A0A061IFR0_CRIGR Loading...

snRNA-activating protein complex subunit 3

Part of the SNAPc complex required for the transcription of both RNA polymerase II and III small-nuclear RNA genes. Binds to the proximal sequence element (PSE), a non-TATA-box basal promoter element common to these 2 types of genes. Recruits TBP and BRF2 to the U6 snRNA TATA box.

AlphaFold DB , UniProt , Accession A0A061IFR0, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Snapc3, Length 407 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.9	Very low	30	Very low	243 Å²	243	129.2 Å²	129.2	100%	1.197	87%	0.866	S	S	*	*				0	121.3	0	-77.2	-168.3	-170.7	0	0	107.1
2	A	30.5	Very low	30	Very low	104 Å²	104	123.5 Å²	123.5	86%	0.86	85%	0.847	S	S	*	*			trans	59.7	137.3	167.5	0	0	0	0	0	118.3
3	A	27.9	Very low	30	Very low	92 Å²	92	123 Å²	123	76%	0.76	84%	0.84	S	S	*	*			cis	-176.2	128.7	-22.6	0	0	0	0	0	103.7
4	D	26.2	Very low	30	Very low	162 Å²	162	127.9 Å²	127.9	87%	0.866	84%	0.844	S	S	*	*			trans	-65.2	148.7	162.5	-95.1	-36.7	0	0	0	110.2
5	P	34.8	Very low	30	Very low	119 Å²	119	130.5 Å²	130.5	77%	0.773	84%	0.839	S	S	*	*			trans	-105.9	117.7	149.8	29.5	-15.4	0	0	0	110.3
6	Q	29.9	Very low	30.1	Very low	198 Å²	198	129.5 Å²	129.5	93%	0.925	83%	0.833	S	S	*	*			trans	-62	149.1	155.5	-75.8	173.4	-19.4	0