; D222-L237 HydrophobicContact CB-CD2 4.23Å
238	N	95.6	Very high	92	Very high	6 Å²	6	40.5 Å²	40.5	3%	0.032	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	141	176.3	-163.6	26	0	0	0	111.1	D178 M179 A220 Y221	D178-N238 WeakPolarHBondContact CB-OD1 3.26Å; D178-N238 PolarHBondContact OD1-ND2 3.29Å; M179-N238 PolarHBondContact N-OD1 3.07Å; M179-N238 WeakPolarHBondContact O-CA 3.25Å; M179-N238 PolarHBondContact O-OD1 3.32Å; M179-N238 VanDerWaalsContact O-OD1 3.07Å; A220-N238 WeakPolarHBondContact CA-O 3.38Å; Y221-N238 HydrophobicContact CD1-CB 4.45Å; Y221-N238 HydrophobicContact CE1-CB 3.94Å; Y221-N238 HydrophobicContact CE2-CB 4.16Å; Y221-N238 PolarHBondContact N-O 2.92Å; Y221-N238 PolarHBondContact O-N 3.22Å; Y221-N238 PolarHBondContact OH-ND2 3.49Å
239	A	96	Very high	92.3	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	116.4	168.3	0	0	0	0	0	109.5	D178 M179 W195 V201 V218 R219 F241	D178-A239 CarbonylContact C-O 3.54Å; M179-A239 HydrophobicContact CB-CB 4.35Å; M179-A239 PolarHBondContact N-O 2.86Å; M179-A239 PolarHBondContact O-N 2.94Å; W195-A239 HydrophobicContact CH2-CB 4.17Å; W195-A239 HydrophobicContact CZ2-CB 4.03Å; V201-A239 HydrophobicContact CG2-CB 4.05Å; V218-A239 HydrophobicContact CG1-CB 4.1Å; R219-A239 WeakPolarHBondContact O-CA 3.3Å; A239-F241 HydrophobicContact CB-CE2 4.49Å
240	T	95.4	Very high	92.5	Very high	9 Å²	9	41.4 Å²	41.4	6%	0.055	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	122.6	-178	-51	0	0	0	0	110.5	E176 D178 V218 R219	E176-T240 HydrophobicContact CB-CG2 3.87Å; E176-T240 HydrophobicContact CG-CG2 4.32Å; D178-T240 WeakPolarHBondContact OD1-CB 3.42Å; D178-T240 WeakPolarHBondContact OD1-CG2 3.38Å; D178-T240 PolarHBondContact OD1-OG1 3.25Å; V218-T240 WeakPolarHBondContact CG1-O 3.32Å; R219-T240 PolarHBondContact N-O 2.92Å; R219-T240 VanDerWaalsContact N-O 3.12Å; R219-T240 PolarHBondContact O-N 3.46Å
241	F	93.8	Very high	92.7	Very high	1 Å²	1	37.9 Å²	37.9	0%	0.004	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	115.9	174.7	-59	-89.7	0	0	0	109.6	V66 I69 Y79 I81 C177 M179 V201 L203 P215 V218 A239	V66-F241 HydrophobicContact CG2-CE1 4.13Å; V66-F241 HydrophobicContact CG2-CZ 4.34Å; I69-F241 HydrophobicContact CD1-CD1 4.34Å; Y79-F241 HydrophobicContact CE2-CD2 4.44Å; I81-F241 HydrophobicContact CD1-CE1 4.06Å; I81-F241 HydrophobicContact CD1-CE2 4.25Å; I81-F241 HydrophobicContact CD1-CZ 3.7Å; C177-F241 PolarHBondContact N-O 2.62Å; C177-F241 WeakPolarHBondContact O-CD2 3.47Å; C177-F241 PolarHBondContact O-N 3.14Å; M179-F241 HydrophobicContact CB-CE2 3.97Å; M179-F241 HydrophobicContact CE-CE2 3.91Å; M179-F241 HydrophobicContact CE-CZ 4.04Å; V201-F241 HydrophobicContact CG1-CE1 4.35Å; V201-F241 HydrophobicContact CG1-CZ 4.45Å; L203-F241 HydrophobicContact CD2-CE1 4.25Å; P215-F241 HydrophobicContact CG-CD1 4.35Å; V218-F241 HydrophobicContact CG1-CD1 4.14Å; V218-F241 HydrophobicContact CG1-CE1 4Å; V218-F241 HydrophobicContact CG1-CZ 4.3Å; V218-F241 HydrophobicContact CG2-CD1 3.74Å; V218-F241 HydrophobicContact CG2-CE1 3.77Å; A239-F241 HydrophobicContact CB-CE2 4.49Å
242	T	92.8	Very high	92.9	Very high	36 Å²	36	36 Å²	36	22%	0.221	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	103.7	177	52.1	0	0	0	0	110.4	E176 P215	E176-T242 HydrophobicContact CG-CG2 4.2Å; P215-T242 WeakPolarHBondContact CA-O 3.3Å; P215-T242 WeakPolarHBondContact CB-O 3.38Å
243	L	91.9	Very high	93	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	119.6	-177.1	-55.7	175.9	0	0	0	109.9	I69 V72 T174 Q175 I209 F212 P215	I69-L243 HydrophobicContact CD1-CD2 4.3Å; V72-L243 HydrophobicContact CG1-CD1 4.46Å; V72-L243 HydrophobicContact CG2-CD1 3.92Å; T174-L243 WeakPolarHBondContact CA-O 3.28Å; Q175-L243 PolarHBondContact N-O 3.4Å; Q175-L243 PolarHBondContact O-N 3.15Å; I209-L243 HydrophobicContact CD1-CD2 3.8Å; F212-L243 HydrophobicContact CB-CB 4.5Å; F212-L243 HydrophobicContact CD1-CB 3.83Å; F212-L243 HydrophobicContact CE1-CB 4.35Å; F212-L243 HydrophobicContact CG-CB 4.35Å; P215-L243 HydrophobicContact CG-CD2 4.19Å
244	Q	90.7	Very high	93	Very high	78 Å²	78	32.1 Å²	32.1	36%	0.364	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	130.1	176.1	-171.4	-177.1	-44.6	0	0	110.1	F212 D213	F212-Q244 CarbonylContact C-O 3.55Å; F212-Q244 VanDerWaalsContact CA-O 3.26Å; F212-Q244 WeakPolarHBondContact CA-O 3.22Å; D213-Q244 HydrophobicContact CB-CB 4.43Å; D213-Q244 PolarHBondContact N-O 2.89Å
245	R	92.6	Very high	93.1	Very high	8 Å²	8	31.1 Å²	31.1	3%	0.03	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	138.3	-179	-167	-179.3	-53.9	-77.2	-5.9	112.2	F170 P171 D173 E211 F212	F170-R245 VanDerWaalsContact CE2-CZ 3.47Å; P171-R245 WeakPolarHBondContact O-CD 3.47Å; D173-R245 PolarHBondContact O-N 3.45Å; D173-R245 WeakPolarHBondContact OD1-CD 3.21Å; D173-R245 IonicContact OD1-CZ 3.22Å; D173-R245 IonicContact OD1-NE 2.68Å; D173-R245 PolarHBondContact OD1-NE 2.9Å; D173-R245 IonicContact OD1-NH2 3.55Å; D173-R245 IonicContact OD2-CZ 3.58Å; D173-R245 IonicContact OD2-NE 2.8Å; D173-R245 PolarHBondContact OD2-NE 3.21Å; D173-R245 IonicContact OD2-NH2 2.9Å; D173-R245 PolarHBondContact OD2-NH2 2.96Å; E211-R245 WeakPolarHBondContact O-CG 3.17Å; E211-R245 IonicContact OE2-NH1 3.47Å; F212-R245 HydrophobicContact CD1-CB 4.07Å; F212-R245 HydrophobicContact CE1-CB 3.99Å; F212-R245 HydrophobicContact CE1-CG 4.33Å
246	Q	91.4	Very high	93.2	Very high	90 Å²	90	35.3 Å²	35.3	42%	0.421	20%	0.197	S	C	.	.	P	Polyproline II helix	trans	-79.3	120.3	173	-68.5	-174.4	-15.7	0	0	111.5	E211 D213	E211-Q246 PolarHBondContact O-N 3.07Å; D213-Q246 VanDerWaalsContact OD1-CG 3.28Å; D213-Q246 WeakPolarHBondContact OD1-CG 3.46Å; D213-Q246 PolarHBondContact OD1-NE2 3.45Å
247	L	91.1	Very high	93.2	Very high	39 Å²	39	36.9 Å²	36.9	20%	0.204	21%	0.208	C	C	.	.	S	Bend	trans	-76.9	-21.5	-175.3	-176.5	60.8	0	0	0	113.8	P171 M172 Y249 W250 L251 W501 L505	P171-L247 HydrophobicContact CG-CD1 3.88Å; M172-L247 HydrophobicContact CG-CD1 3.94Å; M172-L247 HydrophobicContact CG-CD2 4.29Å; L247-Y249 PolarHBondContact O-N 3.21Å; L247-W250 HydrophobicContact CD1-CB 4.42Å; L247-W250 PolarHBondContact O-N 3.46Å; L247-W250 VanDerWaalsContact O-N 3.13Å; L247-L251 HydrophobicContact CD1-CG 4.39Å; L247-L251 HydrophobicContact CD2-CD1 4.06Å; L247-L251 HydrophobicContact CD2-CG 4.36Å; L247-L251 HydrophobicContact CG-CD1 3.84Å; L247-L251 HydrophobicContact CG-CG 3.87Å; L247-L251 PolarHBondContact O-N 3.37Å; L247-W501 HydrophobicContact CD2-CZ3 4.07Å; L247-L505 HydrophobicContact CD2-CD2 4.16Å
248	G	91.3	Very high	93.2	Very high	49 Å²	49	37 Å²	37	51%	0.505	21%	0.208	S	C	.	.	H	α-helix	trans	-57.4	-43.8	-170.1	0	0	0	0	0	114.6	W250 L251 A252	G248-W250 PolarHBondContact O-N 3.42Å; G248-L251 PolarHBondContact O-N 2.7Å; G248-A252 PolarHBondContact O-N 3.46Å; G248-A252 VanDerWaalsContact O-N 3.17Å
249	Y	91.5	Very high	93.1	Very high	139 Å²	139	39.2 Å²	39.2	55%	0.545	22%	0.219	S	C	.	.	H	α-helix	trans	-62	-43.2	177.3	171.3	-101.9	0	0	0	112.3	L247 A252 S253	L247-Y249 PolarHBondContact O-N 3.21Å; Y249-A252 PolarHBondContact O-N 3.19Å; Y249-S253 WeakPolarHBondContact CE2-OG 3.16Å; Y249-S253 VanDerWaalsContact O-CB 3.3Å; Y249-S253 WeakPolarHBondContact O-CB 3.07Å; Y249-S253 PolarHBondContact O-N 3.03Å; Y249-S253 PolarHBondContact O-OG 2.91Å
250	W	92.8	Very high	93.1	Very high	13 Å²	13	44.2 Å²	44.2	5%	0.049	25%	0.245	C	C	.	.	H	α-helix	trans	-69.4	-34.7	-179.3	-70.3	94.6	0	0	0	112.3	F170 P171 L247 G248 T254 Y255 Y297 I310	F170-W250 HydrophobicContact CE1-CD2 4.33Å; F170-W250 HydrophobicContact CE1-CE3 4.19Å; F170-W250 AromaticContact CE1-CH2 3.72Å; F170-W250 HydrophobicContact CE1-CH2 3.72Å; F170-W250 AromaticContact CE1-CZ2 3.9Å; F170-W250 HydrophobicContact CE1-CZ2 3.9Å; F170-W250 AromaticContact CE1-CZ3 3.87Å; F170-W250 HydrophobicContact CE1-CZ3 3.87Å; F170-W250 HydrophobicContact CE2-CZ2 4.38Å; F170-W250 HydrophobicContact CZ-CD2 4.32Å; F170-W250 AromaticContact CZ-CE2 3.67Å; F170-W250 AromaticContact CZ-CH2 3.56Å; F170-W250 HydrophobicContact CZ-CH2 3.56Å; F170-W250 AromaticContact CZ-CZ2 3.31Å; F170-W250 HydrophobicContact CZ-CZ2 3.31Å; F170-W250 HydrophobicContact CZ-CZ3 4.16Å; P171-W250 HydrophobicContact CB-CB 4.15Å; P171-W250 HydrophobicContact CB-CD2 3.89Å; P171-W250 HydrophobicContact CB-CG 3.59Å; P171-W250 HydrophobicContact CG-CB 3.8Å; P171-W250 HydrophobicContact CG-CD2 4.2Å; P171-W250 HydrophobicContact CG-CG 3.77Å; L247-W250 HydrophobicContact CD1-CB 4.42Å; L247-W250 PolarHBondContact O-N 3.46Å; L247-W250 VanDerWaalsContact O-N 3.13Å; G248-W250 PolarHBondContact O-N 3.42Å; W250-T254 WeakPolarHBondContact O-CB 3.48Å; W250-T254 PolarHBondContact O-N 3.43Å; W250-Y255 HydrophobicContact CB-CE2 4.38Å; W250-Y255 WeakPolarHBondContact O-CD2 3.26Å; W250-Y255 PolarHBondContact O-N 3.05Å; W250-Y255 VanDerWaalsContact O-N 3.15Å; W250-Y297 HydrophobicContact CZ3-CG 4.42Å; W250-I310 HydrophobicContact CE3-CD1 3.77Å; W250-I310 HydrophobicContact CZ3-CD1 3.71Å
251	L	93.4	Very high	93.1	Very high	56 Å²	56	45.2 Å²	45.2	29%	0.293	25%	0.25	S	S	.	.	I	π-helix	trans	-61.1	-51.4	172.7	-74.2	169	0	0	0	111.5	L247 G248 Y255 I256 W501	L247-L251 HydrophobicContact CD1-CG 4.39Å; L247-L251 HydrophobicContact CD2-CD1 4.06Å; L247-L251 HydrophobicContact CD2-CG 4.36Å; L247-L251 HydrophobicContact CG-CD1 3.84Å; L247-L251 HydrophobicContact CG-CG 3.87Å; L247-L251 PolarHBondContact O-N 3.37Å; G248-L251 PolarHBondContact O-N 2.7Å; L251-Y255 HydrophobicContact CD2-CD2 4.13Å; L251-Y255 HydrophobicContact CD2-CG 4.3Å; L251-Y255 PolarHBondContact O-N 2.83Å; L251-I256 WeakPolarHBondContact O-CB 3.21Å; L251-I256 VanDerWaalsContact O-CG1 3.3Å; L251-I256 WeakPolarHBondContact O-CG1 3.44Å; L251-I256 PolarHBondContact O-N 3.48Å; L251-W501 HydrophobicContact CD2-CH2 3.37Å; L251-W501 HydrophobicContact CD2-CZ2 3.82Å; L251-W501 HydrophobicContact CD2-CZ3 4.26Å
252	A	94	Very high	93.1	Very high	61 Å²	61	45.2 Å²	45.2	50%	0.504	25%	0.25	S	S	.	.	I	π-helix	trans	-68.7	-39.1	-177.3	0	0	0	0	0	113.2	G248 Y249 P257	G248-A252 PolarHBondContact O-N 3.46Å; G248-A252 VanDerWaalsContact O-N 3.17Å; Y249-A252 PolarHBondContact O-N 3.19Å; A252-P257 WeakPolarHBondContact O-CD 3.44Å; A252-P257 WeakPolarHBondContact O-CG 3.41Å
253	S	91.6	Very high	93.1	Very high	53 Å²	53	46.6 Å²	46.6	37%	0.371	26%	0.258	S	S	.	.	I	π-helix	trans	-90.3	-27.6	-172.1	-55.3	0	0	0	0	114	Y249	Y249-S253 WeakPolarHBondContact CE2-OG 3.16Å; Y249-S253 VanDerWaalsContact O-CB 3.3Å; Y249-S253 WeakPolarHBondContact O-CB 3.07Å; Y249-S253 PolarHBondContact O-N 3.03Å; Y249-S253 PolarHBondContact O-OG 2.91Å
254	T	92.6	Very high	93.1	Very high	9 Å²	9	49.5 Å²	49.5	6%	0.055	28%	0.276	C	S	.	.	I	π-helix	trans	-123.1	-56.1	-173.4	-52.2	0	0	0	0	112.7	W250 N258 Y297 I310	W250-T254 WeakPolarHBondContact O-CB 3.48Å; W250-T254 PolarHBondContact O-N 3.43Å; T254-N258 VanDerWaalsContact O-CB 3.28Å; T254-N258 WeakPolarHBondContact O-CB 3.42Å; T254-N258 VanDerWaalsContact O-CG 3.24Å; T254-N258 PolarHBondContact O-N 3.08Å; T254-N258 VanDerWaalsContact O-N 3.12Å; T254-N258 PolarHBondContact O-ND2 3.03Å; T254-Y297 HydrophobicContact CG2-CD1 3.97Å; T254-Y297 HydrophobicContact CG2-CE1 4.05Å; T254-I310 HydrophobicContact CG2-CD1 4.26Å
255	Y	94.2	Very high	93.3	Very high	1 Å²	1	45.9 Å²	45.9	0%	0.004	26%	0.259	C	S	.	.	I	π-helix	trans	-68.8	-49.7	-172.9	-69.9	-85	0	0	0	112.6	P171 W250 L251 N258 I259 W313 Y500 W501	P171-Y255 WeakPolarHBondContact CD-OH 3.49Å; P171-Y255 HydrophobicContact CG-CE2 4.07Å; W250-Y255 HydrophobicContact CB-CE2 4.38Å; W250-Y255 WeakPolarHBondContact O-CD2 3.26Å; W250-Y255 PolarHBondContact O-N 3.05Å; W250-Y255 VanDerWaalsContact O-N 3.15Å; L251-Y255 HydrophobicContact CD2-CD2 4.13Å; L251-Y255 HydrophobicContact CD2-CG 4.3Å; L251-Y255 PolarHBondContact O-N 2.83Å; Y255-N258 PolarHBondContact O-N 3.41Å; Y255-I259 WeakPolarHBondContact O-CG1 3.27Å; Y255-I259 PolarHBondContact O-N 3.25Å; Y255-W313 AromaticContact CD1-CD2 3.58Å; Y255-W313 HydrophobicContact CD1-CD2 3.58Å; Y255-W313 AromaticContact CD1-CE2 3.49Å; Y255-W313 VanDerWaalsContact CD1-CE2 3.49Å; Y255-W313 AromaticContact CD1-CE3 3.93Å; Y255-W313 HydrophobicContact CD1-CE3 3.93Å; Y255-W313 HydrophobicContact CD1-CG 4.04Å; Y255-W313 HydrophobicContact CD1-CH2 4.1Å; Y255-W313 AromaticContact CD1-CZ2 3.78Å; Y255-W313 HydrophobicContact CD1-CZ2 3.78Å; Y255-W313 HydrophobicContact CD1-CZ3 4.17Å; Y255-W313 AromaticContact CD1-NE1 3.88Å; Y255-W313 HydrophobicContact CE1-CB 4.19Å; Y255-W313 AromaticContact CE1-CD2 3.54Å; Y255-W313 HydrophobicContact CE1-CD2 3.54Å; Y255-W313 AromaticContact CE1-CE2 3.96Å; Y255-W313 AromaticContact CE1-CE3 3.84Å; Y255-W313 HydrophobicContact CE1-CE3 3.84Å; Y255-W313 AromaticContact CE1-CG 3.68Å; Y255-W313 HydrophobicContact CE1-CG 3.68Å; Y255-W313 HydrophobicContact CE1-CZ3 4.46Å; Y255-Y500 AromaticContact CE1-CE1 3.74Å; Y255-Y500 HydrophobicContact CE1-CE1 3.74Å; Y255-Y500 PolarHBondContact OH-OH 3.09Å; Y255-W501 AromaticContact CD1-CH2 3.95Å; Y255-W501 HydrophobicContact CD1-CH2 3.95Å; Y255-W501 AromaticContact CD1-CZ2 3.67Å; Y255-W501 HydrophobicContact CD1-CZ2 3.67Å; Y255-W501 HydrophobicContact CD2-CH2 4.13Å; Y255-W501 HydrophobicContact CE1-CH2 4.03Å; Y255-W501 HydrophobicContact CE1-CZ2 4.04Å; Y255-W501 HydrophobicContact CE2-CH2 4.19Å; Y255-W501 HydrophobicContact CG-CH2 4.03Å; Y255-W501 AromaticContact CG-CZ2 3.95Å; Y255-W501 HydrophobicContact CG-CZ2 3.95Å
256	I	94.7	Very high	93.2	Very high	89 Å²	89	47.3 Å²	47.3	46%	0.456	27%	0.265	S	S	.	.	H	α-helix	trans	-61.7	-49.9	-179.1	-69.3	170.6	0	0	0	111.1	L251 N258 I259 L260	L251-I256 WeakPolarHBondContact O-CB 3.21Å; L251-I256 VanDerWaalsContact O-CG1 3.3Å; L251-I256 WeakPolarHBondContact O-CG1 3.44Å; L251-I256 PolarHBondContact O-N 3.48Å; I256-N258 VanDerWaalsContact C-N 3.32Å; I256-N258 PolarHBondContact O-N 3.24Å; I256-I259 PolarHBondContact O-N 3.49Å; I256-L260 HydrophobicContact CG2-CD1 4.16Å; I256-L260 HydrophobicContact CG2-CG 4.48Å; I256-L260 WeakPolarHBondContact O-CG 3.24Å; I256-L260 PolarHBondContact O-N 2.9Å
257	P	95.1	Very high	93.1	Very high	37 Å²	37	47.4 Å²	47.4	24%	0.24	27%	0.268	C	S	.	.	H	α-helix	trans	-58.7	-40.4	175.6	-28.7	38.5	0	0	0	113.3	A252 L260 I261	A252-P257 WeakPolarHBondContact O-CD 3.44Å; A252-P257 WeakPolarHBondContact O-CG 3.41Å; P257-L260 PolarHBondContact O-N 3.31Å; P257-I261 VanDerWaalsContact O-CG1 3.32Å; P257-I261 WeakPolarHBondContact O-CG1 3.45Å; P257-I261 PolarHBondContact O-N 3.12Å
258	N	94.6	Very high	93	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-63.3	-42.7	175.7	-79.1	-36.6	0	0	0	112.3	T254 Y255 I256 L260 I261 M262 Q293 W313	T254-N258 VanDerWaalsContact O-CB 3.28Å; T254-N258 WeakPolarHBondContact O-CB 3.42Å; T254-N258 VanDerWaalsContact O-CG 3.24Å; T254-N258 PolarHBondContact O-N 3.08Å; T254-N258 VanDerWaalsContact O-N 3.12Å; T254-N258 PolarHBondContact O-ND2 3.03Å; Y255-N258 PolarHBondContact O-N 3.41Å; I256-N258 VanDerWaalsContact C-N 3.32Å; I256-N258 PolarHBondContact O-N 3.24Å; N258-L260 VanDerWaalsContact C-N 3.33Å; N258-L260 PolarHBondContact O-N 3.38Å; N258-I261 PolarHBondContact O-N 3.37Å; N258-M262 WeakPolarHBondContact O-CG 3.45Å; N258-M262 PolarHBondContact O-N 2.95Å; N258-Q293 PolarHBondContact OD1-OE1 2.95Å; N258-W313 HydrophobicContact CB-CZ2 4.47Å
259	I	94.5	Very high	93	Very high	53 Å²	53	43.3 Å²	43.3	27%	0.272	23%	0.234	S	C	.	.	H	α-helix	trans	-60.3	-44.1	174.8	-68.3	166.8	0	0	0	110.6	Y255 I256 I261 M262 V263 W313 F493	Y255-I259 WeakPolarHBondContact O-CG1 3.27Å; Y255-I259 PolarHBondContact O-N 3.25Å; I256-I259 PolarHBondContact O-N 3.49Å; I259-I261 PolarHBondContact O-N 3.31Å; I259-M262 WeakPolarHBondContact O-CB 3.37Å; I259-M262 PolarHBondContact O-N 3.41Å; I259-M262 VanDerWaalsContact O-N 3.16Å; I259-V263 WeakPolarHBondContact O-CG2 3.23Å; I259-V263 PolarHBondContact O-N 3.48Å; I259-W313 HydrophobicContact CD1-CH2 4.15Å; I259-W313 HydrophobicContact CD1-CZ2 4.38Å; I259-W313 HydrophobicContact CG1-CH2 3.95Å; I259-W313 HydrophobicContact CG1-CZ2 3.88Å; I259-F493 HydrophobicContact CG1-CE1 4.28Å; I259-F493 HydrophobicContact CG1-CZ 4.25Å; I259-F493 HydrophobicContact CG2-CE1 4.45Å
260	L	94.7	Very high	92.8	Very high	105 Å²	105	45 Å²	45	55%	0.55	24%	0.24	S	C	.	.	H	α-helix	trans	-63	-41.8	177.6	-67.8	175.1	0	0	0	112	I256 P257 N258 M262 V263 V264	I256-L260 HydrophobicContact CG2-CD1 4.16Å; I256-L260 HydrophobicContact CG2-CG 4.48Å; I256-L260 WeakPolarHBondContact O-CG 3.24Å; I256-L260 PolarHBondContact O-N 2.9Å; P257-L260 PolarHBondContact O-N 3.31Å; N258-L260 VanDerWaalsContact C-N 3.33Å; N258-L260 PolarHBondContact O-N 3.38Å; L260-M262 VanDerWaalsContact C-N 3.27Å; L260-M262 PolarHBondContact O-N 3.16Å; L260-V263 PolarHBondContact O-N 2.94Å; L260-V264 WeakPolarHBondContact O-CG2 3.19Å; L260-V264 PolarHBondContact O-N 3.15Å
261	I	95.3	Very high	92.5	Very high	31 Å²	31	46.2 Å²	46.2	16%	0.159	25%	0.249	C	C	.	.	H	α-helix	trans	-60.8	-39.5	173.9	-69.6	172.4	0	0	0	110.9	P257 N258 I259 V264 S265 T286 V290	P257-I261 VanDerWaalsContact O-CG1 3.32Å; P257-I261 WeakPolarHBondContact O-CG1 3.45Å; P257-I261 PolarHBondContact O-N 3.12Å; N258-I261 PolarHBondContact O-N 3.37Å; I259-I261 PolarHBondContact O-N 3.31Å; I261-V264 PolarHBondContact O-N 3.12Å; I261-S265 PolarHBondContact O-N 3.31Å; I261-T286 HydrophobicContact CG2-CG2 4.15Å; I261-V290 HydrophobicContact CG2-CG2 3.72Å
262	M	94.1	Very high	92.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.6	-42.7	175.4	-68.9	-49.8	-53.2	0	0	112	N258 I259 L260 V264 S265 W266 C317 F320 N321 F493	N258-M262 WeakPolarHBondContact O-CG 3.45Å; N258-M262 PolarHBondContact O-N 2.95Å; I259-M262 WeakPolarHBondContact O-CB 3.37Å; I259-M262 PolarHBondContact O-N 3.41Å; I259-M262 VanDerWaalsContact O-N 3.16Å; L260-M262 VanDerWaalsContact C-N 3.27Å; L260-M262 PolarHBondContact O-N 3.16Å; M262-V264 VanDerWaalsContact C-N 3.35Å; M262-V264 PolarHBondContact O-N 3.38Å; M262-S265 WeakPolarHBondContact O-CB 3.43Å; M262-S265 PolarHBondContact O-N 2.86Å; M262-S265 VanDerWaalsContact O-N 3.15Å; M262-S265 PolarHBondContact O-OG 2.86Å; M262-W266 PolarHBondContact O-N 2.98Å; M262-W266 PolarHBondContact O-NE1 3.2Å; M262-C317 HydrophobicContact SD-CB 4.32Å; M262-F320 HydrophobicContact CE-CB 3.35Å; M262-F320 HydrophobicContact CE-CG 4.37Å; M262-F320 HydrophobicContact SD-CB 4.47Å; M262-N321 HydrophobicContact SD-CB 4.32Å; M262-F493 HydrophobicContact CB-CE1 4.22Å; M262-F493 HydrophobicContact CB-CE2 4.35Å; M262-F493 HydrophobicContact CB-CZ 4.03Å; M262-F493 HydrophobicContact CG-CD2 4.5Å; M262-F493 HydrophobicContact CG-CE1 4.45Å; M262-F493 HydrophobicContact CG-CE2 3.8Å; M262-F493 HydrophobicContact CG-CZ 3.77Å
263	V	92.7	Very high	91.6	Very high	65 Å²	65	44.4 Å²	44.4	39%	0.394	24%	0.235	S	C	.	.	H	α-helix	trans	-61.6	-42.8	174.7	174.4	0	0	0	0	111.4	I259 L260 S265 W266 L267	I259-V263 WeakPolarHBondContact O-CG2 3.23Å; I259-V263 PolarHBondContact O-N 3.48Å; L260-V263 PolarHBondContact O-N 2.94Å; V263-S265 VanDerWaalsContact C-N 3.28Å; V263-S265 PolarHBondContact O-N 3.43Å; V263-W266 HydrophobicContact CG2-CE3 4.29Å; V263-W266 HydrophobicContact CG2-CZ3 4.04Å; V263-W266 PolarHBondContact O-N 3.46Å; V263-W266 VanDerWaalsContact O-N 3.14Å; V263-L267 PolarHBondContact O-N 2.95Å
264	V	93	Very high	91.1	Very high	62 Å²	62	48.8 Å²	48.8	38%	0.376	25%	0.249	S	C	.	.	H	α-helix	trans	-61.3	-38.2	175.1	173.3	0	0	0	0	111.1	L260 I261 M262 W266 L267 T286	L260-V264 WeakPolarHBondContact O-CG2 3.19Å; L260-V264 PolarHBondContact O-N 3.15Å; I261-V264 PolarHBondContact O-N 3.12Å; M262-V264 VanDerWaalsContact C-N 3.35Å; M262-V264 PolarHBondContact O-N 3.38Å; V264-W266 PolarHBondContact O-N 3.16Å; V264-L267 VanDerWaalsContact O-CB 3.3Å; V264-L267 WeakPolarHBondContact O-CB 3.37Å; V264-L267 PolarHBondContact O-N 2.87Å; V264-L267 VanDerWaalsContact O-N 3.16Å; V264-T286 HydrophobicContact CB-CG2 4.27Å; V264-T286 HydrophobicContact CG1-CG2 3.82Å
265	S	93.2	Very high	90.9	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.014	26%	0.259	C	S	.	.	H	α-helix	trans	-61.7	-32.5	176.8	82.5	0	0	0	0	112.7	I261 M262 V263 L267 N268 N321	I261-S265 PolarHBondContact O-N 3.31Å; M262-S265 WeakPolarHBondContact O-CB 3.43Å; M262-S265 PolarHBondContact O-N 2.86Å; M262-S265 VanDerWaalsContact O-N 3.15Å; M262-S265 PolarHBondContact O-OG 2.86Å; V263-S265 VanDerWaalsContact C-N 3.28Å; V263-S265 PolarHBondContact O-N 3.43Å; S265-L267 VanDerWaalsContact C-N 3.3Å; S265-L267 PolarHBondContact O-N 2.9Å; S265-N268 WeakPolarHBondContact O-CB 3.47Å; S265-N268 PolarHBondContact O-N 2.9Å; S265-N321 WeakPolarHBondContact CB-ND2 3.14Å
266	W	90.8	Very high	90.5	Very high	38 Å²	38	53.9 Å²	53.9	14%	0.144	28%	0.28	C	S	.	.	H	α-helix	trans	-74.7	-18.5	178.9	-55.4	-21.1	0	0	0	113.6	M262 V263 V264 N268 F269 P490 F493	M262-W266 PolarHBondContact O-N 2.98Å; M262-W266 PolarHBondContact O-NE1 3.2Å; V263-W266 HydrophobicContact CG2-CE3 4.29Å; V263-W266 HydrophobicContact CG2-CZ3 4.04Å; V263-W266 PolarHBondContact O-N 3.46Å; V263-W266 VanDerWaalsContact O-N 3.14Å; V264-W266 PolarHBondContact O-N 3.16Å; W266-N268 PolarHBondContact O-N 3.34Å; W266-N268 VanDerWaalsContact O-N 3.13Å; W266-F269 HydrophobicContact CB-CD2 4.2Å; W266-F269 HydrophobicContact CB-CE2 4.22Å; W266-F269 HydrophobicContact CG-CE2 4.4Å; W266-F269 VanDerWaalsContact O-CD2 3.28Å; W266-F269 WeakPolarHBondContact O-CD2 3.23Å; W266-F269 PolarHBondContact O-N 3.32Å; W266-F269 VanDerWaalsContact O-N 3.11Å; W266-P490 HydrophobicContact CD2-CB 4.32Å; W266-P490 HydrophobicContact CD2-CG 3.75Å; W266-P490 HydrophobicContact CE3-CB 3.91Å; W266-P490 HydrophobicContact CE3-CG 3.62Å; W266-P490 HydrophobicContact CG-CG 4.29Å; W266-P490 HydrophobicContact CH2-CB 3.83Å; W266-P490 HydrophobicContact CH2-CG 4.32Å; W266-P490 HydrophobicContact CZ2-CB 4.26Å; W266-P490 HydrophobicContact CZ2-CG 4.46Å; W266-P490 HydrophobicContact CZ3-CB 3.64Å; W266-P490 HydrophobicContact CZ3-CG 3.91Å; W266-F493 HydrophobicContact CH2-CB 4.1Å; W266-F493 AromaticContact CH2-CD1 3.69Å; W266-F493 HydrophobicContact CH2-CD1 3.69Å; W266-F493 HydrophobicContact CH2-CG 4.21Å; W266-F493 HydrophobicContact CZ2-CB 3.57Å; W266-F493 AromaticContact CZ2-CD1 3.65Å; W266-F493 HydrophobicContact CZ2-CD1 3.65Å; W266-F493 AromaticContact CZ2-CG 3.74Å; W266-F493 HydrophobicContact CZ2-CG 3.74Å
267	L	89.8	Confident	90.3	Very high	92 Å²	92	54.5 Å²	54.5	48%	0.482	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-60.2	-21.1	171.4	-60.4	179.2	0	0	0	111.6	V263 V264 S265 F269 W270 V271	V263-L267 PolarHBondContact O-N 2.95Å; V264-L267 VanDerWaalsContact O-CB 3.3Å; V264-L267 WeakPolarHBondContact O-CB 3.37Å; V264-L267 PolarHBondContact O-N 2.87Å; V264-L267 VanDerWaalsContact O-N 3.16Å; S265-L267 VanDerWaalsContact C-N 3.3Å; S265-L267 PolarHBondContact O-N 2.9Å; L267-F269 PolarHBondContact O-N 3.35Å; L267-W270 WeakPolarHBondContact O-CB 3.38Å; L267-W270 PolarHBondContact O-N 3.46Å; L267-V271 PolarHBondContact O-N 3.22Å
268	N	90.2	Very high	90.1	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-56.6	-33.1	174.6	-161.9	30.7	0	0	0	112.9	S265 W266 W270 V271 R279 S283 V324	S265-N268 WeakPolarHBondContact O-CB 3.47Å; S265-N268 PolarHBondContact O-N 2.9Å; W266-N268 PolarHBondContact O-N 3.34Å; W266-N268 VanDerWaalsContact O-N 3.13Å; N268-W270 PolarHBondContact O-N 3.03Å; N268-V271 PolarHBondContact O-N 3.43Å; N268-R279 PolarHBondContact O-NE 2.74Å; N268-R279 VanDerWaalsContact OD1-CA 3.23Å; N268-R279 WeakPolarHBondContact OD1-CA 3.5Å; N268-R279 WeakPolarHBondContact OD1-CB 3.38Å; N268-R279 WeakPolarHBondContact OD1-CD 3.17Å; N268-R279 WeakPolarHBondContact OD1-CG 3.44Å; N268-S283 PolarHBondContact ND2-OG 2.81Å; N268-V324 HydrophobicContact CB-CG1 3.94Å; N268-V324 WeakPolarHBondContact ND2-CG1 3.45Å
269	F	89.7	Confident	90	Very high	1 Å²	1	54.9 Å²	54.9	0%	0.004	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-72.9	-13.7	178.4	-50.9	-48.4	0	0	0	113.5	W266 L267 V324 E327 R486 F489	W266-F269 HydrophobicContact CB-CD2 4.2Å; W266-F269 HydrophobicContact CB-CE2 4.22Å; W266-F269 HydrophobicContact CG-CE2 4.4Å; W266-F269 VanDerWaalsContact O-CD2 3.28Å; W266-F269 WeakPolarHBondContact O-CD2 3.23Å; W266-F269 PolarHBondContact O-N 3.32Å; W266-F269 VanDerWaalsContact O-N 3.11Å; L267-F269 PolarHBondContact O-N 3.35Å; F269-V324 HydrophobicContact CE1-CG1 4.14Å; F269-V324 HydrophobicContact CZ-CB 4.48Å; F269-V324 HydrophobicContact CZ-CG1 4.21Å; F269-V324 HydrophobicContact CZ-CG2 3.9Å; F269-E327 HydrophobicContact CE1-CB 4.41Å; F269-E327 HydrophobicContact CE1-CG 4Å; F269-R486 HydrophobicContact CB-CG 3.68Å; F269-R486 HydrophobicContact CG-CG 4.49Å; F269-R486 PolarHBondContact O-NE 3.06Å; F269-R486 VanDerWaalsContact O-NE 3.09Å; F269-R486 PolarHBondContact O-NH2 3.11Å; F269-F489 HydrophobicContact CE1-CD2 4.3Å; F269-F489 HydrophobicContact CE1-CE2 4.34Å; F269-F489 HydrophobicContact CE2-CB 3.83Å; F269-F489 AromaticContact CE2-CD2 3.97Å; F269-F489 HydrophobicContact CE2-CD2 3.97Å; F269-F489 AromaticContact CE2-CG 3.98Å; F269-F489 HydrophobicContact CE2-CG 3.98Å; F269-F489 HydrophobicContact CZ-CB 4.07Å; F269-F489 HydrophobicContact CZ-CD1 4.27Å; F269-F489 AromaticContact CZ-CD2 3.45Å; F269-F489 HydrophobicContact CZ-CD2 3.45Å; F269-F489 VanDerWaalsContact CZ-CD2 3.45Å; F269-F489 AromaticContact CZ-CE2 3.84Å; F269-F489 HydrophobicContact CZ-CE2 3.84Å; F269-F489 AromaticContact CZ-CG 3.68Å; F269-F489 HydrophobicContact CZ-CG 3.68Å; F269-F489 HydrophobicContact CZ-CZ 4.4Å
270	W	87.4	Confident	89.8	Confident	175 Å²	175	54.6 Å²	54.6	66%	0.663	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-25.9	178.2	-69.1	87.5	0	0	0	113	L267 N268	L267-W270 WeakPolarHBondContact O-CB 3.38Å; L267-W270 PolarHBondContact O-N 3.46Å; N268-W270 PolarHBondContact O-N 3.03Å
271	V	87.7	Confident	89.7	Confident	39 Å²	39	54.6 Å²	54.6	24%	0.236	30%	0.297	C	S	.	.	S	Bend	trans	-66.5	141.3	173.8	178.2	0	0	0	0	109.3	L267 N268 A275 A278 R279 L282	L267-V271 PolarHBondContact O-N 3.22Å; N268-V271 PolarHBondContact O-N 3.43Å; V271-A275 HydrophobicContact CG1-CB 3.98Å; V271-A278 HydrophobicContact CG1-CB 4.28Å; V271-R279 HydrophobicContact CB-CG 3.98Å; V271-R279 HydrophobicContact CG1-CG 3.68Å; V271-R279 PolarHBondContact O-NE 3.03Å; V271-R279 PolarHBondContact O-NH2 2.93Å; V271-L282 HydrophobicContact CG2-CD1 4.03Å
272	S	85.1	Confident	89.6	Confident	49 Å²	49	55.8 Å²	55.8	34%	0.343	30%	0.303	S	S	.	.			trans	-66.4	146.6	178.1	63.9	0	0	0	0	112.3	E274 A275 R279	S272-E274 PolarHBondContact O-N 2.97Å; S272-E274 VanDerWaalsContact O-N 3.12Å; S272-A275 PolarHBondContact O-N 3Å; S272-A275 VanDerWaalsContact O-N 3.12Å; S272-R279 PolarHBondContact O-NE 3.19Å
273	L	83.3	Confident	89.5	Confident	29 Å²	29	55.9 Å²	55.9	15%	0.152	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-21.4	175.8	-85.3	174	0	0	0	113.5	A275 A331 A335 S479	L273-A275 VanDerWaalsContact C-N 3.31Å; L273-A331 HydrophobicContact CD2-CB 3.82Å; L273-A335 HydrophobicContact CD1-CB 3.96Å; L273-S479 VanDerWaalsContact CD1-CB 3.5Å
274	E	80.8	Confident	89.6	Confident	146 Å²	146	56.9 Å²	56.9	68%	0.682	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-26.6	179.5	-59.6	-172.8	165.3	0	0	112.2	S272 I276	S272-E274 PolarHBondContact O-N 2.97Å; S272-E274 VanDerWaalsContact O-N 3.12Å; E274-I276 PolarHBondContact O-N 3.44Å
275	A	87	Confident	89.7	Confident	32 Å²	32	58.9 Å²	58.9	26%	0.264	32%	0.315	S	S	.	.			trans	-86	55.4	178.3	0	0	0	0	0	112	V271 S272 L273 P277 A278 R279	V271-A275 HydrophobicContact CG1-CB 3.98Å; S272-A275 PolarHBondContact O-N 3Å; S272-A275 VanDerWaalsContact O-N 3.12Å; L273-A275 VanDerWaalsContact C-N 3.31Å; A275-P277 VanDerWaalsContact C-CD 3.47Å; A275-A278 HydrophobicContact CB-CB 4.13Å; A275-A278 WeakPolarHBondContact O-CB 3.44Å; A275-A278 PolarHBondContact O-N 3.4Å; A275-R279 PolarHBondContact O-N 3.18Å; A275-R279 VanDerWaalsContact O-N 3.13Å
276	I	87.7	Confident	89.8	Confident	84 Å²	84	59.3 Å²	59.3	43%	0.431	32%	0.317	S	S	.	.	H	α-helix	trans	-44.2	-51.3	177.3	-66.7	173.3	0	0	0	113.4	E274 A278 R279 V280 F328	E274-I276 PolarHBondContact O-N 3.44Å; I276-A278 VanDerWaalsContact C-N 3.28Å; I276-A278 PolarHBondContact O-N 3.09Å; I276-R279 PolarHBondContact O-N 3.16Å; I276-V280 HydrophobicContact CG2-CG2 4.3Å; I276-V280 WeakPolarHBondContact O-CG2 3.48Å; I276-V280 PolarHBondContact O-N 2.95Å; I276-F328 HydrophobicContact CG2-CZ 4.17Å
277	P	90.7	Very high	90	Very high	103 Å²	103	59 Å²	59	67%	0.669	32%	0.318	S	S	*	.	H	α-helix	trans	-63.6	-32.9	-177.9	23.6	-34.2	0	0	0	113.2	A275 N281	A275-P277 VanDerWaalsContact C-CD 3.47Å; P277-N281 VanDerWaalsContact O-CB 3.28Å; P277-N281 WeakPolarHBondContact O-CB 3.07Å; P277-N281 PolarHBondContact O-N 2.91Å
278	A	90.9	Very high	90.3	Very high	44 Å²	44	59.4 Å²	59.4	36%	0.364	32%	0.32	S	S	.	.	H	α-helix	trans	-69.9	-46.6	178	0	0	0	0	0	111.4	V271 A275 I276 N281 L282	V271-A278 HydrophobicContact CG1-CB 4.28Å; A275-A278 HydrophobicContact CB-CB 4.13Å; A275-A278 WeakPolarHBondContact O-CB 3.44Å; A275-A278 PolarHBondContact O-N 3.4Å; I276-A278 VanDerWaalsContact C-N 3.28Å; I276-A278 PolarHBondContact O-N 3.09Å; A278-N281 PolarHBondContact O-N 3.12Å; A278-L282 WeakPolarHBondContact O-CB 3.36Å; A278-L282 WeakPolarHBondContact O-CG 3.37Å; A278-L282 PolarHBondContact O-N 3.41Å
279	R	90.7	Very high	90.6	Very high	1 Å²	1	60.3 Å²	60.3	0%	0.004	33%	0.33	C	S	.	.	H	α-helix	trans	-62	-47.8	179.1	-71.4	-155.6	176.7	-169.2	6.1	112.4	N268 V271 S272 A275 I276 N281 L282 S283 F328 D482	N268-R279 PolarHBondContact O-NE 2.74Å; N268-R279 VanDerWaalsContact OD1-CA 3.23Å; N268-R279 WeakPolarHBondContact OD1-CA 3.5Å; N268-R279 WeakPolarHBondContact OD1-CB 3.38Å; N268-R279 WeakPolarHBondContact OD1-CD 3.17Å; N268-R279 WeakPolarHBondContact OD1-CG 3.44Å; V271-R279 HydrophobicContact CB-CG 3.98Å; V271-R279 HydrophobicContact CG1-CG 3.68Å; V271-R279 PolarHBondContact O-NE 3.03Å; V271-R279 PolarHBondContact O-NH2 2.93Å; S272-R279 PolarHBondContact O-NE 3.19Å; A275-R279 PolarHBondContact O-N 3.18Å; A275-R279 VanDerWaalsContact O-N 3.13Å; I276-R279 PolarHBondContact O-N 3.16Å; R279-N281 PolarHBondContact O-N 3.46Å; R279-L282 PolarHBondContact O-N 2.89Å; R279-S283 PolarHBondContact O-N 3.49Å; R279-S283 PolarHBondContact O-OG 3.01Å; R279-F328 HydrophobicContact CB-CD2 3.8Å; R279-F328 HydrophobicContact CB-CE2 3.67Å; R279-F328 HydrophobicContact CB-CG 4.49Å; R279-F328 HydrophobicContact CB-CZ 4.3Å; R279-F328 HydrophobicContact CG-CD2 4.32Å; R279-F328 HydrophobicContact CG-CE2 4.29Å; R279-D482 IonicContact CZ-OD1 3.48Å; R279-D482 IonicContact CZ-OD2 2.71Å; R279-D482 IonicContact NH1-OD1 3.55Å; R279-D482 PolarHBondContact NH1-OD1 3.14Å; R279-D482 IonicContact NH1-OD2 2.74Å; R279-D482 VanDerWaalsContact NH2-CG 3.26Å; R279-D482 IonicContact NH2-OD1 2.83Å; R279-D482 PolarHBondContact NH2-OD1 3.31Å; R279-D482 IonicContact NH2-OD2 3.77Å; R279-D482 PolarHBondContact NH2-OD2 2.71Å
280	V	91.7	Very high	90.9	Very high	47 Å²	47	60.3 Å²	60.3	29%	0.285	33%	0.33	S	S	.	.	H	α-helix	trans	-60.1	-46.6	178.9	173.7	0	0	0	0	111.1	I276 S283 L284 F328	I276-V280 HydrophobicContact CG2-CG2 4.3Å; I276-V280 WeakPolarHBondContact O-CG2 3.48Å; I276-V280 PolarHBondContact O-N 2.95Å; V280-S283 PolarHBondContact O-N 3.45Å; V280-L284 HydrophobicContact CG1-CD1 3.68Å; V280-L284 HydrophobicContact CG1-CG 4.25Å; V280-L284 WeakPolarHBondContact O-CB 3.26Å; V280-L284 WeakPolarHBondContact O-CG 3.43Å; V280-L284 PolarHBondContact O-N 2.97Å; V280-F328 HydrophobicContact CG2-CD1 4.22Å; V280-F328 HydrophobicContact CG2-CE1 3.3Å; V280-F328 HydrophobicContact CG2-CZ 3.61Å
281	N	92.9	Very high	91.3	Very high	106 Å²	106	55.4 Å²	55.4	57%	0.567	32%	0.316	S	S	*	.	H	α-helix	trans	-64.9	-42.9	-178.2	-168.7	38.4	0	0	0	112.1	P277 A278 R279 L284 L285	P277-N281 VanDerWaalsContact O-CB 3.28Å; P277-N281 WeakPolarHBondContact O-CB 3.07Å; P277-N281 PolarHBondContact O-N 2.91Å; A278-N281 PolarHBondContact O-N 3.12Å; R279-N281 PolarHBondContact O-N 3.46Å; N281-L284 PolarHBondContact O-N 2.87Å; N281-L285 WeakPolarHBondContact O-CB 3.35Å; N281-L285 PolarHBondContact O-N 3.41Å
282	L	92.7	Very high	91.6	Very high	55 Å²	55	57.1 Å²	57.1	29%	0.288	33%	0.327	S	S	.	.	H	α-helix	trans	-61.4	-44.8	176.5	-74.8	170	0	0	0	112.2	V271 A278 R279 T286	V271-L282 HydrophobicContact CG2-CD1 4.03Å; A278-L282 WeakPolarHBondContact O-CB 3.36Å; A278-L282 WeakPolarHBondContact O-CG 3.37Å; A278-L282 PolarHBondContact O-N 3.41Å; R279-L282 PolarHBondContact O-N 2.89Å; L282-T286 VanDerWaalsContact O-CG2 3.32Å; L282-T286 WeakPolarHBondContact O-CG2 3.36Å; L282-T286 PolarHBondContact O-N 3Å; L282-T286 VanDerWaalsContact O-N 3.09Å; L282-T286 PolarHBondContact O-OG1 3.17Å
283	S	92.1	Very high	92.1	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.014	32%	0.32	C	S	.	.	H	α-helix	trans	-65.7	-44.4	178	-61.8	0	0	0	0	112.3	N268 R279 V280 T286 L287 N321	N268-S283 PolarHBondContact ND2-OG 2.81Å; R279-S283 PolarHBondContact O-N 3.49Å; R279-S283 PolarHBondContact O-OG 3.01Å; V280-S283 PolarHBondContact O-N 3.45Å; S283-T286 PolarHBondContact O-OG1 3.41Å; S283-L287 WeakPolarHBondContact O-CB 3.28Å; S283-L287 PolarHBondContact O-N 3.43Å; S283-N321 PolarHBondContact O-OD1 3.24Å
284	L	94.1	Very high	92.6	Very high	86 Å²	86	56.9 Å²	56.9	45%	0.45	32%	0.323	S	S	.	.	H	α-helix	trans	-68.6	-38.3	179.4	-68.6	177.6	0	0	0	112.6	V280 N281 L287 L288 L325	V280-L284 HydrophobicContact CG1-CD1 3.68Å; V280-L284 HydrophobicContact CG1-CG 4.25Å; V280-L284 WeakPolarHBondContact O-CB 3.26Å; V280-L284 WeakPolarHBondContact O-CG 3.43Å; V280-L284 PolarHBondContact O-N 2.97Å; N281-L284 PolarHBondContact O-N 2.87Å; L284-L287 PolarHBondContact O-N 2.94Å; L284-L288 WeakPolarHBondContact O-CB 3.33Å; L284-L288 PolarHBondContact O-N 3.15Å; L284-L325 HydrophobicContact CD2-CD2 4.38Å
285	L	95.3	Very high	93.2	Very high	105 Å²	105	54.1 Å²	54.1	55%	0.55	32%	0.316	S	S	.	.	H	α-helix	trans	-67.3	-40.6	178.7	-177.1	62.3	0	0	0	111.7	N281 L288 G289	N281-L285 WeakPolarHBondContact O-CB 3.35Å; N281-L285 PolarHBondContact O-N 3.41Å; L285-L288 PolarHBondContact O-N 3.26Å; L285-G289 PolarHBondContact O-N 3.31Å
286	T	95.1	Very high	93.5	Very high	10 Å²	10	56.2 Å²	56.2	6%	0.061	33%	0.329	C	S	.	.	H	α-helix	trans	-67.1	-40.3	176	52.1	0	0	0	0	111.5	I261 V264 L282 S283 G289 V290 N321	I261-T286 HydrophobicContact CG2-CG2 4.15Å; V264-T286 HydrophobicContact CB-CG2 4.27Å; V264-T286 HydrophobicContact CG1-CG2 3.82Å; L282-T286 VanDerWaalsContact O-CG2 3.32Å; L282-T286 WeakPolarHBondContact O-CG2 3.36Å; L282-T286 PolarHBondContact O-N 3Å; L282-T286 VanDerWaalsContact O-N 3.09Å; L282-T286 PolarHBondContact O-OG1 3.17Å; S283-T286 PolarHBondContact O-OG1 3.41Å; T286-G289 PolarHBondContact O-N 2.83Å; T286-V290 WeakPolarHBondContact O-CG2 3.45Å; T286-V290 PolarHBondContact O-N 3.24Å; T286-V290 VanDerWaalsContact O-N 3.08Å; T286-N321 VanDerWaalsContact CB-ND2 3.25Å; T286-N321 WeakPolarHBondContact CB-ND2 3.28Å; T286-N321 PolarHBondContact OG1-ND2 3.02Å
287	L	95.7	Very high	93.7	Very high	32 Å²	32	52.9 Å²	52.9	17%	0.168	31%	0.311	C	S	.	.	H	α-helix	trans	-60.6	-47.9	173.7	-173.5	56.7	0	0	0	111.9	S283 L284 G289 V290 I291 I318 N321	S283-L287 WeakPolarHBondContact O-CB 3.28Å; S283-L287 PolarHBondContact O-N 3.43Å; L284-L287 PolarHBondContact O-N 2.94Å; L287-G289 VanDerWaalsContact C-N 3.28Å; L287-G289 PolarHBondContact O-N 3.47Å; L287-V290 PolarHBondContact O-N 2.98Å; L287-I291 HydrophobicContact CD1-CD1 4.16Å; L287-I291 HydrophobicContact CG-CD1 3.97Å; L287-I291 WeakPolarHBondContact O-CG1 3.2Å; L287-I291 PolarHBondContact O-N 3.4Å; L287-I318 HydrophobicContact CD1-CG2 4.27Å; L287-N321 VanDerWaalsContact CA-OD1 3.31Å; L287-N321 WeakPolarHBondContact CA-OD1 3.26Å; L287-N321 VanDerWaalsContact CB-OD1 3.23Å; L287-N321 WeakPolarHBondContact CB-OD1 3.36Å; L287-N321 HydrophobicContact CD1-CB 4.39Å; L287-N321 PolarHBondContact N-OD1 3.43Å
288	L	96.3	Very high	93.8	Very high	100 Å²	100	50.4 Å²	50.4	52%	0.524	30%	0.299	S	S	.	.	H	α-helix	trans	-60.9	-38.9	176.5	-179.4	61.6	0	0	0	111.4	L284 L285 I291 T292	L284-L288 WeakPolarHBondContact O-CB 3.33Å; L284-L288 PolarHBondContact O-N 3.15Å; L285-L288 PolarHBondContact O-N 3.26Å; L288-I291 PolarHBondContact O-N 3.42Å; L288-T292 VanDerWaalsContact O-CB 3.27Å; L288-T292 WeakPolarHBondContact O-CB 3.42Å; L288-T292 PolarHBondContact O-N 3.23Å; L288-T292 PolarHBondContact O-OG1 3.31Å
289	G	95.3	Very high	93.9	Very high	21 Å²	21	52 Å²	52	22%	0.216	31%	0.308	C	S	.	.	H	α-helix	trans	-59.2	-46.8	176	0	0	0	0	0	112.9	L285 T286 L287 T292 Q293	L285-G289 PolarHBondContact O-N 3.31Å; T286-G289 PolarHBondContact O-N 2.83Å; L287-G289 VanDerWaalsContact C-N 3.28Å; L287-G289 PolarHBondContact O-N 3.47Å; G289-T292 PolarHBondContact O-N 3.47Å; G289-Q293 PolarHBondContact O-N 2.97Å; G289-Q293 VanDerWaalsContact O-N 3.09Å
290	V	95.5	Very high	93.8	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-64.9	-44	176.5	179.3	0	0	0	0	111.2	I261 T286 L287 T292 Q293 S294 T314 C317 I318	I261-V290 HydrophobicContact CG2-CG2 3.72Å; T286-V290 WeakPolarHBondContact O-CG2 3.45Å; T286-V290 PolarHBondContact O-N 3.24Å; T286-V290 VanDerWaalsContact O-N 3.08Å; L287-V290 PolarHBondContact O-N 2.98Å; V290-T292 PolarHBondContact O-N 3.31Å; V290-Q293 PolarHBondContact O-N 3.35Å; V290-S294 PolarHBondContact O-N 3.4Å; V290-T314 HydrophobicContact CG1-CG2 4.47Å; V290-C317 HydrophobicContact CG1-CB 3.9Å; V290-I318 HydrophobicContact CG1-CG1 3.76Å
291	I	95.9	Very high	93.9	Very high	72 Å²	72	53.9 Å²	53.9	37%	0.369	32%	0.322	S	S	.	.	H	α-helix	trans	-64.8	-40.9	179.2	-67.2	170	0	0	0	111.2	L287 L288 S294 T295 I318	L287-I291 HydrophobicContact CD1-CD1 4.16Å; L287-I291 HydrophobicContact CG-CD1 3.97Å; L287-I291 WeakPolarHBondContact O-CG1 3.2Å; L287-I291 PolarHBondContact O-N 3.4Å; L288-I291 PolarHBondContact O-N 3.42Å; I291-S294 VanDerWaalsContact O-CB 3.29Å; I291-S294 WeakPolarHBondContact O-CB 3.37Å; I291-S294 PolarHBondContact O-N 3.07Å; I291-T295 PolarHBondContact O-N 2.98Å; I291-T295 PolarHBondContact O-OG1 3.34Å; I291-I318 HydrophobicContact CG1-CD1 4.39Å
292	T	95.9	Very high	93.9	Very high	76 Å²	76	49.6 Å²	49.6	47%	0.466	30%	0.3	S	S	.	.	H	α-helix	trans	-66.2	-38.2	179.4	-56.4	0	0	0	0	111.5	L288 G289 V290 T295 S296	L288-T292 VanDerWaalsContact O-CB 3.27Å; L288-T292 WeakPolarHBondContact O-CB 3.42Å; L288-T292 PolarHBondContact O-N 3.23Å; L288-T292 PolarHBondContact O-OG1 3.31Å; G289-T292 PolarHBondContact O-N 3.47Å; V290-T292 PolarHBondContact O-N 3.31Å; T292-T295 PolarHBondContact O-OG1 2.66Å; T292-S296 WeakPolarHBondContact O-CB 3.41Å; T292-S296 PolarHBondContact O-N 3.42Å; T292-S296 VanDerWaalsContact O-N 3.09Å
293	Q	93.9	Very high	93.9	Very high	42 Å²	42	59.1 Å²	59.1	20%	0.196	33%	0.332	C	S	.	.	H	α-helix	trans	-65.2	-41.3	171.7	-77.1	-172.3	50.3	0	0	111.8	N258 G289 V290 T295 S296 Y297	N258-Q293 PolarHBondContact OD1-OE1 2.95Å; G289-Q293 PolarHBondContact O-N 2.97Å; G289-Q293 VanDerWaalsContact O-N 3.09Å; V290-Q293 PolarHBondContact O-N 3.35Å; Q293-T295 PolarHBondContact O-N 2.98Å; Q293-S296 WeakPolarHBondContact O-CB 3.44Å; Q293-S296 PolarHBondContact O-N 2.71Å; Q293-Y297 WeakPolarHBondContact O-CD1 3.26Å; Q293-Y297 PolarHBondContact O-N 3.22Å; Q293-Y297 VanDerWaalsContact O-N 3.16Å
294	S	94.1	Very high	93.9	Very high	30 Å²	30	60.9 Å²	60.9	21%	0.21	34%	0.343	C	S	.	.	H	α-helix	trans	-55	-49.5	176.4	-174.1	0	0	0	0	112.6	V290 I291 S296 Y297 A298	V290-S294 PolarHBondContact O-N 3.4Å; I291-S294 VanDerWaalsContact O-CB 3.29Å; I291-S294 WeakPolarHBondContact O-CB 3.37Å; I291-S294 PolarHBondContact O-N 3.07Å; S294-S296 VanDerWaalsContact C-N 3.33Å; S294-S296 PolarHBondContact O-N 3.25Å; S294-Y297 PolarHBondContact OG-OH 3.4Å; S294-A298 WeakPolarHBondContact O-CB 3.19Å; S294-A298 PolarHBondContact O-N 3.04Å; S294-A298 VanDerWaalsContact O-N 3.07Å
295	T	94.3	Very high	93.8	Very high	88 Å²	88	63 Å²	63	54%	0.54	36%	0.364	S	S	.	.	H	α-helix	trans	-67.5	-34.9	178.8	56.3	0	0	0	0	112.2	I291 T292 Q293 S299	I291-T295 PolarHBondContact O-N 2.98Å; I291-T295 PolarHBondContact O-OG1 3.34Å; T292-T295 PolarHBondContact O-OG1 2.66Å; Q293-T295 PolarHBondContact O-N 2.98Å; T295-S299 PolarHBondContact O-N 3.47Å
296	S	93.5	Very high	93.8	Very high	77 Å²	77	60.2 Å²	60.2	54%	0.538	35%	0.347	S	S	.	.	H	α-helix	trans	-58.9	-56.7	178.1	-171.6	0	0	0	0	111.7	T292 Q293 S294 S299	T292-S296 WeakPolarHBondContact O-CB 3.41Å; T292-S296 PolarHBondContact O-N 3.42Å; T292-S296 VanDerWaalsContact O-N 3.09Å; Q293-S296 WeakPolarHBondContact O-CB 3.44Å; Q293-S296 PolarHBondContact O-N 2.71Å; S294-S296 VanDerWaalsContact C-N 3.33Å; S294-S296 PolarHBondContact O-N 3.25Å; S296-S299 PolarHBondContact O-N 3.41Å; S296-S299 PolarHBondContact O-OG 2.84Å
297	Y	92.1	Very high	93.6	Very high	14 Å²	14	65 Å²	65	6%	0.055	37%	0.371	C	S	.	.	H	α-helix	trans	-74.9	-27.8	-178.8	68.2	-109.6	0	0	0	112.8	W250 T254 Q293 S294 S299 S300 L301 I310 T314	W250-Y297 HydrophobicContact CZ3-CG 4.42Å; T254-Y297 HydrophobicContact CG2-CD1 3.97Å; T254-Y297 HydrophobicContact CG2-CE1 4.05Å; Q293-Y297 WeakPolarHBondContact O-CD1 3.26Å; Q293-Y297 PolarHBondContact O-N 3.22Å; Q293-Y297 VanDerWaalsContact O-N 3.16Å; S294-Y297 PolarHBondContact OG-OH 3.4Å; Y297-S299 PolarHBondContact O-N 3.48Å; Y297-S300 PolarHBondContact O-N 3.41Å; Y297-S300 VanDerWaalsContact O-N 3.13Å; Y297-L301 HydrophobicContact CD2-CD1 4.23Å; Y297-L301 PolarHBondContact O-N 3.05Å; Y297-I310 HydrophobicContact CD1-CD1 4.34Å; Y297-I310 HydrophobicContact CD2-CD1 3.97Å; Y297-I310 HydrophobicContact CE1-CD1 4.32Å; Y297-I310 HydrophobicContact CE1-CG1 4.47Å; Y297-I310 HydrophobicContact CE2-CD1 4.02Å; Y297-I310 HydrophobicContact CE2-CG1 4.17Å; Y297-I310 HydrophobicContact CE2-CG2 4.26Å; Y297-I310 HydrophobicContact CG-CD1 4.19Å; Y297-T314 VanDerWaalsContact OH-CB 3.27Å; Y297-T314 WeakPolarHBondContact OH-CB 3.49Å; Y297-T314 WeakPolarHBondContact OH-CG2 3.34Å; Y297-T314 PolarHBondContact OH-OG1 3.27Å
298	A	92.3	Very high	93.6	Very high	51 Å²	51	64.3 Å²	64.3	42%	0.421	37%	0.367	S	S	.	.	H	α-helix	trans	-64	-24.9	176.5	0	0	0	0	0	112.3	S294 S300	S294-A298 WeakPolarHBondContact O-CB 3.19Å; S294-A298 PolarHBondContact O-N 3.04Å; S294-A298 VanDerWaalsContact O-N 3.07Å; A298-S300 VanDerWaalsContact C-N 3.33Å
299	S	92.2	Very high	93.4	Very high	78 Å²	78	59.5 Å²	59.5	55%	0.545	34%	0.342	S	S	.	.	H	α-helix	trans	-71.4	-26.6	175.3	77	0	0	0	0	113.7	T295 S296 Y297	T295-S299 PolarHBondContact O-N 3.47Å; S296-S299 PolarHBondContact O-N 3.41Å; S296-S299 PolarHBondContact O-OG 2.84Å; Y297-S299 PolarHBondContact O-N 3.48Å
300	S	89.8	Confident	93.4	Very high	75 Å²	75	58.5 Å²	58.5	52%	0.524	33%	0.331	S	S	.	.	H	α-helix	trans	-85.8	-10.2	178.7	-53.1	0	0	0	0	113.2	Y297 A298	Y297-S300 PolarHBondContact O-N 3.41Å; Y297-S300 VanDerWaalsContact O-N 3.13Å; A298-S300 VanDerWaalsContact C-N 3.33Å
301	L	92.1	Very high	93.3	Very high	11 Å²	11	60.2 Å²	60.2	6%	0.058	34%	0.341	C	S	.	.	S	Bend	trans	-108.8	151.7	-176.2	-63.6	175.1	0	0	0	111.5	V74 F170 Y297	V74-L301 HydrophobicContact CG1-CD2 4.21Å; F170-L301 HydrophobicContact CD1-CD1 4.01Å; F170-L301 HydrophobicContact CD2-CD2 4.41Å; F170-L301 HydrophobicContact CE1-CD1 3.53Å; F170-L301 HydrophobicContact CE1-CD2 3.89Å; F170-L301 HydrophobicContact CE1-CG 4.33Å; F170-L301 HydrophobicContact CE2-CD2 3.63Å; F170-L301 HydrophobicContact CZ-CD1 3.91Å; F170-L301 HydrophobicContact CZ-CD2 3.33Å; F170-L301 HydrophobicContact CZ-CG 4.22Å; Y297-L301 HydrophobicContact CD2-CD1 4.23Å; Y297-L301 PolarHBondContact O-N 3.05Å
302	P	93.7	Very high	93.2	Very high	16 Å²	16	59.9 Å²	59.9	10%	0.104	34%	0.339	C	S	.	.			trans	-66.5	149.9	173.7	30	-34.9	0	0	0	110.1	V74 M77 L167 V304	V74-P302 HydrophobicContact CG1-CG 4.38Å; V74-P302 VanDerWaalsContact O-CD 3.26Å; V74-P302 WeakPolarHBondContact O-CD 3.43Å; V74-P302 WeakPolarHBondContact O-CG 3.43Å; M77-P302 HydrophobicContact CE-CB 3.91Å; M77-P302 HydrophobicContact CE-CG 3.48Å; M77-P302 VanDerWaalsContact CE-CG 3.48Å; M77-P302 HydrophobicContact SD-CG 4.22Å; L167-P302 HydrophobicContact CD1-CG 3.43Å; L167-P302 VanDerWaalsContact CD1-CG 3.43Å; P302-V304 HydrophobicContact CG-CG1 4.26Å; P302-V304 PolarHBondContact O-N 3.3Å
303	R	91.9	Very high	93.1	Very high	256 Å²	256	56.3 Å²	56.3	97%	0.966	32%	0.317	S	S	*	.			trans	-74.6	97.3	173.4	-65.4	-178.5	-179.4	-178	-0	109.1
304	V	92.2	Very high	93.1	Very high	38 Å²	38	54.5 Å²	54.5	23%	0.23	31%	0.309	C	S	.	.			trans	-95.8	148.2	174	-65.3	0	0	0	0	110.9	M77 L167 P302 Y306 K308	M77-V304 HydrophobicContact CE-CG1 4.23Å; L167-V304 HydrophobicContact CD1-CG1 4.15Å; P302-V304 HydrophobicContact CG-CG1 4.26Å; P302-V304 PolarHBondContact O-N 3.3Å; V304-Y306 HydrophobicContact CB-CD1 4.33Å; V304-Y306 HydrophobicContact CB-CD2 4.46Å; V304-Y306 HydrophobicContact CB-CE1 4.01Å; V304-Y306 HydrophobicContact CB-CE2 4.11Å; V304-Y306 HydrophobicContact CG1-CE1 4.25Å; V304-Y306 HydrophobicContact CG1-CE2 4.45Å; V304-Y306 HydrophobicContact CG2-CD2 4.24Å; V304-Y306 HydrophobicContact CG2-CE2 3.97Å; V304-K308 HydrophobicContact CG2-CD 3.85Å; V304-K308 HydrophobicContact CG2-CG 3.95Å
305	S	93.3	Very high	93.2	Very high	130 Å²	130	57.6 Å²	57.6	91%	0.909	32%	0.322	S	S	*	.	S	Bend	trans	-83.9	-10.6	-178.6	55.4	0	0	0	0	114.1
306	Y	93.7	Very high	93.2	Very high	48 Å²	48	54 Å²	54	19%	0.188	30%	0.301	C	S	.	.	S	Bend	trans	-104.7	161.9	178.8	55	-102	0	0	0	112.1	L167 R168 V304 K308	L167-Y306 HydrophobicContact CB-CE2 4.15Å; L167-Y306 PolarHBondContact N-OH 2.75Å; R168-Y306 HydrophobicContact CG-CD2 3.82Å; R168-Y306 HydrophobicContact CG-CE2 3.94Å; R168-Y306 HydrophobicContact CG-CG 4.47Å; V304-Y306 HydrophobicContact CB-CD1 4.33Å; V304-Y306 HydrophobicContact CB-CD2 4.46Å; V304-Y306 HydrophobicContact CB-CE1 4.01Å; V304-Y306 HydrophobicContact CB-CE2 4.11Å; V304-Y306 HydrophobicContact CG1-CE1 4.25Å; V304-Y306 HydrophobicContact CG1-CE2 4.45Å; V304-Y306 HydrophobicContact CG2-CD2 4.24Å; V304-Y306 HydrophobicContact CG2-CE2 3.97Å; Y306-K308 HydrophobicContact CE2-CG 4.41Å
307	I	92.8	Very high	93.3	Very high	109 Å²	109	50.4 Å²	50.4	56%	0.559	28%	0.276	S	S	*	.			trans	-79.4	129.9	-179.9	-58.6	174.3	0	0	0	109.8	D311 I312	I307-D311 HydrophobicContact CG2-CB 4.13Å; I307-I312 HydrophobicContact CG2-CD1 3.94Å; I307-I312 HydrophobicContact CG2-CG1 3.61Å
308	K	94	Very high	93.5	Very high	18 Å²	18	52.1 Å²	52.1	8%	0.078	29%	0.285	C	S	.	.			trans	-93.4	158.4	175.3	-54.9	-179.1	-60.4	-56.1	0	111.4	L167 R168 F170 V304 Y306 I310 D311 I312	L167-K308 HydrophobicContact CB-CD 4.15Å; L167-K308 HydrophobicContact CB-CG 4.47Å; L167-K308 WeakPolarHBondContact O-CG 3.4Å; R168-K308 CarbonylContact O-C 3.58Å; F170-K308 HydrophobicContact CB-CD 4.49Å; V304-K308 HydrophobicContact CG2-CD 3.85Å; V304-K308 HydrophobicContact CG2-CG 3.95Å; Y306-K308 HydrophobicContact CE2-CG 4.41Å; K308-I310 VanDerWaalsContact C-N 3.27Å; K308-I310 HydrophobicContact CB-CG2 4.02Å; K308-I310 PolarHBondContact O-N 2.75Å; K308-D311 WeakPolarHBondContact CB-OD2 3.29Å; K308-D311 PolarHBondContact N-OD2 2.9Å; K308-D311 IonicContact NZ-OD1 3.66Å; K308-D311 PolarHBondContact NZ-OD1 3.48Å; K308-D311 IonicContact NZ-OD2 2.76Å; K308-D311 PolarHBondContact NZ-OD2 3.13Å; K308-D311 WeakPolarHBondContact O-CB 3.19Å; K308-D311 PolarHBondContact O-N 3.48Å; K308-I312 PolarHBondContact O-N 3.5Å; K308-I312 VanDerWaalsContact O-N 3.15Å
309	A	93.4	Very high	93.6	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-57.7	-38.3	175.8	0	0	0	0	0	113	R168 F170 M172 D311 I312 W313 Y500 Y504	R168-A309 PolarHBondContact O-N 2.94Å; F170-A309 WeakPolarHBondContact O-CB 3.31Å; M172-A309 HydrophobicContact CE-CB 4.29Å; A309-D311 VanDerWaalsContact C-N 3.32Å; A309-D311 PolarHBondContact O-N 2.93Å; A309-I312 PolarHBondContact O-N 3.13Å; A309-W313 PolarHBondContact O-N 3.26Å; A309-Y500 WeakPolarHBondContact O-CE2 3.13Å; A309-Y500 PolarHBondContact O-OH 3.17Å; A309-Y504 HydrophobicContact CB-CD1 3.69Å; A309-Y504 HydrophobicContact CB-CD2 4.29Å; A309-Y504 HydrophobicContact CB-CE1 3.27Å; A309-Y504 HydrophobicContact CB-CE2 3.93Å; A309-Y504 HydrophobicContact CB-CG 4.2Å
310	I	93.8	Very high	93.7	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65.5	-31.5	173.2	-163.2	168.2	0	0	0	113	F170 W250 T254 Y297 K308 W313 T314	F170-I310 HydrophobicContact CD1-CB 4.3Å; F170-I310 HydrophobicContact CD1-CG2 3.83Å; F170-I310 HydrophobicContact CE1-CD1 4.2Å; F170-I310 HydrophobicContact CE1-CG2 4.38Å; F170-I310 PolarHBondContact O-N 3.23Å; F170-I310 VanDerWaalsContact O-N 3.14Å; W250-I310 HydrophobicContact CE3-CD1 3.77Å; W250-I310 HydrophobicContact CZ3-CD1 3.71Å; T254-I310 HydrophobicContact CG2-CD1 4.26Å; Y297-I310 HydrophobicContact CD1-CD1 4.34Å; Y297-I310 HydrophobicContact CD2-CD1 3.97Å; Y297-I310 HydrophobicContact CE1-CD1 4.32Å; Y297-I310 HydrophobicContact CE1-CG1 4.47Å; Y297-I310 HydrophobicContact CE2-CD1 4.02Å; Y297-I310 HydrophobicContact CE2-CG1 4.17Å; Y297-I310 HydrophobicContact CE2-CG2 4.26Å; Y297-I310 HydrophobicContact CG-CD1 4.19Å; K308-I310 VanDerWaalsContact C-N 3.27Å; K308-I310 HydrophobicContact CB-CG2 4.02Å; K308-I310 PolarHBondContact O-N 2.75Å; I310-W313 WeakPolarHBondContact O-CB 3.14Å; I310-W313 PolarHBondContact O-N 2.98Å; I310-T314 PolarHBondContact O-N 2.68Å; I310-T314 PolarHBondContact O-OG1 3.48Å
311	D	94.1	Very high	93.9	Very high	36 Å²	36	48.5 Å²	48.5	19%	0.193	25%	0.249	C	C	.	.	H	α-helix	trans	-70.3	-38.5	177.4	-57.5	-31.4	0	0	0	110.2	I307 K308 A309 W313 T314 I315	I307-D311 HydrophobicContact CG2-CB 4.13Å; K308-D311 WeakPolarHBondContact CB-OD2 3.29Å; K308-D311 PolarHBondContact N-OD2 2.9Å; K308-D311 IonicContact NZ-OD1 3.66Å; K308-D311 PolarHBondContact NZ-OD1 3.48Å; K308-D311 IonicContact NZ-OD2 2.76Å; K308-D311 PolarHBondContact NZ-OD2 3.13Å; K308-D311 WeakPolarHBondContact O-CB 3.19Å; K308-D311 PolarHBondContact O-N 3.48Å; A309-D311 VanDerWaalsContact C-N 3.32Å; A309-D311 PolarHBondContact O-N 2.93Å; D311-W313 VanDerWaalsContact C-N 3.32Å; D311-W313 PolarHBondContact O-N 3.05Å; D311-T314 PolarHBondContact O-N 2.9Å; D311-I315 WeakPolarHBondContact O-CB 3.35Å; D311-I315 WeakPolarHBondContact O-CD1 3.45Å; D311-I315 WeakPolarHBondContact O-CG1 3.4Å; D311-I315 PolarHBondContact O-N 3.37Å
312	I	94.1	Very high	94	Very high	65 Å²	65	50.2 Å²	50.2	33%	0.333	26%	0.261	S	S	.	.	H	α-helix	trans	-61.8	-42.1	174.8	-70.9	162.4	0	0	0	110.9	I307 K308 A309 A316 Y496 Y500 Y504	I307-I312 HydrophobicContact CG2-CD1 3.94Å; I307-I312 HydrophobicContact CG2-CG1 3.61Å; K308-I312 PolarHBondContact O-N 3.5Å; K308-I312 VanDerWaalsContact O-N 3.15Å; A309-I312 PolarHBondContact O-N 3.13Å; I312-A316 WeakPolarHBondContact O-CB 3.08Å; I312-A316 PolarHBondContact O-N 3.43Å; I312-Y496 PolarHBondContact O-OH 2.88Å; I312-Y500 HydrophobicContact CG2-CE2 4.48Å; I312-Y504 WeakPolarHBondContact CD1-OH 3.18Å
313	W	94.6	Very high	94	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-57.8	-49.8	173.3	174.5	-91.7	0	0	0	112	Y255 N258 I259 A309 I310 D311 A316 C317 F493 Y496 N497 Y500	Y255-W313 AromaticContact CD1-CD2 3.58Å; Y255-W313 HydrophobicContact CD1-CD2 3.58Å; Y255-W313 AromaticContact CD1-CE2 3.49Å; Y255-W313 VanDerWaalsContact CD1-CE2 3.49Å; Y255-W313 AromaticContact CD1-CE3 3.93Å; Y255-W313 HydrophobicContact CD1-CE3 3.93Å; Y255-W313 HydrophobicContact CD1-CG 4.04Å; Y255-W313 HydrophobicContact CD1-CH2 4.1Å; Y255-W313 AromaticContact CD1-CZ2 3.78Å; Y255-W313 HydrophobicContact CD1-CZ2 3.78Å; Y255-W313 HydrophobicContact CD1-CZ3 4.17Å; Y255-W313 AromaticContact CD1-NE1 3.88Å; Y255-W313 HydrophobicContact CE1-CB 4.19Å; Y255-W313 AromaticContact CE1-CD2 3.54Å; Y255-W313 HydrophobicContact CE1-CD2 3.54Å; Y255-W313 AromaticContact CE1-CE2 3.96Å; Y255-W313 AromaticContact CE1-CE3 3.84Å; Y255-W313 HydrophobicContact CE1-CE3 3.84Å; Y255-W313 AromaticContact CE1-CG 3.68Å; Y255-W313 HydrophobicContact CE1-CG 3.68Å; Y255-W313 HydrophobicContact CE1-CZ3 4.46Å; N258-W313 HydrophobicContact CB-CZ2 4.47Å; I259-W313 HydrophobicContact CD1-CH2 4.15Å; I259-W313 HydrophobicContact CD1-CZ2 4.38Å; I259-W313 HydrophobicContact CG1-CH2 3.95Å; I259-W313 HydrophobicContact CG1-CZ2 3.88Å; A309-W313 PolarHBondContact O-N 3.26Å; I310-W313 WeakPolarHBondContact O-CB 3.14Å; I310-W313 PolarHBondContact O-N 2.98Å; D311-W313 VanDerWaalsContact C-N 3.32Å; D311-W313 PolarHBondContact O-N 3.05Å; W313-A316 PolarHBondContact O-N 3.15Å; W313-C317 PolarHBondContact O-N 3.35Å; W313-C317 PolarHBondContact O-SG 3.3Å; W313-F493 HydrophobicContact CH2-CZ 4.35Å; W313-Y496 WeakPolarHBondContact CA-OH 3.44Å; W313-Y496 AromaticContact CE3-CE1 3.9Å; W313-Y496 HydrophobicContact CE3-CE1 3.9Å; W313-Y496 HydrophobicContact CZ3-CE1 4.09Å; W313-N497 WeakPolarHBondContact CH2-OD1 3.45Å; W313-N497 WeakPolarHBondContact CZ3-OD1 2.99Å; W313-Y500 HydrophobicContact CB-CE2 3.87Å; W313-Y500 AromaticContact CE3-CD1 3.76Å; W313-Y500 HydrophobicContact CE3-CD1 3.76Å; W313-Y500 HydrophobicContact CE3-CD2 4.22Å; W313-Y500 AromaticContact CE3-CE1 3.85Å; W313-Y500 HydrophobicContact CE3-CE1 3.85Å; W313-Y500 HydrophobicContact CE3-CE2 4.27Å; W313-Y500 AromaticContact CE3-CG 3.97Å; W313-Y500 HydrophobicContact CE3-CG 3.97Å; W313-Y500 HydrophobicContact CZ3-CD1 4.09Å; W313-Y500 HydrophobicContact CZ3-CE1 4.48Å; W313-Y500 HydrophobicContact CZ3-CG 4.39Å
314	T	94	Very high	94	Very high	5 Å²	5	38.2 Å²	38.2	3%	0.031	22%	0.22	C	C	.	.	H	α-helix	trans	-68.6	-40.1	-177.8	-66.6	0	0	0	0	112.6	V290 Y297 I310 D311 A316 C317 I318	V290-T314 HydrophobicContact CG1-CG2 4.47Å; Y297-T314 VanDerWaalsContact OH-CB 3.27Å; Y297-T314 WeakPolarHBondContact OH-CB 3.49Å; Y297-T314 WeakPolarHBondContact OH-CG2 3.34Å; Y297-T314 PolarHBondContact OH-OG1 3.27Å; I310-T314 PolarHBondContact O-N 2.68Å; I310-T314 PolarHBondContact O-OG1 3.48Å; D311-T314 PolarHBondContact O-N 2.9Å; T314-A316 VanDerWaalsContact C-N 3.29Å; T314-A316 PolarHBondContact O-N 2.99Å; T314-C317 PolarHBondContact O-N 2.77Å; T314-I318 HydrophobicContact CG2-CD1 3.88Å; T314-I318 HydrophobicContact CG2-CG1 4.41Å; T314-I318 VanDerWaalsContact O-CG1 3.31Å; T314-I318 WeakPolarHBondContact O-CG1 3.08Å; T314-I318 PolarHBondContact O-N 3.37Å
315	I	95.1	Very high	94	Very high	94 Å²	94	38.9 Å²	38.9	48%	0.482	22%	0.222	S	C	.	.	H	α-helix	trans	-59.9	-41.9	174.2	-70.6	164.8	0	0	0	110.3	D311 I318 T319	D311-I315 WeakPolarHBondContact O-CB 3.35Å; D311-I315 WeakPolarHBondContact O-CD1 3.45Å; D311-I315 WeakPolarHBondContact O-CG1 3.4Å; D311-I315 PolarHBondContact O-N 3.37Å; I315-I318 PolarHBondContact O-N 3.15Å; I315-T319 WeakPolarHBondContact O-CB 3.35Å; I315-T319 PolarHBondContact O-N 2.89Å; I315-T319 PolarHBondContact O-OG1 2.95Å
316	A	95	Very high	94	Very high	14 Å²	14	37.8 Å²	37.8	12%	0.116	21%	0.206	C	C	.	.	H	α-helix	trans	-63.6	-46.6	175.6	0	0	0	0	0	111.7	I312 W313 T314 I318 T319 F320 Y496	I312-A316 WeakPolarHBondContact O-CB 3.08Å; I312-A316 PolarHBondContact O-N 3.43Å; W313-A316 PolarHBondContact O-N 3.15Å; T314-A316 VanDerWaalsContact C-N 3.29Å; T314-A316 PolarHBondContact O-N 2.99Å; A316-I318 PolarHBondContact O-N 2.88Å; A316-T319 WeakPolarHBondContact O-CB 3.1Å; A316-T319 PolarHBondContact O-N 3.24Å; A316-T319 VanDerWaalsContact O-N 3.12Å; A316-F320 WeakPolarHBondContact O-CD2 3.14Å; A316-F320 PolarHBondContact O-N 2.84Å; A316-Y496 HydrophobicContact CB-CD1 4.29Å; A316-Y496 HydrophobicContact CB-CD2 4.32Å; A316-Y496 HydrophobicContact CB-CE1 3.59Å; A316-Y496 HydrophobicContact CB-CE2 3.61Å; A316-Y496 VanDerWaalsContact CB-OH 3.24Å; A316-Y496 WeakPolarHBondContact CB-OH 3.34Å
317	C	95.1	Very high	93.9	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58.4	-45	176.7	-66.3	0	0	0	0	112.1	M262 V290 W313 T314 T319 F320 N321	M262-C317 HydrophobicContact SD-CB 4.32Å; V290-C317 HydrophobicContact CG1-CB 3.9Å; W313-C317 PolarHBondContact O-N 3.35Å; W313-C317 PolarHBondContact O-SG 3.3Å; T314-C317 PolarHBondContact O-N 2.77Å; C317-T319 VanDerWaalsContact C-N 3.33Å; C317-T319 PolarHBondContact O-N 2.79Å; C317-F320 PolarHBondContact O-N 3.14Å; C317-N321 VanDerWaalsContact O-CB 3.31Å; C317-N321 WeakPolarHBondContact O-CB 3.32Å; C317-N321 PolarHBondContact O-N 3.21Å
318	I	95.4	Very high	93.8	Very high	50 Å²	50	31.6 Å²	31.6	26%	0.256	18%	0.176	S	C	.	.	H	α-helix	trans	-61.4	-41.6	175.3	-68.9	169.5	0	0	0	110.9	L287 V290 I291 T314 I315 A316 N321 S322	L287-I318 HydrophobicContact CD1-CG2 4.27Å; V290-I318 HydrophobicContact CG1-CG1 3.76Å; I291-I318 HydrophobicContact CG1-CD1 4.39Å; T314-I318 HydrophobicContact CG2-CD1 3.88Å; T314-I318 HydrophobicContact CG2-CG1 4.41Å; T314-I318 VanDerWaalsContact O-CG1 3.31Å; T314-I318 WeakPolarHBondContact O-CG1 3.08Å; T314-I318 PolarHBondContact O-N 3.37Å; I315-I318 PolarHBondContact O-N 3.15Å; A316-I318 PolarHBondContact O-N 2.88Å; I318-N321 PolarHBondContact O-N 2.84Å; I318-S322 VanDerWaalsContact O-CB 3.25Å; I318-S322 WeakPolarHBondContact O-CB 3.49Å; I318-S322 PolarHBondContact O-N 3.07Å; I318-S322 PolarHBondContact O-OG 3.42Å
319	T	95.1	Very high	93.7	Very high	89 Å²	89	33.1 Å²	33.1	55%	0.546	19%	0.192	S	C	.	.	H	α-helix	trans	-64.8	-47.1	179	-57.8	0	0	0	0	111.4	I315 A316 C317 S322 G323	I315-T319 WeakPolarHBondContact O-CB 3.35Å; I315-T319 PolarHBondContact O-N 2.89Å; I315-T319 PolarHBondContact O-OG1 2.95Å; A316-T319 WeakPolarHBondContact O-CB 3.1Å; A316-T319 PolarHBondContact O-N 3.24Å; A316-T319 VanDerWaalsContact O-N 3.12Å; C317-T319 VanDerWaalsContact C-N 3.33Å; C317-T319 PolarHBondContact O-N 2.79Å; T319-S322 PolarHBondContact O-N 3.17Å; T319-G323 PolarHBondContact O-N 2.72Å
320	F	94.6	Very high	93.6	Very high	39 Å²	39	37 Å²	37	17%	0.171	21%	0.212	C	C	.	.	H	α-helix	trans	-62.9	-44.1	177	-80.7	-71.5	0	0	0	111.8	M262 A316 C317 G323 V324 C492 F493 Y496	M262-F320 HydrophobicContact CE-CB 3.35Å; M262-F320 HydrophobicContact CE-CG 4.37Å; M262-F320 HydrophobicContact SD-CB 4.47Å; A316-F320 WeakPolarHBondContact O-CD2 3.14Å; A316-F320 PolarHBondContact O-N 2.84Å; C317-F320 PolarHBondContact O-N 3.14Å; F320-G323 WeakPolarHBondContact O-CA 3.48Å; F320-G323 PolarHBondContact O-N 2.88Å; F320-G323 VanDerWaalsContact O-N 3.16Å; F320-V324 PolarHBondContact O-N 2.98Å; F320-V324 VanDerWaalsContact O-N 3.12Å; F320-C492 HydrophobicContact CE1-CB 3.78Å; F320-C492 HydrophobicContact CZ-CB 4.26Å; F320-F493 AromaticContact CD2-CD2 3.74Å; F320-F493 HydrophobicContact CD2-CD2 3.74Å; F320-F493 HydrophobicContact CD2-CE2 4.38Å; F320-F493 HydrophobicContact CE1-CB 4.37Å; F320-F493 AromaticContact CE2-CD2 3.89Å; F320-F493 HydrophobicContact CE2-CD2 3.89Å; F320-F493 HydrophobicContact CG-CD2 4.19Å; F320-F493 HydrophobicContact CZ-CB 4.39Å; F320-F493 HydrophobicContact CZ-CD2 4.44Å; F320-Y496 HydrophobicContact CE2-CD1 4.29Å; F320-Y496 HydrophobicContact CE2-CG 4.07Å
321	N	93.9	Very high	93.4	Very high	1 Å²	1	37 Å²	37	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-65.2	-42.1	178.8	-166.5	-82.1	0	0	0	112	M262 S265 S283 T286 L287 C317 I318 G323 V324 L325	M262-N321 HydrophobicContact SD-CB 4.32Å; S265-N321 WeakPolarHBondContact CB-ND2 3.14Å; S283-N321 PolarHBondContact O-OD1 3.24Å; T286-N321 VanDerWaalsContact CB-ND2 3.25Å; T286-N321 WeakPolarHBondContact CB-ND2 3.28Å; T286-N321 PolarHBondContact OG1-ND2 3.02Å; L287-N321 VanDerWaalsContact CA-OD1 3.31Å; L287-N321 WeakPolarHBondContact CA-OD1 3.26Å; L287-N321 VanDerWaalsContact CB-OD1 3.23Å; L287-N321 WeakPolarHBondContact CB-OD1 3.36Å; L287-N321 HydrophobicContact CD1-CB 4.39Å; L287-N321 PolarHBondContact N-OD1 3.43Å; C317-N321 VanDerWaalsContact O-CB 3.31Å; C317-N321 WeakPolarHBondContact O-CB 3.32Å; C317-N321 PolarHBondContact O-N 3.21Å; I318-N321 PolarHBondContact O-N 2.84Å; N321-G323 VanDerWaalsContact C-N 3.26Å; N321-G323 PolarHBondContact O-N 3.43Å; N321-V324 WeakPolarHBondContact O-CB 3.44Å; N321-V324 PolarHBondContact O-N 3.04Å; N321-V324 VanDerWaalsContact O-N 3.15Å; N321-L325 PolarHBondContact O-N 2.8Å
322	S	93.9	Very high	93.1	Very high	46 Å²	46	36.8 Å²	36.8	32%	0.322	21%	0.213	S	C	.	.	H	α-helix	trans	-62.9	-34.2	172.4	-58.2	0	0	0	0	112.1	I318 T319 V324 L325 L326	I318-S322 VanDerWaalsContact O-CB 3.25Å; I318-S322 WeakPolarHBondContact O-CB 3.49Å; I318-S322 PolarHBondContact O-N 3.07Å; I318-S322 PolarHBondContact O-OG 3.42Å; T319-S322 PolarHBondContact O-N 3.17Å; S322-V324 VanDerWaalsContact C-N 3.34Å; S322-V324 PolarHBondContact O-N 3.37Å; S322-L325 PolarHBondContact O-N 3.48Å; S322-L326 WeakPolarHBondContact O-CB 3.45Å; S322-L326 PolarHBondContact O-N 3.1Å
323	G	93.3	Very high	92.8	Very high	20 Å²	20	37 Å²	37	21%	0.206	21%	0.213	C	C	.	.	H	α-helix	trans	-61.5	-38.2	173.1	0	0	0	0	0	113	T319 F320 N321 L326 E327	T319-G323 PolarHBondContact O-N 2.72Å; F320-G323 WeakPolarHBondContact O-CA 3.48Å; F320-G323 PolarHBondContact O-N 2.88Å; F320-G323 VanDerWaalsContact O-N 3.16Å; N321-G323 VanDerWaalsContact C-N 3.26Å; N321-G323 PolarHBondContact O-N 3.43Å; G323-L326 PolarHBondContact O-N 2.91Å; G323-E327 WeakPolarHBondContact O-CB 3.32Å; G323-E327 PolarHBondContact O-N 2.7Å
324	V	92.7	Very high	92.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.3	-41	173.1	178.1	0	0	0	0	111	N268 F269 F320 N321 S322 E327 F328 F489	N268-V324 HydrophobicContact CB-CG1 3.94Å; N268-V324 WeakPolarHBondContact ND2-CG1 3.45Å; F269-V324 HydrophobicContact CE1-CG1 4.14Å; F269-V324 HydrophobicContact CZ-CB 4.48Å; F269-V324 HydrophobicContact CZ-CG1 4.21Å; F269-V324 HydrophobicContact CZ-CG2 3.9Å; F320-V324 PolarHBondContact O-N 2.98Å; F320-V324 VanDerWaalsContact O-N 3.12Å; N321-V324 WeakPolarHBondContact O-CB 3.44Å; N321-V324 PolarHBondContact O-N 3.04Å; N321-V324 VanDerWaalsContact O-N 3.15Å; S322-V324 VanDerWaalsContact C-N 3.34Å; S322-V324 PolarHBondContact O-N 3.37Å; V324-E327 PolarHBondContact O-N 2.86Å; V324-F328 PolarHBondContact O-N 2.83Å; V324-F489 HydrophobicContact CG2-CD1 4.13Å; V324-F489 HydrophobicContact CG2-CE1 4.15Å
325	L	92.3	Very high	92.3	Very high	52 Å²	52	41.6 Å²	41.6	27%	0.272	24%	0.241	S	C	.	.	H	α-helix	trans	-66.4	-39.4	176.7	-174.7	67.3	0	0	0	111.8	L284 N321 S322 F328 A329	L284-L325 HydrophobicContact CD2-CD2 4.38Å; N321-L325 PolarHBondContact O-N 2.8Å; S322-L325 PolarHBondContact O-N 3.48Å; L325-F328 PolarHBondContact O-N 3.16Å; L325-A329 PolarHBondContact O-N 3.23Å
326	L	93	Very high	91.9	Very high	108 Å²	108	44.8 Å²	44.8	57%	0.565	25%	0.247	S	C	*	.	H	α-helix	trans	-65.8	-42.2	176.2	-177.6	62.2	0	0	0	111.7	S322 G323 F328 A329 I330	S322-L326 WeakPolarHBondContact O-CB 3.45Å; S322-L326 PolarHBondContact O-N 3.1Å; G323-L326 PolarHBondContact O-N 2.91Å; L326-F328 VanDerWaalsContact C-N 3.32Å; L326-F328 PolarHBondContact O-N 3.18Å; L326-A329 PolarHBondContact O-N 3.29Å; L326-I330 HydrophobicContact CD1-CD1 4.14Å; L326-I330 HydrophobicContact CD1-CG1 4.42Å; L326-I330 HydrophobicContact CG-CD1 3.93Å; L326-I330 VanDerWaalsContact O-CG1 3.31Å; L326-I330 WeakPolarHBondContact O-CG1 3.42Å; L326-I330 PolarHBondContact O-N 2.84Å
327	E	91.9	Very high	91.6	Very high	11 Å²	11	52 Å²	52	5%	0.051	27%	0.271	C	S	.	.	H	α-helix	trans	-55.7	-49.6	172.7	-173.2	-74.3	150.6	0	0	110.5	F269 G323 V324 A329 I330 A331 I481 S485 F489	F269-E327 HydrophobicContact CE1-CB 4.41Å; F269-E327 HydrophobicContact CE1-CG 4Å; G323-E327 WeakPolarHBondContact O-CB 3.32Å; G323-E327 PolarHBondContact O-N 2.7Å; V324-E327 PolarHBondContact O-N 2.86Å; E327-A329 VanDerWaalsContact C-N 3.34Å; E327-A329 PolarHBondContact O-N 3.21Å; E327-I330 PolarHBondContact O-N 3.26Å; E327-A331 VanDerWaalsContact O-CB 3.28Å; E327-A331 WeakPolarHBondContact O-CB 3.37Å; E327-A331 PolarHBondContact O-N 3.43Å; E327-I481 HydrophobicContact CG-CG2 4.19Å; E327-I481 VanDerWaalsContact OE1-CG2 3.25Å; E327-I481 WeakPolarHBondContact OE1-CG2 3.29Å; E327-S485 VanDerWaalsContact CG-OG 3.29Å; E327-S485 WeakPolarHBondContact CG-OG 3.4Å; E327-F489 HydrophobicContact CB-CE2 4.32Å; E327-F489 HydrophobicContact CB-CZ 4.23Å; E327-F489 HydrophobicContact CG-CE2 4.27Å
328	F	90.5	Very high	91.3	Very high	15 Å²	15	57.9 Å²	57.9	7%	0.066	30%	0.299	C	S	.	.	H	α-helix	trans	-59.6	-44	177.8	167	-104.4	0	0	0	112.1	I276 R279 V280 V324 L325 L326 I330 A331 S332	I276-F328 HydrophobicContact CG2-CZ 4.17Å; R279-F328 HydrophobicContact CB-CD2 3.8Å; R279-F328 HydrophobicContact CB-CE2 3.67Å; R279-F328 HydrophobicContact CB-CG 4.49Å; R279-F328 HydrophobicContact CB-CZ 4.3Å; R279-F328 HydrophobicContact CG-CD2 4.32Å; R279-F328 HydrophobicContact CG-CE2 4.29Å; V280-F328 HydrophobicContact CG2-CD1 4.22Å; V280-F328 HydrophobicContact CG2-CE1 3.3Å; V280-F328 HydrophobicContact CG2-CZ 3.61Å; V324-F328 PolarHBondContact O-N 2.83Å; L325-F328 PolarHBondContact O-N 3.16Å; L326-F328 VanDerWaalsContact C-N 3.32Å; L326-F328 PolarHBondContact O-N 3.18Å; F328-I330 PolarHBondContact O-N 2.82Å; F328-A331 PolarHBondContact O-N 3.18Å; F328-S332 WeakPolarHBondContact O-CB 3.1Å; F328-S332 PolarHBondContact O-N 2.75Å
329	A	91.5	Very high	90.8	Very high	51 Å²	51	62.9 Å²	62.9	42%	0.421	32%	0.318	S	S	.	.	H	α-helix	trans	-61.5	-43.1	178	0	0	0	0	0	111.9	L325 L326 E327 H333	L325-A329 PolarHBondContact O-N 3.23Å; L326-A329 PolarHBondContact O-N 3.29Å; E327-A329 VanDerWaalsContact C-N 3.34Å; E327-A329 PolarHBondContact O-N 3.21Å; A329-H333 VanDerWaalsContact O-CB 3.26Å; A329-H333 WeakPolarHBondContact O-CB 3.5Å; A329-H333 PolarHBondContact O-N 2.93Å
330	I	91.6	Very high	90.5	Very high	82 Å²	82	62 Å²	62	42%	0.421	31%	0.313	S	S	.	.	H	α-helix	trans	-67.8	-47.7	177.7	-67.9	168	0	0	0	110.8	L326 E327 F328 S332 H333 L334	L326-I330 HydrophobicContact CD1-CD1 4.14Å; L326-I330 HydrophobicContact CD1-CG1 4.42Å; L326-I330 HydrophobicContact CG-CD1 3.93Å; L326-I330 VanDerWaalsContact O-CG1 3.31Å; L326-I330 WeakPolarHBondContact O-CG1 3.42Å; L326-I330 PolarHBondContact O-N 2.84Å; E327-I330 PolarHBondContact O-N 3.26Å; F328-I330 PolarHBondContact O-N 2.82Å; I330-S332 PolarHBondContact O-N 3.08Å; I330-H333 PolarHBondContact O-N 3.43Å; I330-L334 HydrophobicContact CG2-CD1 3.78Å; I330-L334 HydrophobicContact CG2-CG 4.46Å; I330-L334 WeakPolarHBondContact O-CB 3.24Å; I330-L334 WeakPolarHBondContact O-CG 3.22Å; I330-L334 PolarHBondContact O-N 2.53Å
331	A	89.2	Confident	90.2	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-63.1	-42.7	-179.6	0	0	0	0	0	111.6	L273 E327 F328 L334 A335 I481	L273-A331 HydrophobicContact CD2-CB 3.82Å; E327-A331 VanDerWaalsContact O-CB 3.28Å; E327-A331 WeakPolarHBondContact O-CB 3.37Å; E327-A331 PolarHBondContact O-N 3.43Å; F328-A331 PolarHBondContact O-N 3.18Å; A331-L334 PolarHBondContact O-N 2.79Å; A331-A335 WeakPolarHBondContact O-CB 3.41Å; A331-A335 PolarHBondContact O-N 2.88Å; A331-I481 HydrophobicContact CB-CD1 4.3Å
332	S	88.1	Confident	89.9	Confident	31 Å²	31	69 Å²	69	22%	0.217	35%	0.353	C	S	.	.	H	α-helix	trans	-63.6	-43.9	174.7	-179.7	0	0	0	0	112	F328 I330 R336	F328-S332 WeakPolarHBondContact O-CB 3.1Å; F328-S332 PolarHBondContact O-N 2.75Å; I330-S332 PolarHBondContact O-N 3.08Å; S332-R336 WeakPolarHBondContact O-CB 3.39Å; S332-R336 PolarHBondContact O-N 2.89Å
333	H	89	Confident	89.6	Confident	69 Å²	69	74.9 Å²	74.9	32%	0.319	37%	0.368	S	S	.	.	H	α-helix	trans	-63.8	-43.1	177.7	177.5	-100.9	0	0	0	112.3	A329 I330 R337	A329-H333 VanDerWaalsContact O-CB 3.26Å; A329-H333 WeakPolarHBondContact O-CB 3.5Å; A329-H333 PolarHBondContact O-N 2.93Å; I330-H333 PolarHBondContact O-N 3.43Å; H333-R337 PolarHBondContact CE1-NE 3.43Å; H333-R337 PolarHBondContact CE1-NH2 2.81Å; H333-R337 PolarHBondContact NE2-NE 3.46Å; H333-R337 WeakPolarHBondContact O-CG 3.43Å; H333-R337 PolarHBondContact O-N 3.09Å; H333-R337 VanDerWaalsContact O-N 3.1Å
334	L	89.8	Confident	89.4	Confident	72 Å²	72	78.1 Å²	78.1	38%	0.377	38%	0.378	S	S	.	.	H	α-helix	trans	-69.8	-42.2	177.8	-71.8	172	0	0	0	112.3	I330 A331 R336 R337 Q338 I481	I330-L334 HydrophobicContact CG2-CD1 3.78Å; I330-L334 HydrophobicContact CG2-CG 4.46Å; I330-L334 WeakPolarHBondContact O-CB 3.24Å; I330-L334 WeakPolarHBondContact O-CG 3.22Å; I330-L334 PolarHBondContact O-N 2.53Å; A331-L334 PolarHBondContact O-N 2.79Å; L334-R336 VanDerWaalsContact C-N 3.31Å; L334-R336 PolarHBondContact O-N 2.86Å; L334-R337 PolarHBondContact O-N 2.92Å; L334-Q338 WeakPolarHBondContact O-CG 3.41Å; L334-Q338 PolarHBondContact O-N 3.25Å; L334-I481 HydrophobicContact CB-CD1 4.47Å; L334-I481 HydrophobicContact CD1-CD1 3.45Å; L334-I481 VanDerWaalsContact CD1-CD1 3.45Å
335	A	86.7	Confident	89.3	Confident	29 Å²	29	81 Å²	81	24%	0.24	40%	0.396	C	S	.	.	H	α-helix	trans	-60.9	-40.7	174.8	0	0	0	0	0	111.6	L273 A331 Q338 K339	L273-A335 HydrophobicContact CD1-CB 3.96Å; A331-A335 WeakPolarHBondContact O-CB 3.41Å; A331-A335 PolarHBondContact O-N 2.88Å; A335-Q338 PolarHBondContact O-N 2.76Å; A335-K339 WeakPolarHBondContact O-CB 3.49Å; A335-K339 PolarHBondContact O-N 2.83Å
336	R	87.4	Confident	89.1	Confident	162 Å²	162	82.1 Å²	82.1	61%	0.611	40%	0.4	S	S	*	.	H	α-helix	trans	-62.7	-42.4	174.2	-172.5	175	66.4	-167.2	1.5	111.9	S332 L334 K339 V340	S332-R336 WeakPolarHBondContact O-CB 3.39Å; S332-R336 PolarHBondContact O-N 2.89Å; L334-R336 VanDerWaalsContact C-N 3.31Å; L334-R336 PolarHBondContact O-N 2.86Å; R336-K339 PolarHBondContact O-N 2.94Å; R336-V340 VanDerWaalsContact O-CG2 3.28Å; R336-V340 WeakPolarHBondContact O-CG2 3.27Å; R336-V340 PolarHBondContact O-N 2.71Å
337	R	89.3	Confident	89	Confident	164 Å²	164	78.6 Å²	78.6	62%	0.619	38%	0.383	S	S	*	.	H	α-helix	trans	-63.5	-42.2	175.9	-75.8	-171.6	176.1	-162.6	0.8	112.2	H333 L334 V340 S341	H333-R337 PolarHBondContact CE1-NE 3.43Å; H333-R337 PolarHBondContact CE1-NH2 2.81Å; H333-R337 PolarHBondContact NE2-NE 3.46Å; H333-R337 WeakPolarHBondContact O-CG 3.43Å; H333-R337 PolarHBondContact O-N 3.09Å; H333-R337 VanDerWaalsContact O-N 3.1Å; L334-R337 PolarHBondContact O-N 2.92Å; R337-V340 PolarHBondContact O-N 2.81Å; R337-S341 PolarHBondContact O-N 2.74Å
338	Q	87.2	Confident	88.9	Confident	125 Å²	125	85 Å²	85	58%	0.584	41%	0.406	S	S	*	.	H	α-helix	trans	-64.2	-46.9	176.2	-73.7	176.9	-13.1	0	0	111.6	L334 A335 V340 S341 E342	L334-Q338 WeakPolarHBondContact O-CG 3.41Å; L334-Q338 PolarHBondContact O-N 3.25Å; A335-Q338 PolarHBondContact O-N 2.76Å; Q338-V340 VanDerWaalsContact C-N 3.3Å; Q338-V340 PolarHBondContact O-N 2.92Å; Q338-S341 WeakPolarHBondContact O-CB 3.38Å; Q338-S341 PolarHBondContact O-N 3.03Å; Q338-S341 VanDerWaalsContact O-N 3.09Å; Q338-E342 WeakPolarHBondContact O-CG 3.46Å; Q338-E342 PolarHBondContact O-N 3.15Å
339	K	85.9	Confident	88.9	Confident	154 Å²	154	88.7 Å²	88.7	67%	0.67	42%	0.422	S	S	*	.	H	α-helix	trans	-59.1	-39.1	177	-170.6	173.8	-176.4	173.8	0	112.6	A335 R336 W343	A335-K339 WeakPolarHBondContact O-CB 3.49Å; A335-K339 PolarHBondContact O-N 2.83Å; R336-K339 PolarHBondContact O-N 2.94Å; K339-W343 VanDerWaalsContact O-CB 3.23Å; K339-W343 WeakPolarHBondContact O-CB 3.44Å; K339-W343 PolarHBondContact O-N 2.05Å
340	V	88.5	Confident	88.8	Confident	71 Å²	71	91 Å²	91	43%	0.43	43%	0.427	S	S	.	.	H	α-helix	trans	-66.9	-42.2	174.9	171.5	0	0	0	0	111.4	R336 R337 Q338 W343 Q344	R336-V340 VanDerWaalsContact O-CG2 3.28Å; R336-V340 WeakPolarHBondContact O-CG2 3.27Å; R336-V340 PolarHBondContact O-N 2.71Å; R337-V340 PolarHBondContact O-N 2.81Å; Q338-V340 VanDerWaalsContact C-N 3.3Å; Q338-V340 PolarHBondContact O-N 2.92Å; V340-W343 PolarHBondContact O-N 3.48Å; V340-Q344 VanDerWaalsContact O-CG 3.31Å; V340-Q344 WeakPolarHBondContact O-CG 3.42Å; V340-Q344 PolarHBondContact O-N 3.27Å
341	S	88.4	Confident	88.8	Confident	66 Å²	66	90 Å²	90	46%	0.462	42%	0.424	S	S	.	.	H	α-helix	trans	-62.5	-47.3	175.9	-179	0	0	0	0	112	R337 Q338 W343 Q344 V345	R337-S341 PolarHBondContact O-N 2.74Å; Q338-S341 WeakPolarHBondContact O-CB 3.38Å; Q338-S341 PolarHBondContact O-N 3.03Å; Q338-S341 VanDerWaalsContact O-N 3.09Å; S341-W343 PolarHBondContact O-N 3.08Å; S341-Q344 WeakPolarHBondContact O-CB 3.29Å; S341-Q344 PolarHBondContact O-N 2.9Å; S341-V345 WeakPolarHBondContact O-CG2 3.46Å; S341-V345 PolarHBondContact O-N 3.32Å
342	E	88.7	Confident	88.8	Confident	122 Å²	122	98.4 Å²	98.4	57%	0.57	46%	0.456	S	S	*	.	H	α-helix	trans	-61.5	-44	176.1	-72.2	-179.5	-177.4	0	0	111.6	Q338 Q344 V345 E346	Q338-E342 WeakPolarHBondContact O-CG 3.46Å; Q338-E342 PolarHBondContact O-N 3.15Å; E342-Q344 VanDerWaalsContact C-N 3.33Å; E342-Q344 PolarHBondContact O-N 2.79Å; E342-V345 PolarHBondContact O-N 2.91Å; E342-V345 VanDerWaalsContact O-N 3.16Å; E342-E346 WeakPolarHBondContact O-CG 3.39Å; E342-E346 PolarHBondContact O-N 2.94Å
343	W	87.6	Confident	88.7	Confident	168 Å²	168	105 Å²	105	64%	0.636	48%	0.476	S	S	*	.	H	α-helix	trans	-59.7	-42.6	175.5	178.7	80	0	0	0	111.7	K339 V340 S341 V345 E346 V347	K339-W343 VanDerWaalsContact O-CB 3.23Å; K339-W343 WeakPolarHBondContact O-CB 3.44Å; K339-W343 PolarHBondContact O-N 2.05Å; V340-W343 PolarHBondContact O-N 3.48Å; S341-W343 PolarHBondContact O-N 3.08Å; W343-V345 VanDerWaalsContact C-N 3.32Å; W343-V345 PolarHBondContact O-N 2.88Å; W343-E346 PolarHBondContact O-N 2.91Å; W343-V347 HydrophobicContact CD2-CG2 3.92Å; W343-V347 HydrophobicContact CE3-CG2 4.47Å; W343-V347 HydrophobicContact CG-CG2 4.31Å; W343-V347 HydrophobicContact CH2-CG2 4.36Å; W343-V347 HydrophobicContact CZ2-CG2 3.79Å; W343-V347 WeakPolarHBondContact O-CB 3.45Å; W343-V347 WeakPolarHBondContact O-CG2 3.3Å; W343-V347 PolarHBondContact O-N 2.97Å
344	Q	89.2	Confident	88.6	Confident	88 Å²	88	105.7 Å²	105.7	41%	0.411	48%	0.48	S	S	.	.	H	α-helix	trans	-61.2	-40.2	175.3	-74	177.2	-0.7	0	0	112.4	V340 S341 E342 R348	V340-Q344 VanDerWaalsContact O-CG 3.31Å; V340-Q344 WeakPolarHBondContact O-CG 3.42Å; V340-Q344 PolarHBondContact O-N 3.27Å; S341-Q344 WeakPolarHBondContact O-CB 3.29Å; S341-Q344 PolarHBondContact O-N 2.9Å; E342-Q344 VanDerWaalsContact C-N 3.33Å; E342-Q344 PolarHBondContact O-N 2.79Å; Q344-R348 WeakPolarHBondContact O-CB 3.43Å; Q344-R348 VanDerWaalsContact O-CG 3.23Å; Q344-R348 WeakPolarHBondContact O-CG 3.46Å; Q344-R348 PolarHBondContact O-N 3.13Å
345	V	89.1	Confident	88.5	Confident	62 Å²	62	107.4 Å²	107.4	38%	0.376	49%	0.489	S	S	.	.	H	α-helix	trans	-68.6	-44.3	177.3	173	0	0	0	0	111.3	S341 E342 W343 R348 K349	S341-V345 WeakPolarHBondContact O-CG2 3.46Å; S341-V345 PolarHBondContact O-N 3.32Å; E342-V345 PolarHBondContact O-N 2.91Å; E342-V345 VanDerWaalsContact O-N 3.16Å; W343-V345 VanDerWaalsContact C-N 3.32Å; W343-V345 PolarHBondContact O-N 2.88Å; V345-R348 PolarHBondContact O-N 2.81Å; V345-K349 WeakPolarHBondContact O-CG 3.44Å; V345-K349 PolarHBondContact O-N 2.98Å
346	E	88.5	Confident	88.4	Confident	74 Å²	74	108.9 Å²	108.9	35%	0.346	50%	0.501	S	S	.	.	H	α-helix	trans	-65.2	-41.4	178.2	-70.9	-64.3	114.2	0	0	111.7	E342 W343 R348 K349 L350 R471	E342-E346 WeakPolarHBondContact O-CG 3.39Å; E342-E346 PolarHBondContact O-N 2.94Å; W343-E346 PolarHBondContact O-N 2.91Å; E346-R348 PolarHBondContact O-N 3.16Å; E346-K349 PolarHBondContact O-N 2.78Å; E346-K349 IonicContact OE1-NZ 2.75Å; E346-K349 PolarHBondContact OE1-NZ 3.42Å; E346-L350 WeakPolarHBondContact O-CB 3.41Å; E346-L350 PolarHBondContact O-N 3Å; E346-R471 IonicContact OE2-NH2 3.76Å
347	V	90.3	Very high	88.3	Confident	34 Å²	34	108.6 Å²	108.6	21%	0.206	50%	0.5	C	S	.	.	H	α-helix	trans	-61	-43.8	172.9	170	0	0	0	0	110.8	W343 K349 L350 V351	W343-V347 HydrophobicContact CD2-CG2 3.92Å; W343-V347 HydrophobicContact CE3-CG2 4.47Å; W343-V347 HydrophobicContact CG-CG2 4.31Å; W343-V347 HydrophobicContact CH2-CG2 4.36Å; W343-V347 HydrophobicContact CZ2-CG2 3.79Å; W343-V347 WeakPolarHBondContact O-CB 3.45Å; W343-V347 WeakPolarHBondContact O-CG2 3.3Å; W343-V347 PolarHBondContact O-N 2.97Å; V347-K349 VanDerWaalsContact C-N 3.33Å; V347-K349 PolarHBondContact O-N 3.37Å; V347-L350 PolarHBondContact O-N 3.04Å; V347-V351 HydrophobicContact CG1-CG2 4.26Å; V347-V351 WeakPolarHBondContact O-CB 3.36Å; V347-V351 VanDerWaalsContact O-CG2 3.27Å; V347-V351 WeakPolarHBondContact O-CG2 3.46Å; V347-V351 PolarHBondContact O-N 2.9Å
348	R	90.3	Very high	88	Confident	146 Å²	146	110 Å²	110	55%	0.551	51%	0.505	S	S	*	.	H	α-helix	trans	-61.3	-40.3	175.2	-74.4	173.9	-166.6	172.7	6.8	112.2	Q344 V345 E346 R352	Q344-R348 WeakPolarHBondContact O-CB 3.43Å; Q344-R348 VanDerWaalsContact O-CG 3.23Å; Q344-R348 WeakPolarHBondContact O-CG 3.46Å; Q344-R348 PolarHBondContact O-N 3.13Å; V345-R348 PolarHBondContact O-N 2.81Å; E346-R348 PolarHBondContact O-N 3.16Å; R348-R352 WeakPolarHBondContact O-CB 3.34Å; R348-R352 VanDerWaalsContact O-CG 3.28Å; R348-R352 WeakPolarHBondContact O-CG 3.46Å; R348-R352 PolarHBondContact O-N 3.15Å
349	K	90.6	Very high	87.9	Confident	93 Å²	93	107.8 Å²	107.8	40%	0.404	50%	0.503	S	S	.	.	H	α-helix	trans	-65.7	-42.8	175.7	-71.9	176.2	-170.1	164.4	0	111.6	V345 E346 V347 R352 R353	V345-K349 WeakPolarHBondContact O-CG 3.44Å; V345-K349 PolarHBondContact O-N 2.98Å; E346-K349 PolarHBondContact O-N 2.78Å; E346-K349 IonicContact OE1-NZ 2.75Å; E346-K349 PolarHBondContact OE1-NZ 3.42Å; V347-K349 VanDerWaalsContact C-N 3.33Å; V347-K349 PolarHBondContact O-N 3.37Å; K349-R352 PolarHBondContact O-N 2.66Å; K349-R353 WeakPolarHBondContact O-CG 3.43Å; K349-R353 PolarHBondContact O-N 2.73Å
350	L	89.7	Confident	87.5	Confident	98 Å²	98	103.2 Å²	103.2	51%	0.513	49%	0.49	S	S	.	.	H	α-helix	trans	-62.8	-49.6	178.2	-173.5	66.5	0	0	0	110.9	E346 V347 R352 R353 E354	E346-L350 WeakPolarHBondContact O-CB 3.41Å; E346-L350 PolarHBondContact O-N 3Å; V347-L350 PolarHBondContact O-N 3.04Å; L350-R352 VanDerWaalsContact C-N 3.3Å; L350-R352 PolarHBondContact O-N 2.87Å; L350-R353 PolarHBondContact O-N 2.83Å; L350-R353 VanDerWaalsContact O-N 3.1Å; L350-E354 PolarHBondContact O-N 3.3Å
351	V	90.7	Very high	87	Confident	61 Å²	61	102.4 Å²	102.4	37%	0.37	49%	0.491	S	S	.	.	H	α-helix	trans	-58.5	-40.8	176.1	171.8	0	0	0	0	111.4	V347 E354 L355	V347-V351 HydrophobicContact CG1-CG2 4.26Å; V347-V351 WeakPolarHBondContact O-CB 3.36Å; V347-V351 VanDerWaalsContact O-CG2 3.27Å; V347-V351 WeakPolarHBondContact O-CG2 3.46Å; V347-V351 PolarHBondContact O-N 2.9Å; V351-E354 PolarHBondContact O-N 3.12Å; V351-L355 HydrophobicContact CG1-CD1 3.76Å; V351-L355 HydrophobicContact CG1-CG 4.27Å; V351-L355 WeakPolarHBondContact O-CB 3.38Å; V351-L355 VanDerWaalsContact O-CG 3.27Å; V351-L355 WeakPolarHBondContact O-CG 3.41Å; V351-L355 PolarHBondContact O-N 2.96Å
352	R	89.1	Confident	86.6	Confident	178 Å²	178	103.1 Å²	103.1	67%	0.672	50%	0.495	S	S	*	.	H	α-helix	trans	-63.9	-40.5	174.9	-77.6	177.3	-174.9	176	0.5	113	R348 K349 L350 A356	R348-R352 WeakPolarHBondContact O-CB 3.34Å; R348-R352 VanDerWaalsContact O-CG 3.28Å; R348-R352 WeakPolarHBondContact O-CG 3.46Å; R348-R352 PolarHBondContact O-N 3.15Å; K349-R352 PolarHBondContact O-N 2.66Å; L350-R352 VanDerWaalsContact C-N 3.3Å; L350-R352 PolarHBondContact O-N 2.87Å; R352-A356 VanDerWaalsContact O-CB 3.31Å; R352-A356 WeakPolarHBondContact O-CB 3.44Å; R352-A356 PolarHBondContact O-N 2.84Å
353	R	87.7	Confident	85.9	Confident	169 Å²	169	102.8 Å²	102.8	64%	0.638	49%	0.494	S	S	*	.	H	α-helix	trans	-65.3	-44.4	177	-73.3	177.7	-170.9	165.8	1.7	111.3	K349 L350 A356 R357	K349-R353 WeakPolarHBondContact O-CG 3.43Å; K349-R353 PolarHBondContact O-N 2.73Å; L350-R353 PolarHBondContact O-N 2.83Å; L350-R353 VanDerWaalsContact O-N 3.1Å; R353-A356 PolarHBondContact O-N 2.9Å; R353-R357 WeakPolarHBondContact O-CB 3.13Å; R353-R357 PolarHBondContact O-N 3.45Å
354	E	85.4	Confident	85.3	Confident	83 Å²	83	100.1 Å²	100.1	39%	0.388	49%	0.491	S	S	.	.	H	α-helix	trans	-62.7	-50.2	175.3	-69.6	-55.2	141.6	0	0	110.8	L350 V351 A356 R357 W358	L350-E354 PolarHBondContact O-N 3.3Å; V351-E354 PolarHBondContact O-N 3.12Å; E354-A356 VanDerWaalsContact C-N 3.3Å; E354-A356 PolarHBondContact O-N 3.32Å; E354-R357 WeakPolarHBondContact O-CB 3.43Å; E354-R357 PolarHBondContact O-N 2.8Å; E354-W358 PolarHBondContact O-N 3.24Å
355	L	88.2	Confident	84.4	Confident	108 Å²	108	100.6 Å²	100.6	57%	0.565	49%	0.493	S	S	*	.	H	α-helix	trans	-58.7	-38.7	177.2	-73.8	171.4	0	0	0	113	V351 W358 C359	V351-L355 HydrophobicContact CG1-CD1 3.76Å; V351-L355 HydrophobicContact CG1-CG 4.27Å; V351-L355 WeakPolarHBondContact O-CB 3.38Å; V351-L355 VanDerWaalsContact O-CG 3.27Å; V351-L355 WeakPolarHBondContact O-CG 3.41Å; V351-L355 PolarHBondContact O-N 2.96Å; L355-W358 PolarHBondContact O-N 2.7Å; L355-C359 VanDerWaalsContact O-CB 3.23Å; L355-C359 WeakPolarHBondContact O-CB 3.45Å; L355-C359 PolarHBondContact O-N 3.12Å
356	A	85	Confident	83.3	Confident	60 Å²	60	104 Å²	104	50%	0.496	50%	0.5	S	S	.	.	H	α-helix	trans	-67.3	-38.2	175.3	0	0	0	0	0	112.5	R352 R353 E354 C359 S360	R352-A356 VanDerWaalsContact O-CB 3.31Å; R352-A356 WeakPolarHBondContact O-CB 3.44Å; R352-A356 PolarHBondContact O-N 2.84Å; R353-A356 PolarHBondContact O-N 2.9Å; E354-A356 VanDerWaalsContact C-N 3.3Å; E354-A356 PolarHBondContact O-N 3.32Å; A356-C359 PolarHBondContact O-N 3.43Å; A356-S360 WeakPolarHBondContact O-CB 3.47Å; A356-S360 PolarHBondContact O-N 2.8Å; A356-S360 PolarHBondContact O-OG 2.86Å
357	R	85.2	Confident	82.1	Confident	157 Å²	157	103.9 Å²	103.9	59%	0.592	51%	0.513	S	S	*	.	H	α-helix	trans	-64.3	-43.3	174.1	-169.7	178.7	-176.7	176.5	-0.4	111.4	R353 E354 S360 A361	R353-R357 WeakPolarHBondContact O-CB 3.13Å; R353-R357 PolarHBondContact O-N 3.45Å; E354-R357 WeakPolarHBondContact O-CB 3.43Å; E354-R357 PolarHBondContact O-N 2.8Å; R357-S360 PolarHBondContact O-OG 2.81Å; R357-A361 WeakPolarHBondContact O-CB 3.18Å; R357-A361 PolarHBondContact O-N 2.93Å; R357-A361 VanDerWaalsContact O-N 3.09Å
358	W	82.8	Confident	80.7	Confident	192 Å²	192	110.1 Å²	110.1	73%	0.727	54%	0.539	S	S	*	.	H	α-helix	trans	-66.9	-40.1	174.7	-80.9	83	0	0	0	112.4	E354 L355 A361 C362	E354-W358 PolarHBondContact O-N 3.24Å; L355-W358 PolarHBondContact O-N 2.7Å; W358-A361 PolarHBondContact O-N 3.07Å; W358-C362 WeakPolarHBondContact O-CB 3.09Å; W358-C362 PolarHBondContact O-N 2.82Å
359	C	84.9	Confident	79	Confident	80 Å²	80	110.6 Å²	110.6	54%	0.541	54%	0.541	S	S	.	.	H	α-helix	trans	-64.4	-45.5	178.1	-168.7	0	0	0	0	112	L355 A356 C362 Q363	L355-C359 VanDerWaalsContact O-CB 3.23Å; L355-C359 WeakPolarHBondContact O-CB 3.45Å; L355-C359 PolarHBondContact O-N 3.12Å; A356-C359 PolarHBondContact O-N 3.43Å; C359-C362 PolarHBondContact O-N 2.94Å; C359-Q363 WeakPolarHBondContact O-CB 3.36Å; C359-Q363 PolarHBondContact O-N 2.83Å
360	S	78.5	Confident	77	Confident	58 Å²	58	107.3 Å²	107.3	41%	0.406	53%	0.533	S	S	.	.	H	α-helix	trans	-64.3	-40.1	175.9	51.8	0	0	0	0	112.7	A356 R357 Q363 L364	A356-S360 WeakPolarHBondContact O-CB 3.47Å; A356-S360 PolarHBondContact O-N 2.8Å; A356-S360 PolarHBondContact O-OG 2.86Å; R357-S360 PolarHBondContact O-OG 2.81Å; S360-Q363 PolarHBondContact O-N 2.95Å; S360-L364 WeakPolarHBondContact O-CB 3.48Å; S360-L364 PolarHBondContact O-N 3.05Å
361	A	77.9	Confident	75.1	Confident	54 Å²	54	108 Å²	108	45%	0.446	54%	0.544	S	S	.	.	H	α-helix	trans	-61.6	-42.7	172.8	0	0	0	0	0	112.1	R357 W358 L364 Q365	R357-A361 WeakPolarHBondContact O-CB 3.18Å; R357-A361 PolarHBondContact O-N 2.93Å; R357-A361 VanDerWaalsContact O-N 3.09Å; W358-A361 PolarHBondContact O-N 3.07Å; A361-L364 PolarHBondContact O-N 3.45Å; A361-Q365 WeakPolarHBondContact O-CB 3.37Å; A361-Q365 PolarHBondContact O-N 2.9Å
362	C	78.7	Confident	73.1	Confident	81 Å²	81	109 Å²	109	55%	0.547	55%	0.553	S	S	.	*	H	α-helix	trans	-66.3	-39.6	177.5	-157.2	0	0	0	0	111.9	W358 C359 Q365 Y366	W358-C362 WeakPolarHBondContact O-CB 3.09Å; W358-C362 PolarHBondContact O-N 2.82Å; C359-C362 PolarHBondContact O-N 2.94Å; C362-Q365 PolarHBondContact O-N 2.97Å; C362-Y366 PolarHBondContact O-N 2.91Å
363	Q	74.6	Confident	71.2	Confident	114 Å²	114	101.8 Å²	101.8	53%	0.533	53%	0.532	S	S	.	.	H	α-helix	trans	-66.7	-40.4	177.3	-168.8	176.2	-3.3	0	0	112.2	C359 S360 Q365 Y366 A367	C359-Q363 WeakPolarHBondContact O-CB 3.36Å; C359-Q363 PolarHBondContact O-N 2.83Å; S360-Q363 PolarHBondContact O-N 2.95Å; Q363-Q365 VanDerWaalsContact C-N 3.33Å; Q363-Y366 PolarHBondContact O-N 3.33Å; Q363-A367 WeakPolarHBondContact O-CB 3.25Å; Q363-A367 PolarHBondContact O-N 2.64Å
364	L	74.4	Confident	69.4	Low	112 Å²	112	97.8 Å²	97.8	59%	0.586	52%	0.523	S	S	*	.	H	α-helix	trans	-60.6	-42.7	171.4	-91.2	153.5	0	0	0	111.6	S360 A361 A367 Q368	S360-L364 WeakPolarHBondContact O-CB 3.48Å; S360-L364 PolarHBondContact O-N 3.05Å; A361-L364 PolarHBondContact O-N 3.45Å; L364-A367 PolarHBondContact O-N 3.07Å; L364-Q368 WeakPolarHBondContact O-CB 3.28Å; L364-Q368 WeakPolarHBondContact O-CG 3.32Å; L364-Q368 PolarHBondContact O-N 3.06Å
365	Q	70.7	Confident	67.7	Low	98 Å²	98	97 Å²	97	46%	0.458	53%	0.527	S	S	.	.	H	α-helix	trans	-67.1	-35.5	178.2	-159.3	176	14.2	0	0	112.4	A361 C362 Q363 R369	A361-Q365 WeakPolarHBondContact O-CB 3.37Å; A361-Q365 PolarHBondContact O-N 2.9Å; C362-Q365 PolarHBondContact O-N 2.97Å; Q363-Q365 VanDerWaalsContact C-N 3.33Å; Q365-R369 WeakPolarHBondContact O-CB 3.33Å; Q365-R369 PolarHBondContact O-N 2.79Å
366	Y	66.9	Low	65.8	Low	133 Å²	133	94.7 Å²	94.7	52%	0.522	52%	0.523	S	S	.	.	H	α-helix	trans	-68.6	-44.1	173.3	-172.7	-95.6	0	0	0	111.9	C362 Q363 Q368 R369 G370	C362-Y366 PolarHBondContact O-N 2.91Å; Q363-Y366 PolarHBondContact O-N 3.33Å; Y366-Q368 PolarHBondContact O-N 3.09Å; Y366-R369 PolarHBondContact O-N 2.94Å; Y366-G370 PolarHBondContact O-N 3.15Å
367	A	62.9	Low	64	Low	73 Å²	73	100.5 Å²	100.5	60%	0.603	53%	0.534	S	S	*	.	H	α-helix	trans	-63.4	-40.6	178.2	0	0	0	0	0	112.5	Q363 L364 R369 G370	Q363-A367 WeakPolarHBondContact O-CB 3.25Å; Q363-A367 PolarHBondContact O-N 2.64Å; L364-A367 PolarHBondContact O-N 3.07Å; A367-R369 VanDerWaalsContact C-N 3.3Å; A367-R369 PolarHBondContact O-N 3.11Å; A367-G370 PolarHBondContact O-N 3.32Å
368	Q	61.3	Low	62.3	Low	164 Å²	164	97.1 Å²	97.1	77%	0.766	53%	0.534	S	S	*	.	H	α-helix	trans	-67.8	-28.9	175.2	-75.6	-178.3	-14	0	0	113.1	L364 Y366 G370	L364-Q368 WeakPolarHBondContact O-CB 3.28Å; L364-Q368 WeakPolarHBondContact O-CG 3.32Å; L364-Q368 PolarHBondContact O-N 3.06Å; Y366-Q368 PolarHBondContact O-N 3.09Å; Q368-G370 VanDerWaalsContact C-N 3.34Å
369	R	54.4	Low	60.7	Low	157 Å²	157	92 Å²	92	59%	0.592	53%	0.532	S	S	*	.	H	α-helix	trans	-82.6	-9.4	177.7	-80.3	-175.6	171.6	144.5	-1.3	114.3	Q365 Y366 A367 A373	Q365-R369 WeakPolarHBondContact O-CB 3.33Å; Q365-R369 PolarHBondContact O-N 2.79Å; Y366-R369 PolarHBondContact O-N 2.94Å; A367-R369 VanDerWaalsContact C-N 3.3Å; A367-R369 PolarHBondContact O-N 3.11Å; R369-A373 HydrophobicContact CB-CB 4.37Å
370	G	47.4	Very low	59.1	Low	23 Å²	23	93 Å²	93	24%	0.237	54%	0.541	C	S	.	.	T	Hydrogen-bonded Turn	trans	55	-179.4	173.1	0	0	0	0	0	114.6	Y366 A367 Q368 S372 A373	Y366-G370 PolarHBondContact O-N 3.15Å; A367-G370 PolarHBondContact O-N 3.32Å; Q368-G370 VanDerWaalsContact C-N 3.34Å; G370-S372 PolarHBondContact O-N 3.45Å; G370-A373 PolarHBondContact O-N 2.94Å
371	P	51.5	Low	57.4	Low	114 Å²	114	92.7 Å²	92.7	74%	0.74	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-3.5	-178.5	-19.3	31.7	0	0	0	114.8	A373 S375	P371-A373 VanDerWaalsContact C-N 3.31Å; P371-A373 PolarHBondContact O-N 3.06Å; P371-S375 PolarHBondContact O-N 2.89Å; P371-S375 PolarHBondContact O-OG 3.24Å
372	S	48.3	Very low	55.8	Low	81 Å²	81	100.3 Å²	100.3	57%	0.566	56%	0.561	S	S	*	*	H	α-helix	trans	-68.3	-25.6	177.3	-21.9	0	0	0	0	113.4	G370 S375 A376	G370-S372 PolarHBondContact O-N 3.45Å; S372-S375 WeakPolarHBondContact CA-OG 3.02Å; S372-S375 PolarHBondContact O-OG 3.21Å; S372-S375 VanDerWaalsContact O-OG 3.05Å; S372-A376 WeakPolarHBondContact O-CB 3.45Å; S372-A376 PolarHBondContact O-N 3.18Å
373	A	49.6	Very low	54.1	Low	27 Å²	27	101 Å²	101	22%	0.223	57%	0.567	C	S	.	*	H	α-helix	trans	-81.5	-32.7	179.2	0	0	0	0	0	112.5	R369 G370 P371 A376 Y377	R369-A373 HydrophobicContact CB-CB 4.37Å; G370-A373 PolarHBondContact O-N 2.94Å; P371-A373 VanDerWaalsContact C-N 3.31Å; P371-A373 PolarHBondContact O-N 3.06Å; A373-A376 PolarHBondContact O-N 2.85Å; A373-Y377 WeakPolarHBondContact O-CB 3.29Å; A373-Y377 PolarHBondContact O-N 2.82Å
374	L	49	Very low	52.7	Low	84 Å²	84	100.4 Å²	100.4	44%	0.44	57%	0.567	S	S	.	*	H	α-helix	trans	-73.5	-33.8	176.8	-155.6	74.1	0	0	0	110.9	S378 I391	L374-S378 VanDerWaalsContact O-CB 3.25Å; L374-S378 WeakPolarHBondContact O-CB 3.35Å; L374-S378 PolarHBondContact O-N 2.96Å; L374-S378 VanDerWaalsContact O-N 3.07Å; L374-S378 PolarHBondContact O-OG 3.03Å; L374-I391 HydrophobicContact CD1-CG2 4.23Å
375	S	49.4	Very low	51.6	Low	68 Å²	68	103.9 Å²	103.9	48%	0.476	58%	0.581	S	S	.	*	H	α-helix	trans	-73.3	-34.8	170	57.6	0	0	0	0	112.8	P371 S372 S378 A379	P371-S375 PolarHBondContact O-N 2.89Å; P371-S375 PolarHBondContact O-OG 3.24Å; S372-S375 WeakPolarHBondContact CA-OG 3.02Å; S372-S375 PolarHBondContact O-OG 3.21Å; S372-S375 VanDerWaalsContact O-OG 3.05Å; S375-S378 WeakPolarHBondContact CA-OG 3.47Å; S375-S378 PolarHBondContact O-OG 2.74Å; S375-A379 WeakPolarHBondContact O-CB 3.43Å; S375-A379 PolarHBondContact O-N 2.91Å
376	A	49.2	Very low	50.6	Low	59 Å²	59	107.2 Å²	107.2	49%	0.488	59%	0.594	S	S	.	*	H	α-helix	trans	-70.2	-36.6	174.7	0	0	0	0	0	113.6	S372 A373 S380	S372-A376 WeakPolarHBondContact O-CB 3.45Å; S372-A376 PolarHBondContact O-N 3.18Å; A373-A376 PolarHBondContact O-N 2.85Å; A376-S380 PolarHBondContact O-N 2.85Å
377	Y	46.9	Very low	49.9	Very low	182 Å²	182	103.8 Å²	103.8	71%	0.714	59%	0.586	S	S	*	*	H	α-helix	trans	-78.2	-35.6	176.5	-98	-89.8	0	0	0	113.2	A373 A379 S380 S381	A373-Y377 WeakPolarHBondContact O-CB 3.29Å; A373-Y377 PolarHBondContact O-N 2.82Å; Y377-A379 VanDerWaalsContact C-N 3.34Å; Y377-S380 PolarHBondContact O-N 2.84Å; Y377-S381 PolarHBondContact O-N 2.83Å
378	S	49.6	Very low	49.4	Very low	86 Å²	86	103.6 Å²	103.6	60%	0.601	58%	0.58	S	S	*	*	H	α-helix	trans	-72	-27.4	174.4	55.8	0	0	0	0	112.9	L374 S375 S380	L374-S378 VanDerWaalsContact O-CB 3.25Å; L374-S378 WeakPolarHBondContact O-CB 3.35Å; L374-S378 PolarHBondContact O-N 2.96Å; L374-S378 VanDerWaalsContact O-N 3.07Å; L374-S378 PolarHBondContact O-OG 3.03Å; S375-S378 WeakPolarHBondContact CA-OG 3.47Å; S375-S378 PolarHBondContact O-OG 2.74Å; S378-S380 VanDerWaalsContact C-N 3.29Å; S378-S380 PolarHBondContact O-N 2.85Å
379	A	49.6	Very low	49	Very low	84 Å²	84	102.7 Å²	102.7	69%	0.694	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	-18.7	170.7	0	0	0	0	0	113.6	S375 Y377	S375-A379 WeakPolarHBondContact O-CB 3.43Å; S375-A379 PolarHBondContact O-N 2.91Å; Y377-A379 VanDerWaalsContact C-N 3.34Å
380	S	50.8	Low	48.7	Very low	102 Å²	102	103 Å²	103	71%	0.713	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	-7.6	-174.9	-174.8	0	0	0	0	114.8	A376 Y377 S378	A376-S380 PolarHBondContact O-N 2.85Å; Y377-S380 PolarHBondContact O-N 2.84Å; S378-S380 VanDerWaalsContact C-N 3.29Å; S378-S380 PolarHBondContact O-N 2.85Å
381	S	42.3	Very low	49.2	Very low	51 Å²	51	105.2 Å²	105.2	36%	0.357	58%	0.584	S	S	.	*			trans	-128.1	71	-173.5	173	0	0	0	0	112	Y377 S383	Y377-S381 PolarHBondContact O-N 2.83Å; S381-S383 PolarHBondContact O-N 3Å
382	K	43.6	Very low	49.3	Very low	214 Å²	214	104.6 Å²	104.6	93%	0.93	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	18.1	175.7	-107.2	-176.4	-179.1	-179.7	0	114.8
383	S	44.4	Very low	49.8	Very low	95 Å²	95	103.8 Å²	103.8	66%	0.664	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.6	16.3	-166.5	70.5	0	0	0	0	118.5	S381	S381-S383 PolarHBondContact O-N 3Å
384	N	45.2	Very low	50.1	Low	101 Å²	101	106.1 Å²	106.1	54%	0.54	58%	0.581	S	S	.	*			trans	-148.7	102.1	175.4	-88.4	-43.2	0	0	0	113.5	K386 V387	N384-K386 PolarHBondContact O-N 2.79Å; N384-V387 HydrophobicContact CB-CB 4.41Å; N384-V387 HydrophobicContact CB-CG2 3.75Å; N384-V387 PolarHBondContact O-N 3.16Å
385	E	51.8	Low	50.4	Low	186 Å²	186	104.8 Å²	104.8	87%	0.869	58%	0.582	S	S	*	*	H	α-helix	trans	-52.5	-32.8	172.1	-119.8	173.1	167.4	0	0	112.7	V387 S388 E389	E385-V387 VanDerWaalsContact C-N 3.27Å; E385-V387 PolarHBondContact O-N 3.04Å; E385-S388 PolarHBondContact O-N 2.99Å; E385-E389 PolarHBondContact O-N 2.95Å
386	K	48.9	Very low	50.6	Low	168 Å²	168	104.4 Å²	104.4	73%	0.73	58%	0.583	S	S	*	*	H	α-helix	trans	-65.8	-23.3	177.6	-70.3	-175.3	177.3	179.3	0	114.6	N384 Y390	N384-K386 PolarHBondContact O-N 2.79Å; K386-Y390 PolarHBondContact O-N 2.04Å
387	V	52.8	Low	50.9	Low	60 Å²	60	104 Å²	104	36%	0.364	58%	0.579	S	S	.	*	H	α-helix	trans	-79.7	-35.4	-178.9	176.6	0	0	0	0	110.8	N384 E385 E389 Y390 I391	N384-V387 HydrophobicContact CB-CB 4.41Å; N384-V387 HydrophobicContact CB-CG2 3.75Å; N384-V387 PolarHBondContact O-N 3.16Å; E385-V387 VanDerWaalsContact C-N 3.27Å; E385-V387 PolarHBondContact O-N 3.04Å; V387-E389 VanDerWaalsContact C-N 3.34Å; V387-Y390 PolarHBondContact O-N 3.4Å; V387-I391 HydrophobicContact CG1-CD1 3.84Å; V387-I391 HydrophobicContact CG1-CG1 4.44Å; V387-I391 VanDerWaalsContact O-CG1 3.29Å; V387-I391 WeakPolarHBondContact O-CG1 3.41Å; V387-I391 PolarHBondContact O-N 3.03Å
388	S	50.7	Low	51.1	Low	69 Å²	69	98 Å²	98	48%	0.483	57%	0.567	S	S	.	*	H	α-helix	trans	-60.4	-44.7	173	173.6	0	0	0	0	111.4	E385 Y390 I391 N392	E385-S388 PolarHBondContact O-N 2.99Å; S388-Y390 PolarHBondContact O-N 3.14Å; S388-I391 PolarHBondContact O-N 3.17Å; S388-N392 WeakPolarHBondContact O-CB 3.35Å; S388-N392 VanDerWaalsContact O-CG 3.26Å; S388-N392 PolarHBondContact O-N 3.14Å; S388-N392 PolarHBondContact O-ND2 3.47Å
389	E	53.4	Low	51.2	Low	146 Å²	146	100.3 Å²	100.3	68%	0.682	57%	0.566	S	S	*	*	H	α-helix	trans	-65.1	-39.4	179.2	-150.5	174.9	-163.7	0	0	112	E385 V387 S393	E385-E389 PolarHBondContact O-N 2.95Å; V387-E389 VanDerWaalsContact C-N 3.34Å; E389-S393 WeakPolarHBondContact O-CB 3.26Å; E389-S393 PolarHBondContact O-N 2.94Å
390	Y	49.3	Very low	51.3	Low	163 Å²	163	99.2 Å²	99.2	64%	0.639	56%	0.557	S	S	*	*	H	α-helix	trans	-65.8	-44.5	175.2	-170.2	-100.7	0	0	0	112.2	K386 V387 S388 S393 V394	K386-Y390 PolarHBondContact O-N 2.04Å; V387-Y390 PolarHBondContact O-N 3.4Å; S388-Y390 PolarHBondContact O-N 3.14Å; Y390-S393 PolarHBondContact O-N 3.49Å; Y390-S393 PolarHBondContact O-OG 2.83Å; Y390-V394 HydrophobicContact CD1-CG2 4.24Å; Y390-V394 HydrophobicContact CE1-CG2 3.96Å; Y390-V394 WeakPolarHBondContact O-CG2 3.44Å; Y390-V394 PolarHBondContact O-N 3.17Å
391	I	56.5	Low	51.4	Low	69 Å²	69	101.2 Å²	101.2	35%	0.354	56%	0.559	S	S	.	*	H	α-helix	trans	-65	-42.4	178.8	-68.1	167.2	0	0	0	111	L374 V387 S388 S393 V394 A395	L374-I391 HydrophobicContact CD1-CG2 4.23Å; V387-I391 HydrophobicContact CG1-CD1 3.84Å; V387-I391 HydrophobicContact CG1-CG1 4.44Å; V387-I391 VanDerWaalsContact O-CG1 3.29Å; V387-I391 WeakPolarHBondContact O-CG1 3.41Å; V387-I391 PolarHBondContact O-N 3.03Å; S388-I391 PolarHBondContact O-N 3.17Å; I391-S393 VanDerWaalsContact C-N 3.3Å; I391-S393 PolarHBondContact O-N 2.96Å; I391-V394 PolarHBondContact O-N 3.11Å; I391-A395 WeakPolarHBondContact O-CB 3.26Å; I391-A395 PolarHBondContact O-N 3.09Å
392	N	55.3	Low	51.8	Low	102 Å²	102	105.2 Å²	105.2	55%	0.545	57%	0.572	S	S	.	*	H	α-helix	trans	-63.4	-36.2	175.3	-71.2	-22.3	0	0	0	111.8	S388 A396	S388-N392 WeakPolarHBondContact O-CB 3.35Å; S388-N392 VanDerWaalsContact O-CG 3.26Å; S388-N392 PolarHBondContact O-N 3.14Å; S388-N392 PolarHBondContact O-ND2 3.47Å; N392-A396 WeakPolarHBondContact O-CB 3.11Å; N392-A396 PolarHBondContact O-N 3.29Å
393	S	57.3	Low	51.8	Low	63 Å²	63	99.9 Å²	99.9	44%	0.441	55%	0.553	S	S	.	*	H	α-helix	trans	-67.5	-37.5	175.7	79.4	0	0	0	0	112.9	E389 Y390 I391 A397	E389-S393 WeakPolarHBondContact O-CB 3.26Å; E389-S393 PolarHBondContact O-N 2.94Å; Y390-S393 PolarHBondContact O-N 3.49Å; Y390-S393 PolarHBondContact O-OG 2.83Å; I391-S393 VanDerWaalsContact C-N 3.3Å; I391-S393 PolarHBondContact O-N 2.96Å; S393-A397 VanDerWaalsContact O-CB 3.28Å; S393-A397 WeakPolarHBondContact O-CB 3.45Å; S393-A397 PolarHBondContact O-N 3.21Å
394	V	56.6	Low	51.5	Low	77 Å²	77	100 Å²	100	47%	0.467	55%	0.554	S	S	.	*	H	α-helix	trans	-74	-39.6	178.3	175.3	0	0	0	0	110.8	Y390 I391 A397 A398	Y390-V394 HydrophobicContact CD1-CG2 4.24Å; Y390-V394 HydrophobicContact CE1-CG2 3.96Å; Y390-V394 WeakPolarHBondContact O-CG2 3.44Å; Y390-V394 PolarHBondContact O-N 3.17Å; I391-V394 PolarHBondContact O-N 3.11Å; V394-A397 PolarHBondContact O-N 2.77Å; V394-A398 WeakPolarHBondContact O-CB 3.41Å; V394-A398 PolarHBondContact O-N 2.98Å
395	A	56.1	Low	51.3	Low	56 Å²	56	100.9 Å²	100.9	46%	0.463	57%	0.565	S	S	.	*	H	α-helix	trans	-66.4	-40.8	173.6	0	0	0	0	0	112	I391 A398 F399	I391-A395 WeakPolarHBondContact O-CB 3.26Å; I391-A395 PolarHBondContact O-N 3.09Å; A395-A398 PolarHBondContact O-N 2.99Å; A395-F399 WeakPolarHBondContact O-CB 3.41Å; A395-F399 PolarHBondContact O-N 2.87Å
396	A	53.3	Low	50.4	Low	60 Å²	60	99.1 Å²	99.1	50%	0.496	57%	0.567	S	S	.	*	H	α-helix	trans	-65	-40.1	174.2	0	0	0	0	0	111.9	N392 F399 A400	N392-A396 WeakPolarHBondContact O-CB 3.11Å; N392-A396 PolarHBondContact O-N 3.29Å; A396-F399 PolarHBondContact O-N 3.09Å; A396-A400 VanDerWaalsContact O-CB 3.31Å; A396-A400 WeakPolarHBondContact O-CB 3.42Å; A396-A400 PolarHBondContact O-N 3.05Å
397	A	54.8	Low	49.8	Very low	50 Å²	50	99.2 Å²	99.2	41%	0.413	57%	0.574	S	S	.	*	H	α-helix	trans	-64.7	-40.9	174.3	0	0	0	0	0	111.9	S393 V394 I401	S393-A397 VanDerWaalsContact O-CB 3.28Å; S393-A397 WeakPolarHBondContact O-CB 3.45Å; S393-A397 PolarHBondContact O-N 3.21Å; V394-A397 PolarHBondContact O-N 2.77Å; A397-I401 VanDerWaalsContact O-CD1 3.31Å; A397-I401 WeakPolarHBondContact O-CD1 3.09Å; A397-I401 WeakPolarHBondContact O-CG1 3.42Å; A397-I401 PolarHBondContact O-N 3.41Å; A397-I401 VanDerWaalsContact O-N 3.16Å
398	A	51.1	Low	48.8	Very low	55 Å²	55	105 Å²	105	46%	0.455	60%	0.598	S	S	.	*	H	α-helix	trans	-65	-40.4	175.6	0	0	0	0	0	112.3	V394 A395 I401 Q402	V394-A398 WeakPolarHBondContact O-CB 3.41Å; V394-A398 PolarHBondContact O-N 2.98Å; A395-A398 PolarHBondContact O-N 2.99Å; A398-I401 PolarHBondContact O-N 3.5Å; A398-Q402 PolarHBondContact O-N 2.8Å
399	F	51.2	Low	47.9	Very low	136 Å²	136	113.1 Å²	113.1	60%	0.596	62%	0.618	S	S	*	*	H	α-helix	trans	-70.2	-37.5	177.8	-163.1	-95	0	0	0	112.6	A395 A396 I401 Q402 N403	A395-F399 WeakPolarHBondContact O-CB 3.41Å; A395-F399 PolarHBondContact O-N 2.87Å; A396-F399 PolarHBondContact O-N 3.09Å; F399-I401 VanDerWaalsContact C-N 3.31Å; F399-I401 PolarHBondContact O-N 2.77Å; F399-Q402 PolarHBondContact O-N 2.84Å; F399-N403 WeakPolarHBondContact CE1-ND2 3.14Å; F399-N403 WeakPolarHBondContact CZ-ND2 3.39Å; F399-N403 PolarHBondContact O-N 2.98Å
400	A	51.5	Low	46.9	Very low	61 Å²	61	111.8 Å²	111.8	50%	0.504	62%	0.622	S	S	.	*	H	α-helix	trans	-65.9	-32.8	175.6	0	0	0	0	0	112.6	A396 Q402	A396-A400 VanDerWaalsContact O-CB 3.31Å; A396-A400 WeakPolarHBondContact O-CB 3.42Å; A396-A400 PolarHBondContact O-N 3.05Å; A400-Q402 VanDerWaalsContact C-N 3.3Å
401	I	53.1	Low	45.9	Very low	144 Å²	144	109.6 Å²	109.6	74%	0.738	63%	0.63	S	S	*	*	H	α-helix	trans	-71	-27.3	175.5	-69	164.3	0	0	0	111.7	A397 A398 F399	A397-I401 VanDerWaalsContact O-CD1 3.31Å; A397-I401 WeakPolarHBondContact O-CD1 3.09Å; A397-I401 WeakPolarHBondContact O-CG1 3.42Å; A397-I401 PolarHBondContact O-N 3.41Å; A397-I401 VanDerWaalsContact O-N 3.16Å; A398-I401 PolarHBondContact O-N 3.5Å; F399-I401 VanDerWaalsContact C-N 3.31Å; F399-I401 PolarHBondContact O-N 2.77Å
402	Q	50.3	Low	44.9	Very low	135 Å²	135	112.1 Å²	112.1	63%	0.631	65%	0.651	S	S	*	*	H	α-helix	trans	-87.5	-18.8	-172.3	-138.2	168.7	-2.8	0	0	114.3	A398 F399 A400	A398-Q402 PolarHBondContact O-N 2.8Å; F399-Q402 PolarHBondContact O-N 2.84Å; A400-Q402 VanDerWaalsContact C-N 3.3Å
403	N	44.8	Very low	43.6	Very low	102 Å²	102	116.2 Å²	116.2	55%	0.545	67%	0.667	S	S	.	*	S	Bend	trans	-123	10.3	-169.3	-76.1	-33	0	0	0	115.8	F399 P405	F399-N403 WeakPolarHBondContact CE1-ND2 3.14Å; F399-N403 WeakPolarHBondContact CZ-ND2 3.39Å; F399-N403 PolarHBondContact O-N 2.98Å; N403-P405 WeakPolarHBondContact O-CD 3.4Å
404	S	38.2	Very low	42.4	Very low	97 Å²	97	121.6 Å²	121.6	68%	0.678	69%	0.687	S	S	*	*			trans	-93.1	111	177	-82.5	0	0	0	0	112.6
405	P	40.2	Very low	41.2	Very low	120 Å²	120	122.8 Å²	122.8	78%	0.779	70%	0.699	S	S	*	*			trans	-68.1	140.5	167.1	28.5	-31.9	0	0	0	110.3	N403 L407	N403-P405 WeakPolarHBondContact O-CD 3.4Å; P405-L407 PolarHBondContact O-N 3.42Å
406	V	34.3	Very low	40.2	Very low	149 Å²	149	125 Å²	125	90%	0.903	71%	0.706	S	S	*	*			trans	-63.3	99.2	-178.8	178.3	0	0	0	0	110.1
407	L	34.8	Very low	39.1	Very low	169 Å²	169	132.9 Å²	132.9	89%	0.885	72%	0.723	S	S	*	*			trans	-144.7	135.7	162.8	-149.9	81.5	0	0	0	110.5	P405	P405-L407 PolarHBondContact O-N 3.42Å
408	E	32.3	Very low	38.4	Very low	183 Å²	183	137.3 Å²	137.3	86%	0.855	74%	0.739	S	S	*	*			trans	-68.7	128.5	-165.1	-59	174	132.8	0	0	115.5
409	R	30.9	Very low	37.7	Very low	238 Å²	238	139.9 Å²	139.9	90%	0.898	75%	0.749	S	S	*	*				154.9	158.2	129.4	-91.5	-168	-179.2	177.4	2.9	114
410	P	32.5	Very low	37.1	Very low	118 Å²	118	143.9 Å²	143.9	77%	0.766	77%	0.767	S	S	*	*				-107.8	138.4	-125.3	38.2	-33.5	0	0	0	115.7
411	S	29.9	Very low	36.3	Very low	118 Å²	118	145.7 Å²	145.7	83%	0.825	78%	0.776	S	S	*	*			trans	177	161.8	145.5	56.1	0	0	0	0	110.2
412	P	33.7	Very low	35.3	Very low	121 Å²	121	142.2 Å²	142.2	79%	0.786	78%	0.775	S	S	*	*			cis	-106.4	156.4	-23.2	34.2	-20.2	0	0	0	111.3	M414	P412-M414 PolarHBondContact O-N 3.37Å; P412-M414 VanDerWaalsContact O-N 3.11Å
413	Q	28	Very low	34.3	Very low	188 Å²	188	144.1 Å²	144.1	88%	0.879	79%	0.788	S	S	*	*			trans	-63.7	110.7	179.4	-67	179	-10.3	0	0	111.5	S415	Q413-S415 PolarHBondContact O-N 2.81Å
414	M	32.1	Very low	33.5	Very low	177 Å²	177	147.9 Å²	147.9	87%	0.872	81%	0.805	S	S	*	*			trans	-69	96.2	160.9	-175.5	178.4	-97.3	0	0	108.3	P412 V416	P412-M414 PolarHBondContact O-N 3.37Å; P412-M414 VanDerWaalsContact O-N 3.11Å; M414-V416 PolarHBondContact O-N 3.02Å
415	S	31.8	Very low	33.1	Very low	101 Å²	101	148.3 Å²	148.3	71%	0.706	81%	0.808	S	S	*	*			trans	-82.7	111.2	174.1	71	0	0	0	0	109.7	Q413 R417	Q413-S415 PolarHBondContact O-N 2.81Å; S415-R417 PolarHBondContact O-N 2.59Å
416	V	35.6	Very low	32.6	Very low	102 Å²	102	151 Å²	151	62%	0.618	81%	0.812	S	S	*	*			trans	-86.1	99.1	164.8	-179.5	0	0	0	0	106.7	M414 L418	M414-V416 PolarHBondContact O-N 3.02Å; V416-L418 PolarHBondContact O-N 3.21Å
417	R	30	Very low	32.3	Very low	227 Å²	227	147.8 Å²	147.8	86%	0.857	80%	0.802	S	S	*	*			trans	-76.6	103.8	168.8	-114.3	-178.2	-174.5	170.1	2.6	107.9	S415 T419	S415-R417 PolarHBondContact O-N 2.59Å; R417-T419 PolarHBondContact O-N 2.85Å
418	L	39.9	Very low	32	Very low	143 Å²	143	147.1 Å²	147.1	75%	0.749	80%	0.799	S	S	*	*			trans	-70.7	104.9	162.8	-81	157.5	0	0	0	107.5	V416	V416-L418 PolarHBondContact O-N 3.21Å
419	T	36.7	Very low	32	Very low	108 Å²	108	145.1 Å²	145.1	66%	0.663	79%	0.792	S	S	*	*			trans	-70.4	142	172.1	47.6	0	0	0	0	109.6	R417 S421	R417-T419 PolarHBondContact O-N 2.85Å; T419-S421 PolarHBondContact O-N 3.22Å
420	K	38.3	Very low	31.9	Very low	221 Å²	221	143 Å²	143	96%	0.961	79%	0.79	S	S	*	*	S	Bend	trans	-76.1	33.5	-171.4	-150.6	-179.4	-177	-175.5	0	113.2
421	S	34.3	Very low	31.7	Very low	99 Å²	99	143.3 Å²	143.3	69%	0.692	80%	0.795	S	S	*	*			trans	-125.6	79	-176	59.1	0	0	0	0	110	T419	T419-S421 PolarHBondContact O-N 3.22Å
422	G	33.2	Very low	31.7	Very low	70 Å²	70	141.3 Å²	141.3	72%	0.722	79%	0.793	S	S	*	*			trans	-149.7	57.8	177.5	0	0	0	0	0	109.7	M424	G422-M424 VanDerWaalsContact C-N 3.34Å; G422-M424 PolarHBondContact O-N 3.22Å
423	L	28.4	Very low	31.4	Very low	175 Å²	175	145.2 Å²	145.2	92%	0.916	80%	0.797	S	S	*	*			trans	-61.4	92.9	169.7	-108.6	140.6	0	0	0	108.5	S425	L423-S425 VanDerWaalsContact C-N 3.33Å; L423-S425 PolarHBondContact O-N 3.26Å
424	M	29	Very low	31.4	Very low	181 Å²	181	141.1 Å²	141.1	89%	0.892	79%	0.789	S	S	*	*			trans	-81	88.3	157.6	-81.7	-82.2	-170.3	0	0	107	G422 M426	G422-M424 VanDerWaalsContact C-N 3.34Å; G422-M424 PolarHBondContact O-N 3.22Å; M424-M426 PolarHBondContact O-N 3.33Å
425	S	28.3	Very low	31.3	Very low	106 Å²	106	138.1 Å²	138.1	74%	0.741	78%	0.777	S	S	*	*			trans	-69.3	105.7	160.2	-179.5	0	0	0	0	107.2	L423 A427	L423-S425 VanDerWaalsContact C-N 3.33Å; L423-S425 PolarHBondContact O-N 3.26Å; S425-A427 PolarHBondContact O-N 2.92Å
426	M	30.5	Very low	31.2	Very low	176 Å²	176	141.4 Å²	141.4	87%	0.867	78%	0.778	S	S	*	*			trans	-71.5	123.1	167.4	-80.4	-160.9	176.7	0	0	109.3	M424	M424-M426 PolarHBondContact O-N 3.33Å
427	A	28.2	Very low	30.9	Very low	83 Å²	83	142.6 Å²	142.6	69%	0.686	79%	0.786	S	S	*	*			trans	46.3	106	140.3	0	0	0	0	0	117.1	S425	S425-A427 PolarHBondContact O-N 2.92Å
428	N	29.3	Very low	30.9	Very low	155 Å²	155	136 Å²	136	83%	0.829	77%	0.774	S	S	*	*			trans	-160.6	136.1	136.9	-111.7	-27.7	0	0	0	113.4
429	I	30.6	Very low	30.4	Very low	140 Å²	140	138.9 Å²	138.9	72%	0.718	78%	0.781	S	S	*	*			trans	92.6	94.1	147.4	-56.9	158.1	0	0	0	118
430	K	29.5	Very low	30	Very low	194 Å²	194	137 Å²	137	84%	0.843	78%	0.783	S	S	*	*				51.5	120.1	122.1	-69.9	179.3	172.6	177.9	0	120.7
431	S	28.8	Very low	29.7	Very low	125 Å²	125	133.7 Å²	133.7	87%	0.874	78%	0.781	S	S	*	*				66	116.2	120.1	-172.8	0	0	0	0	119.5
432	G	29.5	Very low	29.4	Very low	75 Å²	75	136.7 Å²	136.7	77%	0.773	78%	0.782	S	S	*	*			trans	160.4	115.9	153.2	0	0	0	0	0	114.4
433	K	26.7	Very low	29.2	Very low	204 Å²	204	141.5 Å²	141.5	89%	0.887	78%	0.779	S	S	*	*			trans	-68	159.1	-179.2	-83	168.2	165.2	172.7	0	115
434	S	28.9	Very low	29	Very low	101 Å²	101	141.2 Å²	141.2	71%	0.706	77%	0.773	S	S	*	*			trans	67.3	144.8	150	-86.8	0	0	0	0	116.9
435	D	29.1	Very low	29.1	Very low	115 Å²	115	140.4 Å²	140.4	62%	0.615	77%	0.772	S	S	*	*			cis	-166.8	148.1	7.8	-121	17.9	0	0	0	107.6
436	K	29.6	Very low	29.3	Very low	170 Å²	170	140.7 Å²	140.7	74%	0.739	77%	0.768	S	S	*	*			trans	71.3	127.3	137	-77.1	179.9	-175.7	168.1	0	123.6
437	V	29.8	Very low	29.2	Very low	127 Å²	127	137.7 Å²	137.7	77%	0.77	76%	0.76	S	S	*	*			trans	85.2	124.8	133.7	175.9	0	0	0	0	114.1
438	S	30.2	Very low	29.2	Very low	88 Å²	88	140.3 Å²	140.3	62%	0.615	76%	0.763	S	S	*	*			cis	-169.3	144	48.2	-151.7	0	0	0	0	112.7
439	K	29.8	Very low	29.2	Very low	204 Å²	204	138.7 Å²	138.7	89%	0.887	75%	0.754	S	S	*	*			trans	39.5	131	139	-60.5	175.9	179.8	-179.7	0	119.3
440	G	29	Very low	29.4	Very low	68 Å²	68	137.4 Å²	137.4	70%	0.701	76%	0.758	S	S	*	*			cis	168.1	-170.7	9.4	0	0	0	0	0	111.2
441	V	30.8	Very low	29.6	Very low	152 Å²	152	131.8 Å²	131.8	92%	0.921	75%	0.747	S	S	*	*			trans	90.5	127.5	173.4	-170.9	0	0	0	0	115.2
442	F	27.4	Very low	29.8	Very low	162 Å²	162	133.2 Å²	133.2	71%	0.711	74%	0.744	S	S	*	*			cis	-171	120.5	-24.1	-172.6	-91.1	0	0	0	106.1
443	Y	29	Very low	30.1	Very low	170 Å²	170	135.6 Å²	135.6	67%	0.667	74%	0.744	S	S	*	*			trans	48.3	125.1	144.9	-59.7	-110.6	0	0	0	121.1
444	E	25.7	Very low	30.5	Very low	169 Å²	169	129.4 Å²	129.4	79%	0.79	73%	0.731	S	S	*	*				66.1	117.2	65.3	-86.9	-170.8	157.1	0	0	115.4
445	L	30.8	Very low	30.8	Very low	165 Å²	165	129.8 Å²	129.8	86%	0.864	72%	0.724	S	S	*	*			trans	-147.4	103.7	144.8	-127.8	99.6	0	0	0	107.5
446	V	32.5	Very low	31	Very low	111 Å²	111	128.5 Å²	128.5	67%	0.673	72%	0.718	S	S	*	*				76.1	92.3	99.1	171.4	0	0	0	0	111.7
447	T	28	Very low	31.3	Very low	113 Å²	113	125 Å²	125	69%	0.693	71%	0.711	S	S	*	*				94.5	145.4	81.6	64.2	0	0	0	0	113.6
448	N	28.1	Very low	31.6	Very low	138 Å²	138	123.7 Å²	123.7	74%	0.738	70%	0.703	S	S	*	*			trans	92.9	134.5	177.4	-57.1	11.2	0	0	0	112.7
449	D	28.9	Very low	31.9	Very low	121 Å²	121	125.1 Å²	125.1	65%	0.647	70%	0.7	S	S	*	*			cis	-165.3	136.9	3.4	-113.3	-33.3	0	0	0	105.8	A451	D449-A451 VanDerWaalsContact C-N 3.26Å; D449-A451 PolarHBondContact O-N 3.12Å
450	S	34.6	Very low	32.2	Very low	114 Å²	114	121.2 Å²	121.2	80%	0.797	68%	0.683	S	S	*	*	S	Bend	trans	46.6	1.5	151.6	42.3	0	0	0	0	123.3
451	A	35	Very low	32.5	Very low	75 Å²	75	124.2 Å²	124.2	62%	0.62	68%	0.683	S	S	*	*			trans	-108	-10	-175.7	0	0	0	0	0	114.4	D449	D449-A451 VanDerWaalsContact C-N 3.26Å; D449-A451 PolarHBondContact O-N 3.12Å
452	L	33.1	Very low	32.9	Very low	156 Å²	156	119.9 Å²	119.9	82%	0.817	66%	0.663	S	S	*	*	S	Bend	trans	-86.6	-17	-172	-136.6	84.8	0	0	0	114.1
453	T	35.1	Very low	33.4	Very low	124 Å²	124	118.9 Å²	118.9	76%	0.761	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-10.9	-175.5	10	0	0	0	0	114.4
454	A	34.6	Very low	33.8	Very low	75 Å²	75	117 Å²	117	62%	0.62	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-14.4	173.9	0	0	0	0	0	113.6	T458	A454-T458 PolarHBondContact O-OG1 2.91Å
455	L	35.7	Very low	34.7	Very low	108 Å²	108	114.1 Å²	114.1	57%	0.565	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-23.2	179.8	-138.1	81.7	0	0	0	113	T457 T458 Q459	L455-T457 VanDerWaalsContact C-N 3.35Å; L455-T457 PolarHBondContact O-N 2.73Å; L455-T458 PolarHBondContact O-OG1 2.97Å; L455-Q459 WeakPolarHBondContact O-CB 3.17Å; L455-Q459 PolarHBondContact O-N 2.83Å
456	D	34.1	Very low	35.3	Very low	89 Å²	89	111.6 Å²	111.6	48%	0.476	66%	0.655	S	S	.	*	H	α-helix	trans	-78.9	-15.8	-174.9	-161.8	40.9	0	0	0	113.7	K460	D456-K460 IonicContact OD1-NZ 3.56Å; D456-K460 IonicContact OD2-NZ 2.76Å; D456-K460 PolarHBondContact OD2-NZ 3.17Å
457	T	35.4	Very low	35.6	Very low	97 Å²	97	114.2 Å²	114.2	60%	0.595	67%	0.665	S	S	*	*	H	α-helix	trans	-89.9	-31.5	173.5	42.1	0	0	0	0	112.7	L455	L455-T457 VanDerWaalsContact C-N 3.35Å; L455-T457 PolarHBondContact O-N 2.73Å
458	T	35.4	Very low	36.5	Very low	99 Å²	99	116.4 Å²	116.4	61%	0.607	67%	0.667	S	S	*	*	H	α-helix	trans	-81.8	-20.7	177.6	33.5	0	0	0	0	113.5	A454 L455	A454-T458 PolarHBondContact O-OG1 2.91Å; L455-T458 PolarHBondContact O-OG1 2.97Å
459	Q	36.2	Very low	37	Very low	118 Å²	118	115.2 Å²	115.2	55%	0.551	67%	0.667	S	S	*	*	H	α-helix	trans	-93.1	-21	179	-149.3	169	-16.4	0	0	113.5	L455 A462	L455-Q459 WeakPolarHBondContact O-CB 3.17Å; L455-Q459 PolarHBondContact O-N 2.83Å; Q459-A462 PolarHBondContact O-N 3.35Å
460	K	37.7	Very low	37.3	Very low	121 Å²	121	118.7 Å²	118.7	53%	0.526	68%	0.679	S	S	.	*	H	α-helix	trans	-74.1	-31.3	173	-89.2	174.1	179.8	138.6	0	113.3	D456 A462 L463	D456-K460 IonicContact OD1-NZ 3.56Å; D456-K460 IonicContact OD2-NZ 2.76Å; D456-K460 PolarHBondContact OD2-NZ 3.17Å; K460-A462 VanDerWaalsContact C-N 3.26Å; K460-A462 PolarHBondContact O-N 3.37Å; K460-L463 PolarHBondContact O-N 2.97Å
461	D	34.3	Very low	37.7	Very low	131 Å²	131	122.3 Å²	122.3	70%	0.701	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-16.3	174.1	-71.8	-21.2	0	0	0	113.1
462	A	39.6	Very low	37.7	Very low	61 Å²	61	123 Å²	123	50%	0.504	68%	0.681	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.9	-2.6	174.7	0	0	0	0	0	114.2	Q459 K460	Q459-A462 PolarHBondContact O-N 3.35Å; K460-A462 VanDerWaalsContact C-N 3.26Å; K460-A462 PolarHBondContact O-N 3.37Å
463	L	38.7	Very low	38.2	Very low	142 Å²	142	125.1 Å²	125.1	74%	0.743	68%	0.684	S	S	*	*	S	Bend	trans	-113.1	2.5	-176.7	-75.8	168.4	0	0	0	114.3	K460	K460-L463 PolarHBondContact O-N 2.97Å
464	L	36.2	Very low	38.5	Very low	129 Å²	129	127.6 Å²	127.6	68%	0.675	68%	0.684	S	S	*	*	S	Bend	trans	-89	125.5	167	-75.2	162.2	0	0	0	108.9
465	P	45.2	Very low	39.1	Very low	109 Å²	109	129.8 Å²	129.8	71%	0.708	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-58.9	136.4	175.3	24.9	-31.3	0	0	0	108.5	N467	P465-N467 PolarHBondContact O-N 3.01Å
466	P	42.4	Very low	40	Very low	113 Å²	113	127.5 Å²	127.5	73%	0.734	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-59.5	131.6	176.2	26	-31.2	0	0	0	107.9	E468	P466-E468 PolarHBondContact O-N 2.71Å
467	N	40.3	Very low	41	Very low	165 Å²	165	128.4 Å²	128.4	88%	0.882	70%	0.702	S	S	*	*			trans	-40.9	112.1	176	-127.7	-7.2	0	0	0	109.2	P465 P469	P465-N467 PolarHBondContact O-N 3.01Å; N467-P469 WeakPolarHBondContact O-CD 3.41Å; N467-P469 VanDerWaalsContact O-N 3.17Å
468	E	45.4	Very low	42.2	Very low	160 Å²	160	128.3 Å²	128.3	75%	0.748	70%	0.696	S	S	*	*			trans	-61.2	119.5	-174.3	-163.2	174.6	-165	0	0	107.9	P466 Q470	P466-E468 PolarHBondContact O-N 2.71Å; E468-Q470 PolarHBondContact O-N 3.13Å
469	P	39.4	Very low	43.9	Very low	112 Å²	112	124.4 Å²	124.4	73%	0.727	67%	0.672	S	S	*	*			trans	-59.6	121.2	173.6	23.2	-29.9	0	0	0	106.7	N467 R471	N467-P469 WeakPolarHBondContact O-CD 3.41Å; N467-P469 VanDerWaalsContact O-N 3.17Å; P469-R471 PolarHBondContact O-N 3.16Å
470	Q	35.4	Very low	46	Very low	195 Å²	195	127.3 Å²	127.3	91%	0.911	68%	0.683	S	S	*	*			trans	-40.5	106	177.6	-75.9	178.2	-11.4	0	0	108.8	E468 A472	E468-Q470 PolarHBondContact O-N 3.13Å; Q470-A472 PolarHBondContact O-N 2.93Å
471	R	42.1	Very low	48.2	Very low	190 Å²	190	123.9 Å²	123.9	72%	0.717	67%	0.67	S	S	*	*			trans	-60.9	105.5	-174.4	-157.6	177	-161.2	-177.5	5.6	106.6	E346 P469 K473	E346-R471 IonicContact OE2-NH2 3.76Å; P469-R471 PolarHBondContact O-N 3.16Å; R471-K473 PolarHBondContact O-N 3.45Å
472	A	35.9	Very low	50.6	Low	88 Å²	88	117.8 Å²	117.8	73%	0.727	64%	0.637	S	S	*	*			trans	-47.4	118.8	175.9	0	0	0	0	0	107.9	Q470 K474	Q470-A472 PolarHBondContact O-N 2.93Å; A472-K474 PolarHBondContact O-N 2.92Å
473	K	42.7	Very low	52.7	Low	201 Å²	201	117.5 Å²	117.5	87%	0.874	63%	0.632	S	S	*	*			trans	-50.1	113.1	176.9	-79.5	178.9	176.7	177.5	0	106.9	R471	R471-K473 PolarHBondContact O-N 3.45Å
474	K	41.7	Very low	55.1	Low	177 Å²	177	119 Å²	119	77%	0.77	63%	0.629	S	S	*	*			trans	-51.7	133.2	172.9	-84.1	-177.5	175.1	-178.9	0	107.2	A472 A476	A472-K474 PolarHBondContact O-N 2.92Å; K474-A476 PolarHBondContact O-N 3.48Å
475	P	47.8	Very low	57.7	Low	121 Å²	121	113.3 Å²	113.3	79%	0.786	60%	0.6	S	S	*	*			trans	-53.7	134.2	176.2	21.9	-31.5	0	0	0	108.6	S477	P475-S477 PolarHBondContact O-N 3.23Å
476	A	53.6	Low	59.8	Low	59 Å²	59	110.2 Å²	110.2	49%	0.488	57%	0.574	S	S	.	*			trans	-46.8	106.3	-174.1	0	0	0	0	0	110	K474 M478	K474-A476 PolarHBondContact O-N 3.48Å; A476-M478 PolarHBondContact O-N 2.66Å
477	S	55.1	Low	62.1	Low	109 Å²	109	112.3 Å²	112.3	76%	0.762	57%	0.572	S	S	*	*			trans	-63.7	102.6	175.8	162.5	0	0	0	0	107.3	P475 S479	P475-S477 PolarHBondContact O-N 3.23Å; S477-S479 PolarHBondContact O-N 3.27Å
478	M	61	Low	64.5	Low	95 Å²	95	108.1 Å²	108.1	47%	0.468	55%	0.552	S	S	.	*			trans	-53.8	130.5	173.7	-170.2	-179.1	-57.5	0	0	108.9	A476 K480 D482 R486	A476-M478 PolarHBondContact O-N 2.66Å; M478-K480 PolarHBondContact O-N 2.98Å; M478-D482 HydrophobicContact CG-CB 4.4Å; M478-R486 VanDerWaalsContact CE-NH1 3.3Å; M478-R486 VanDerWaalsContact CE-NH2 3.34Å
479	S	71	Confident	66.7	Low	17 Å²	17	102.2 Å²	102.2	12%	0.119	52%	0.524	C	S	.	.			trans	-59.9	134.9	173.1	-165.2	0	0	0	0	108.7	L273 S477 I481 D482 S483	L273-S479 VanDerWaalsContact CD1-CB 3.5Å; S477-S479 PolarHBondContact O-N 3.27Å; S479-I481 PolarHBondContact O-N 3.12Å; S479-I481 VanDerWaalsContact O-N 3.11Å; S479-I481 PolarHBondContact OG-N 2.69Å; S479-D482 WeakPolarHBondContact CB-OD2 3.32Å; S479-D482 PolarHBondContact O-N 3.4Å; S479-S483 PolarHBondContact O-N 3.03Å
480	K	80.5	Confident	69.2	Low	178 Å²	178	98.1 Å²	98.1	77%	0.774	50%	0.497	S	S	*	.	H	α-helix	trans	-52.9	-32.4	167.9	-68.8	-175.9	178.5	-177.7	0	110.8	M478 S483 Y484	M478-K480 PolarHBondContact O-N 2.98Å; K480-S483 WeakPolarHBondContact O-CB 3.46Å; K480-S483 PolarHBondContact O-N 2.8Å; K480-Y484 WeakPolarHBondContact O-CD2 3.31Å; K480-Y484 PolarHBondContact O-N 3.49Å
481	I	83.5	Confident	71.9	Confident	50 Å²	50	91.1 Å²	91.1	26%	0.256	47%	0.473	S	S	.	.	H	α-helix	trans	-66.9	-51.6	179.6	-53.5	168.6	0	0	0	110.4	E327 A331 L334 S479 S483 Y484 S485	E327-I481 HydrophobicContact CG-CG2 4.19Å; E327-I481 VanDerWaalsContact OE1-CG2 3.25Å; E327-I481 WeakPolarHBondContact OE1-CG2 3.29Å; A331-I481 HydrophobicContact CB-CD1 4.3Å; L334-I481 HydrophobicContact CB-CD1 4.47Å; L334-I481 HydrophobicContact CD1-CD1 3.45Å; L334-I481 VanDerWaalsContact CD1-CD1 3.45Å; S479-I481 PolarHBondContact O-N 3.12Å; S479-I481 VanDerWaalsContact O-N 3.11Å; S479-I481 PolarHBondContact OG-N 2.69Å; I481-S483 PolarHBondContact O-N 3.33Å; I481-S483 VanDerWaalsContact O-N 3.16Å; I481-Y484 PolarHBondContact O-N 3.18Å; I481-S485 PolarHBondContact O-N 2.71Å; I481-S485 PolarHBondContact O-OG 2.9Å
482	D	84.9	Confident	74.3	Confident	2 Å²	2	84.8 Å²	84.8	1%	0.011	46%	0.457	C	S	.	.	H	α-helix	trans	-53.9	-39.1	176.4	-66	-42.7	0	0	0	111.1	R279 M478 S479 Y484 S485 R486	R279-D482 IonicContact CZ-OD1 3.48Å; R279-D482 IonicContact CZ-OD2 2.71Å; R279-D482 IonicContact NH1-OD1 3.55Å; R279-D482 PolarHBondContact NH1-OD1 3.14Å; R279-D482 IonicContact NH1-OD2 2.74Å; R279-D482 VanDerWaalsContact NH2-CG 3.26Å; R279-D482 IonicContact NH2-OD1 2.83Å; R279-D482 PolarHBondContact NH2-OD1 3.31Å; R279-D482 IonicContact NH2-OD2 3.77Å; R279-D482 PolarHBondContact NH2-OD2 2.71Å; M478-D482 HydrophobicContact CG-CB 4.4Å; S479-D482 WeakPolarHBondContact CB-OD2 3.32Å; S479-D482 PolarHBondContact O-N 3.4Å; D482-Y484 PolarHBondContact O-N 3.33Å; D482-S485 PolarHBondContact O-N 2.86Å; D482-R486 VanDerWaalsContact O-CG 3.25Å; D482-R486 WeakPolarHBondContact O-CG 3.4Å; D482-R486 PolarHBondContact O-N 3.34Å
483	S	84.3	Confident	77.1	Confident	55 Å²	55	80.8 Å²	80.8	39%	0.385	42%	0.423	S	S	.	.	H	α-helix	trans	-63.3	-39.2	179.8	-169.9	0	0	0	0	113.1	S479 K480 I481	S479-S483 PolarHBondContact O-N 3.03Å; K480-S483 WeakPolarHBondContact O-CB 3.46Å; K480-S483 PolarHBondContact O-N 2.8Å; I481-S483 PolarHBondContact O-N 3.33Å; I481-S483 VanDerWaalsContact O-N 3.16Å
484	Y	88.7	Confident	79.5	Confident	173 Å²	173	76.4 Å²	76.4	68%	0.678	41%	0.409	S	S	*	.	H	α-helix	trans	-73.6	-43.1	174.4	-73.8	-71.6	0	0	0	111	K480 I481 D482 R486 F487 V488	K480-Y484 WeakPolarHBondContact O-CD2 3.31Å; K480-Y484 PolarHBondContact O-N 3.49Å; I481-Y484 PolarHBondContact O-N 3.18Å; D482-Y484 PolarHBondContact O-N 3.33Å; Y484-R486 PolarHBondContact O-N 2.89Å; Y484-F487 PolarHBondContact O-N 3.33Å; Y484-F487 VanDerWaalsContact O-N 3.07Å; Y484-V488 WeakPolarHBondContact O-CG2 3.43Å; Y484-V488 PolarHBondContact O-N 2.92Å
485	S	90.4	Very high	82	Confident	10 Å²	10	72.9 Å²	72.9	7%	0.07	40%	0.398	C	S	.	.	H	α-helix	trans	-59.1	-32.3	-178.3	-59	0	0	0	0	113.1	E327 I481 D482 F487 F489	E327-S485 VanDerWaalsContact CG-OG 3.29Å; E327-S485 WeakPolarHBondContact CG-OG 3.4Å; I481-S485 PolarHBondContact O-N 2.71Å; I481-S485 PolarHBondContact O-OG 2.9Å; D482-S485 PolarHBondContact O-N 2.86Å; S485-F487 PolarHBondContact O-N 2.94Å; S485-F489 WeakPolarHBondContact O-CD2 3.31Å; S485-F489 PolarHBondContact O-N 3.1Å
486	R	89.8	Confident	84.2	Confident	45 Å²	45	69.4 Å²	69.4	17%	0.17	37%	0.369	C	S	.	.	H	α-helix	trans	-55.8	-29.6	174.6	-77.6	168.5	-169.5	-153.2	-0.7	114.7	F269 M478 D482 Y484 P490	F269-R486 HydrophobicContact CB-CG 3.68Å; F269-R486 HydrophobicContact CG-CG 4.49Å; F269-R486 PolarHBondContact O-NE 3.06Å; F269-R486 VanDerWaalsContact O-NE 3.09Å; F269-R486 PolarHBondContact O-NH2 3.11Å; M478-R486 VanDerWaalsContact CE-NH1 3.3Å; M478-R486 VanDerWaalsContact CE-NH2 3.34Å; D482-R486 VanDerWaalsContact O-CG 3.25Å; D482-R486 WeakPolarHBondContact O-CG 3.4Å; D482-R486 PolarHBondContact O-N 3.34Å; Y484-R486 PolarHBondContact O-N 2.89Å; R486-P490 WeakPolarHBondContact O-CD 3.45Å; R486-P490 VanDerWaalsContact O-CG 3.3Å; R486-P490 WeakPolarHBondContact O-CG 3.36Å
487	F	90	Very high	86.1	Confident	157 Å²	157	67.5 Å²	67.5	69%	0.689	35%	0.351	S	S	*	.	H	α-helix	trans	-105.2	-41.1	-179.7	-64.9	-77.9	0	0	0	111.8	Y484 S485 A491	Y484-F487 PolarHBondContact O-N 3.33Å; Y484-F487 VanDerWaalsContact O-N 3.07Å; S485-F487 PolarHBondContact O-N 2.94Å; F487-A491 WeakPolarHBondContact O-CB 3.47Å; F487-A491 PolarHBondContact O-N 2.88Å
488	V	91.6	Very high	87.9	Confident	77 Å²	77	65.9 Å²	65.9	47%	0.467	34%	0.339	S	S	.	.	H	α-helix	trans	-63.6	-48.3	-174.9	174.5	0	0	0	0	111.2	Y484 A491 C492	Y484-V488 WeakPolarHBondContact O-CG2 3.43Å; Y484-V488 PolarHBondContact O-N 2.92Å; V488-A491 PolarHBondContact O-N 3.05Å; V488-C492 WeakPolarHBondContact O-CB 3.32Å; V488-C492 PolarHBondContact O-N 3.18Å; V488-C492 PolarHBondContact O-SG 3.08Å
489	F	91.2	Very high	89.4	Confident	35 Å²	35	68.1 Å²	68.1	15%	0.154	35%	0.346	C	S	.	.	H	α-helix	trans	-64.7	-50	-177.2	-81.8	-95.4	0	0	0	112.8	F269 V324 E327 S485 A491 C492 F493	F269-F489 HydrophobicContact CE1-CD2 4.3Å; F269-F489 HydrophobicContact CE1-CE2 4.34Å; F269-F489 HydrophobicContact CE2-CB 3.83Å; F269-F489 AromaticContact CE2-CD2 3.97Å; F269-F489 HydrophobicContact CE2-CD2 3.97Å; F269-F489 AromaticContact CE2-CG 3.98Å; F269-F489 HydrophobicContact CE2-CG 3.98Å; F269-F489 HydrophobicContact CZ-CB 4.07Å; F269-F489 HydrophobicContact CZ-CD1 4.27Å; F269-F489 AromaticContact CZ-CD2 3.45Å; F269-F489 HydrophobicContact CZ-CD2 3.45Å; F269-F489 VanDerWaalsContact CZ-CD2 3.45Å; F269-F489 AromaticContact CZ-CE2 3.84Å; F269-F489 HydrophobicContact CZ-CE2 3.84Å; F269-F489 AromaticContact CZ-CG 3.68Å; F269-F489 HydrophobicContact CZ-CG 3.68Å; F269-F489 HydrophobicContact CZ-CZ 4.4Å; V324-F489 HydrophobicContact CG2-CD1 4.13Å; V324-F489 HydrophobicContact CG2-CE1 4.15Å; E327-F489 HydrophobicContact CB-CE2 4.32Å; E327-F489 HydrophobicContact CB-CZ 4.23Å; E327-F489 HydrophobicContact CG-CE2 4.27Å; S485-F489 WeakPolarHBondContact O-CD2 3.31Å; S485-F489 PolarHBondContact O-N 3.1Å; F489-A491 PolarHBondContact O-N 2.98Å; F489-C492 PolarHBondContact O-N 3.45Å; F489-F493 PolarHBondContact O-N 3.33Å
490	P	91.2	Very high	90.5	Very high	26 Å²	26	67.7 Å²	67.7	17%	0.169	34%	0.342	C	S	.	.	H	α-helix	trans	-60.5	-41.8	175	-26.4	36.2	0	0	0	113.6	W266 R486 F493 L494	W266-P490 HydrophobicContact CD2-CB 4.32Å; W266-P490 HydrophobicContact CD2-CG 3.75Å; W266-P490 HydrophobicContact CE3-CB 3.91Å; W266-P490 HydrophobicContact CE3-CG 3.62Å; W266-P490 HydrophobicContact CG-CG 4.29Å; W266-P490 HydrophobicContact CH2-CB 3.83Å; W266-P490 HydrophobicContact CH2-CG 4.32Å; W266-P490 HydrophobicContact CZ2-CB 4.26Å; W266-P490 HydrophobicContact CZ2-CG 4.46Å; W266-P490 HydrophobicContact CZ3-CB 3.64Å; W266-P490 HydrophobicContact CZ3-CG 3.91Å; R486-P490 WeakPolarHBondContact O-CD 3.45Å; R486-P490 VanDerWaalsContact O-CG 3.3Å; R486-P490 WeakPolarHBondContact O-CG 3.36Å; P490-F493 PolarHBondContact O-N 3.21Å; P490-L494 WeakPolarHBondContact O-CB 3.19Å; P490-L494 WeakPolarHBondContact O-CG 3.47Å; P490-L494 PolarHBondContact O-N 3.32Å
491	A	92.3	Very high	91	Very high	48 Å²	48	61.7 Å²	61.7	40%	0.397	32%	0.315	S	S	.	.	H	α-helix	trans	-63.7	-44.5	179.1	0	0	0	0	0	112	F487 V488 F489 F493 L494 L495	F487-A491 WeakPolarHBondContact O-CB 3.47Å; F487-A491 PolarHBondContact O-N 2.88Å; V488-A491 PolarHBondContact O-N 3.05Å; F489-A491 PolarHBondContact O-N 2.98Å; A491-F493 VanDerWaalsContact C-N 3.34Å; A491-F493 PolarHBondContact O-N 3.41Å; A491-L494 PolarHBondContact O-N 3.36Å; A491-L495 WeakPolarHBondContact O-CG 3.11Å; A491-L495 PolarHBondContact O-N 3.3Å
492	C	93.7	Very high	91.3	Very high	57 Å²	57	64.1 Å²	64.1	39%	0.385	33%	0.328	S	S	.	.	H	α-helix	trans	-62.7	-39.9	176	-70.3	0	0	0	0	112.1	F320 V488 F489 Y496	F320-C492 HydrophobicContact CE1-CB 3.78Å; F320-C492 HydrophobicContact CZ-CB 4.26Å; V488-C492 WeakPolarHBondContact O-CB 3.32Å; V488-C492 PolarHBondContact O-N 3.18Å; V488-C492 PolarHBondContact O-SG 3.08Å; F489-C492 PolarHBondContact O-N 3.45Å; C492-Y496 WeakPolarHBondContact O-CB 3.32Å; C492-Y496 PolarHBondContact O-N 3.23Å
493	F	93.7	Very high	91.6	Very high	4 Å²	4	69.7 Å²	69.7	2%	0.018	35%	0.349	C	S	.	.	H	α-helix	trans	-68.5	-39.5	177.1	-173.7	-105.9	0	0	0	112.3	I259 M262 W266 W313 F320 F489 P490 A491 Y496 N497	I259-F493 HydrophobicContact CG1-CE1 4.28Å; I259-F493 HydrophobicContact CG1-CZ 4.25Å; I259-F493 HydrophobicContact CG2-CE1 4.45Å; M262-F493 HydrophobicContact CB-CE1 4.22Å; M262-F493 HydrophobicContact CB-CE2 4.35Å; M262-F493 HydrophobicContact CB-CZ 4.03Å; M262-F493 HydrophobicContact CG-CD2 4.5Å; M262-F493 HydrophobicContact CG-CE1 4.45Å; M262-F493 HydrophobicContact CG-CE2 3.8Å; M262-F493 HydrophobicContact CG-CZ 3.77Å; W266-F493 HydrophobicContact CH2-CB 4.1Å; W266-F493 AromaticContact CH2-CD1 3.69Å; W266-F493 HydrophobicContact CH2-CD1 3.69Å; W266-F493 HydrophobicContact CH2-CG 4.21Å; W266-F493 HydrophobicContact CZ2-CB 3.57Å; W266-F493 AromaticContact CZ2-CD1 3.65Å; W266-F493 HydrophobicContact CZ2-CD1 3.65Å; W266-F493 AromaticContact CZ2-CG 3.74Å; W266-F493 HydrophobicContact CZ2-CG 3.74Å; W313-F493 HydrophobicContact CH2-CZ 4.35Å; F320-F493 AromaticContact CD2-CD2 3.74Å; F320-F493 HydrophobicContact CD2-CD2 3.74Å; F320-F493 HydrophobicContact CD2-CE2 4.38Å; F320-F493 HydrophobicContact CE1-CB 4.37Å; F320-F493 AromaticContact CE2-CD2 3.89Å; F320-F493 HydrophobicContact CE2-CD2 3.89Å; F320-F493 HydrophobicContact CG-CD2 4.19Å; F320-F493 HydrophobicContact CZ-CB 4.39Å; F320-F493 HydrophobicContact CZ-CD2 4.44Å; F489-F493 PolarHBondContact O-N 3.33Å; P490-F493 PolarHBondContact O-N 3.21Å; A491-F493 VanDerWaalsContact C-N 3.34Å; A491-F493 PolarHBondContact O-N 3.41Å; F493-Y496 WeakPolarHBondContact O-CB 3.24Å; F493-Y496 PolarHBondContact O-N 3.05Å; F493-N497 VanDerWaalsContact CD1-ND2 3.28Å; F493-N497 WeakPolarHBondContact CD1-ND2 3.39Å; F493-N497 WeakPolarHBondContact CE1-ND2 3.33Å; F493-N497 VanDerWaalsContact CZ-ND2 3.3Å; F493-N497 WeakPolarHBondContact CZ-ND2 3.38Å; F493-N497 PolarHBondContact O-N 2.93Å; F493-N497 PolarHBondContact O-ND2 3.31Å
494	L	92.6	Very high	91.8	Very high	110 Å²	110	68.1 Å²	68.1	58%	0.576	34%	0.335	S	S	*	.	H	α-helix	trans	-63.3	-44.6	174.9	-75.1	173.2	0	0	0	111.8	P490 A491 Y496 N497 C498	P490-L494 WeakPolarHBondContact O-CB 3.19Å; P490-L494 WeakPolarHBondContact O-CG 3.47Å; P490-L494 PolarHBondContact O-N 3.32Å; A491-L494 PolarHBondContact O-N 3.36Å; L494-Y496 VanDerWaalsContact C-N 3.34Å; L494-Y496 PolarHBondContact O-N 3.24Å; L494-N497 WeakPolarHBondContact O-CB 3.42Å; L494-N497 PolarHBondContact O-N 2.86Å; L494-C498 PolarHBondContact O-N 3.47Å; L494-C498 PolarHBondContact O-SG 2.73Å; L494-C498 VanDerWaalsContact O-SG 3.35Å
495	L	94.2	Very high	91.5	Very high	103 Å²	103	63 Å²	63	54%	0.539	32%	0.32	S	S	.	.	H	α-helix	trans	-59.1	-46.4	174.1	-73.8	173.2	0	0	0	111.2	A491 N497 C498 F499	A491-L495 WeakPolarHBondContact O-CG 3.11Å; A491-L495 PolarHBondContact O-N 3.3Å; L495-N497 VanDerWaalsContact C-N 3.33Å; L495-N497 PolarHBondContact O-N 3.16Å; L495-C498 PolarHBondContact O-N 2.93Å; L495-F499 HydrophobicContact CB-CE2 4.42Å; L495-F499 WeakPolarHBondContact O-CD2 3.09Å; L495-F499 PolarHBondContact O-N 2.87Å
496	Y	94.8	Very high	91.1	Very high	47 Å²	47	66.5 Å²	66.5	18%	0.184	34%	0.34	C	S	.	.	H	α-helix	trans	-57	-45.5	175.4	172.8	-97.9	0	0	0	112	I312 W313 A316 F320 C492 F493 L494 C498 F499 Y500	I312-Y496 PolarHBondContact O-OH 2.88Å; W313-Y496 WeakPolarHBondContact CA-OH 3.44Å; W313-Y496 AromaticContact CE3-CE1 3.9Å; W313-Y496 HydrophobicContact CE3-CE1 3.9Å; W313-Y496 HydrophobicContact CZ3-CE1 4.09Å; A316-Y496 HydrophobicContact CB-CD1 4.29Å; A316-Y496 HydrophobicContact CB-CD2 4.32Å; A316-Y496 HydrophobicContact CB-CE1 3.59Å; A316-Y496 HydrophobicContact CB-CE2 3.61Å; A316-Y496 VanDerWaalsContact CB-OH 3.24Å; A316-Y496 WeakPolarHBondContact CB-OH 3.34Å; F320-Y496 HydrophobicContact CE2-CD1 4.29Å; F320-Y496 HydrophobicContact CE2-CG 4.07Å; C492-Y496 WeakPolarHBondContact O-CB 3.32Å; C492-Y496 PolarHBondContact O-N 3.23Å; F493-Y496 WeakPolarHBondContact O-CB 3.24Å; F493-Y496 PolarHBondContact O-N 3.05Å; L494-Y496 VanDerWaalsContact C-N 3.34Å; L494-Y496 PolarHBondContact O-N 3.24Å; Y496-C498 PolarHBondContact O-N 2.98Å; Y496-F499 PolarHBondContact O-N 3.47Å; Y496-Y500 HydrophobicContact CE1-CD2 4.49Å; Y496-Y500 AromaticContact CZ-CD2 4Å; Y496-Y500 VanDerWaalsContact O-CB 3.26Å; Y496-Y500 WeakPolarHBondContact O-CB 3.46Å; Y496-Y500 PolarHBondContact O-N 2.9Å; Y496-Y500 WeakPolarHBondContact OH-CD2 3.41Å
497	N	93.1	Very high	90.5	Very high	20 Å²	20	68.6 Å²	68.6	11%	0.107	35%	0.354	C	S	.	.	H	α-helix	trans	-58.1	-48.9	176.4	-87.5	-95.1	0	0	0	111.4	W313 F493 L494 L495 F499 Y500 W501	W313-N497 WeakPolarHBondContact CH2-OD1 3.45Å; W313-N497 WeakPolarHBondContact CZ3-OD1 2.99Å; F493-N497 VanDerWaalsContact CD1-ND2 3.28Å; F493-N497 WeakPolarHBondContact CD1-ND2 3.39Å; F493-N497 WeakPolarHBondContact CE1-ND2 3.33Å; F493-N497 VanDerWaalsContact CZ-ND2 3.3Å; F493-N497 WeakPolarHBondContact CZ-ND2 3.38Å; F493-N497 PolarHBondContact O-N 2.93Å; F493-N497 PolarHBondContact O-ND2 3.31Å; L494-N497 WeakPolarHBondContact O-CB 3.42Å; L494-N497 PolarHBondContact O-N 2.86Å; L495-N497 VanDerWaalsContact C-N 3.33Å; L495-N497 PolarHBondContact O-N 3.16Å; N497-F499 PolarHBondContact O-N 3.32Å; N497-Y500 PolarHBondContact O-N 3.13Å; N497-W501 PolarHBondContact O-N 2.65Å
498	C	92.5	Very high	90	Very high	75 Å²	75	62.4 Å²	62.4	51%	0.507	33%	0.329	S	S	.	.	H	α-helix	trans	-57.2	-48.5	177.8	-67.5	0	0	0	0	111.5	L494 L495 Y496 L502	L494-C498 PolarHBondContact O-N 3.47Å; L494-C498 PolarHBondContact O-SG 2.73Å; L494-C498 VanDerWaalsContact O-SG 3.35Å; L495-C498 PolarHBondContact O-N 2.93Å; Y496-C498 PolarHBondContact O-N 2.98Å; C498-L502 VanDerWaalsContact O-CB 3.23Å; C498-L502 WeakPolarHBondContact O-CB 3.39Å; C498-L502 WeakPolarHBondContact O-CD1 3.45Å; C498-L502 WeakPolarHBondContact O-CG 3.43Å; C498-L502 PolarHBondContact O-N 3.33Å
499	F	93.6	Very high	89	Confident	142 Å²	142	64.2 Å²	64.2	62%	0.623	33%	0.33	S	S	*	.	H	α-helix	trans	-64.9	-42.2	178.8	-74.1	-62.4	0	0	0	112.8	L495 Y496 N497 Y503	L495-F499 HydrophobicContact CB-CE2 4.42Å; L495-F499 WeakPolarHBondContact O-CD2 3.09Å; L495-F499 PolarHBondContact O-N 2.87Å; Y496-F499 PolarHBondContact O-N 3.47Å; N497-F499 PolarHBondContact O-N 3.32Å; F499-Y503 WeakPolarHBondContact O-CB 3.32Å; F499-Y503 PolarHBondContact O-N 3.3Å
500	Y	93.5	Very high	87.7	Confident	8 Å²	8	70.6 Å²	70.6	3%	0.031	36%	0.36	C	S	.	.	H	α-helix	trans	-59.9	-53.1	179.6	-179.1	-91	0	0	0	111.2	M172 Y255 A309 I312 W313 Y496 N497 Y503 Y504	M172-Y500 HydrophobicContact CE-CE1 4.19Å; Y255-Y500 AromaticContact CE1-CE1 3.74Å; Y255-Y500 HydrophobicContact CE1-CE1 3.74Å; Y255-Y500 PolarHBondContact OH-OH 3.09Å; A309-Y500 WeakPolarHBondContact O-CE2 3.13Å; A309-Y500 PolarHBondContact O-OH 3.17Å; I312-Y500 HydrophobicContact CG2-CE2 4.48Å; W313-Y500 HydrophobicContact CB-CE2 3.87Å; W313-Y500 AromaticContact CE3-CD1 3.76Å; W313-Y500 HydrophobicContact CE3-CD1 3.76Å; W313-Y500 HydrophobicContact CE3-CD2 4.22Å; W313-Y500 AromaticContact CE3-CE1 3.85Å; W313-Y500 HydrophobicContact CE3-CE1 3.85Å; W313-Y500 HydrophobicContact CE3-CE2 4.27Å; W313-Y500 AromaticContact CE3-CG 3.97Å; W313-Y500 HydrophobicContact CE3-CG 3.97Å; W313-Y500 HydrophobicContact CZ3-CD1 4.09Å; W313-Y500 HydrophobicContact CZ3-CE1 4.48Å; W313-Y500 HydrophobicContact CZ3-CG 4.39Å; Y496-Y500 HydrophobicContact CE1-CD2 4.49Å; Y496-Y500 AromaticContact CZ-CD2 4Å; Y496-Y500 VanDerWaalsContact O-CB 3.26Å; Y496-Y500 WeakPolarHBondContact O-CB 3.46Å; Y496-Y500 PolarHBondContact O-N 2.9Å; Y496-Y500 WeakPolarHBondContact OH-CD2 3.41Å; N497-Y500 PolarHBondContact O-N 3.13Å; Y500-Y503 PolarHBondContact O-N 2.87Å; Y500-Y504 HydrophobicContact CD1-CD2 4.31Å; Y500-Y504 AromaticContact CD2-CD2 3.81Å; Y500-Y504 HydrophobicContact CD2-CD2 3.81Å; Y500-Y504 AromaticContact CD2-CE2 3.69Å; Y500-Y504 HydrophobicContact CD2-CE2 3.69Å; Y500-Y504 HydrophobicContact CE1-CD2 4.08Å; Y500-Y504 AromaticContact CE2-CD2 3.57Å; Y500-Y504 HydrophobicContact CE2-CD2 3.57Å; Y500-Y504 AromaticContact CE2-CE2 3.35Å; Y500-Y504 HydrophobicContact CE2-CE2 3.35Å; Y500-Y504 HydrophobicContact CG-CD2 4.17Å; Y500-Y504 HydrophobicContact CG-CE2 4.48Å; Y500-Y504 AromaticContact CZ-CD2 3.7Å; Y500-Y504 AromaticContact CZ-CE2 3.9Å; Y500-Y504 WeakPolarHBondContact O-CD2 3.42Å; Y500-Y504 PolarHBondContact O-N 3.06Å
501	W	91.3	Very high	86	Confident	52 Å²	52	80.4 Å²	80.4	20%	0.197	40%	0.4	C	S	.	.	H	α-helix	trans	-68.1	-40.9	-178.1	-70.4	113.3	0	0	0	112	M172 L247 L251 Y255 N497 Y503 L505	M172-W501 HydrophobicContact SD-CE3 4.37Å; M172-W501 HydrophobicContact SD-CZ3 4.01Å; L247-W501 HydrophobicContact CD2-CZ3 4.07Å; L251-W501 HydrophobicContact CD2-CH2 3.37Å; L251-W501 HydrophobicContact CD2-CZ2 3.82Å; L251-W501 HydrophobicContact CD2-CZ3 4.26Å; Y255-W501 AromaticContact CD1-CH2 3.95Å; Y255-W501 HydrophobicContact CD1-CH2 3.95Å; Y255-W501 AromaticContact CD1-CZ2 3.67Å; Y255-W501 HydrophobicContact CD1-CZ2 3.67Å; Y255-W501 HydrophobicContact CD2-CH2 4.13Å; Y255-W501 HydrophobicContact CE1-CH2 4.03Å; Y255-W501 HydrophobicContact CE1-CZ2 4.04Å; Y255-W501 HydrophobicContact CE2-CH2 4.19Å; Y255-W501 HydrophobicContact CG-CH2 4.03Å; Y255-W501 AromaticContact CG-CZ2 3.95Å; Y255-W501 HydrophobicContact CG-CZ2 3.95Å; N497-W501 PolarHBondContact O-N 2.65Å; W501-Y503 PolarHBondContact O-N 3.44Å; W501-L505 HydrophobicContact CE3-CD1 3.59Å; W501-L505 HydrophobicContact CE3-CG 3.96Å; W501-L505 HydrophobicContact CZ3-CD1 4.24Å; W501-L505 VanDerWaalsContact O-CB 3.23Å; W501-L505 WeakPolarHBondContact O-CB 3.49Å; W501-L505 PolarHBondContact O-N 3.11Å
502	L	90.5	Very high	85.7	Confident	101 Å²	101	82 Å²	82	53%	0.529	40%	0.4	S	S	.	.	H	α-helix	trans	-61.6	-43.7	174.7	-73.8	171.5	0	0	0	111.7	C498 V506 I507	C498-L502 VanDerWaalsContact O-CB 3.23Å; C498-L502 WeakPolarHBondContact O-CB 3.39Å; C498-L502 WeakPolarHBondContact O-CD1 3.45Å; C498-L502 WeakPolarHBondContact O-CG 3.43Å; C498-L502 PolarHBondContact O-N 3.33Å; L502-V506 HydrophobicContact CD2-CG2 4.21Å; L502-V506 WeakPolarHBondContact O-CB 3.36Å; L502-V506 PolarHBondContact O-N 3.34Å; L502-V506 VanDerWaalsContact O-N 3.1Å; L502-I507 PolarHBondContact O-N 3.32Å
503	Y	90.5	Very high	85.2	Confident	118 Å²	118	83.3 Å²	83.3	46%	0.463	40%	0.401	S	S	.	.	I	π-helix	trans	-63.5	-53.1	-179.6	-177.8	-97.1	0	0	0	111.6	F499 Y500 W501 I507 V508	F499-Y503 WeakPolarHBondContact O-CB 3.32Å; F499-Y503 PolarHBondContact O-N 3.3Å; Y500-Y503 PolarHBondContact O-N 2.87Å; W501-Y503 PolarHBondContact O-N 3.44Å; Y503-I507 HydrophobicContact CD2-CD1 4.11Å; Y503-I507 WeakPolarHBondContact O-CB 3.44Å; Y503-I507 PolarHBondContact O-N 3.42Å; Y503-I507 VanDerWaalsContact O-N 3.17Å; Y503-V508 HydrophobicContact CD1-CG2 3.95Å; Y503-V508 HydrophobicContact CE1-CG2 3.57Å; Y503-V508 WeakPolarHBondContact O-CG2 3.49Å; Y503-V508 PolarHBondContact O-N 3.19Å; Y503-V508 VanDerWaalsContact O-N 3.07Å
504	Y	87.9	Confident	84.8	Confident	22 Å²	22	87.7 Å²	87.7	9%	0.086	42%	0.422	C	S	.	.	I	π-helix	trans	-79	-35.9	-173.3	-73.5	-69.4	0	0	0	114.2	M172 A309 I312 Y500 V508	M172-Y504 HydrophobicContact CE-CD1 4.29Å; M172-Y504 HydrophobicContact CE-CD2 4.21Å; M172-Y504 HydrophobicContact CE-CG 3.71Å; M172-Y504 VanDerWaalsContact SD-CB 3.53Å; A309-Y504 HydrophobicContact CB-CD1 3.69Å; A309-Y504 HydrophobicContact CB-CD2 4.29Å; A309-Y504 HydrophobicContact CB-CE1 3.27Å; A309-Y504 HydrophobicContact CB-CE2 3.93Å; A309-Y504 HydrophobicContact CB-CG 4.2Å; I312-Y504 WeakPolarHBondContact CD1-OH 3.18Å; Y500-Y504 HydrophobicContact CD1-CD2 4.31Å; Y500-Y504 AromaticContact CD2-CD2 3.81Å; Y500-Y504 HydrophobicContact CD2-CD2 3.81Å; Y500-Y504 AromaticContact CD2-CE2 3.69Å; Y500-Y504 HydrophobicContact CD2-CE2 3.69Å; Y500-Y504 HydrophobicContact CE1-CD2 4.08Å; Y500-Y504 AromaticContact CE2-CD2 3.57Å; Y500-Y504 HydrophobicContact CE2-CD2 3.57Å; Y500-Y504 AromaticContact CE2-CE2 3.35Å; Y500-Y504 HydrophobicContact CE2-CE2 3.35Å; Y500-Y504 HydrophobicContact CG-CD2 4.17Å; Y500-Y504 HydrophobicContact CG-CE2 4.48Å; Y500-Y504 AromaticContact CZ-CD2 3.7Å; Y500-Y504 AromaticContact CZ-CE2 3.9Å; Y500-Y504 WeakPolarHBondContact O-CD2 3.42Å; Y500-Y504 PolarHBondContact O-N 3.06Å; Y504-V508 HydrophobicContact CD1-CG2 4.26Å
505	L	83.6	Confident	84.3	Confident	67 Å²	67	86.4 Å²	86.4	35%	0.351	41%	0.413	S	S	.	.	I	π-helix	trans	-83.8	-30.6	-179.5	-66.2	177.4	0	0	0	113.7	M172 L247 W501 K509	M172-L505 HydrophobicContact CG-CD2 4.01Å; M172-L505 HydrophobicContact SD-CD2 3.66Å; M172-L505 HydrophobicContact SD-CG 4.07Å; L247-L505 HydrophobicContact CD2-CD2 4.16Å; W501-L505 HydrophobicContact CE3-CD1 3.59Å; W501-L505 HydrophobicContact CE3-CG 3.96Å; W501-L505 HydrophobicContact CZ3-CD1 4.24Å; W501-L505 VanDerWaalsContact O-CB 3.23Å; W501-L505 WeakPolarHBondContact O-CB 3.49Å; W501-L505 PolarHBondContact O-N 3.11Å; L505-K509 VanDerWaalsContact O-CB 3.28Å; L505-K509 WeakPolarHBondContact O-CB 3.42Å
506	V	82	Confident	83.7	Confident	82 Å²	82	85.4 Å²	85.4	50%	0.497	41%	0.405	S	S	.	.	I	π-helix	trans	-102.8	-51	-174.4	-172.9	0	0	0	0	111.4	L502 H510	L502-V506 HydrophobicContact CD2-CG2 4.21Å; L502-V506 WeakPolarHBondContact O-CB 3.36Å; L502-V506 PolarHBondContact O-N 3.34Å; L502-V506 VanDerWaalsContact O-N 3.1Å; V506-H510 PolarHBondContact O-CD2 3.15Å
507	I	77.6	Confident	82.9	Confident	90 Å²	90	87.9 Å²	87.9	46%	0.462	42%	0.42	S	S	.	.	I	π-helix	trans	-80.9	-44.4	-170.8	-57.6	177.4	0	0	0	110.9	L502 Y503	L502-I507 PolarHBondContact O-N 3.32Å; Y503-I507 HydrophobicContact CD2-CD1 4.11Å; Y503-I507 WeakPolarHBondContact O-CB 3.44Å; Y503-I507 PolarHBondContact O-N 3.42Å; Y503-I507 VanDerWaalsContact O-N 3.17Å
508	V	78.5	Confident	82.2	Confident	27 Å²	27	92.8 Å²	92.8	16%	0.164	44%	0.443	C	S	.	.	I	π-helix	trans	-82.8	-37.9	-172.8	177.8	0	0	0	0	112	T169 Y503 Y504 H510 K511	T169-V508 HydrophobicContact CG2-CG1 3.26Å; Y503-V508 HydrophobicContact CD1-CG2 3.95Å; Y503-V508 HydrophobicContact CE1-CG2 3.57Å; Y503-V508 WeakPolarHBondContact O-CG2 3.49Å; Y503-V508 PolarHBondContact O-N 3.19Å; Y503-V508 VanDerWaalsContact O-N 3.07Å; Y504-V508 HydrophobicContact CD1-CG2 4.26Å; V508-H510 PolarHBondContact O-N 2.97Å; V508-K511 PolarHBondContact O-N 3.15Å
509	K	70.1	Confident	81.4	Confident	115 Å²	115	94.2 Å²	94.2	50%	0.5	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-25.6	178.8	-168.2	177.1	179.2	179.9	0	113.8	L505	L505-K509 VanDerWaalsContact O-CB 3.28Å; L505-K509 WeakPolarHBondContact O-CB 3.42Å
510	H	64.7	Low	80.4	Confident	168 Å²	168	90.2 Å²	90.2	78%	0.778	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-0.5	179.6	-86.9	-69.6	0	0	0	114.4	V506 V508	V506-H510 PolarHBondContact O-CD2 3.15Å; V508-H510 PolarHBondContact O-N 2.97Å
511	K	54.8	Low	79.2	Confident	232 Å²	232	97.6 Å²	97.6	100%	1.009	46%	0.458	S	S	*	.			trans	-100	0	169.9	-77.4	-175.3	173.9	-175.8	0	109.5	V508	V508-K511 PolarHBondContact O-N 3.15Å

Retrieved 511 of 511 residues in 88.2 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).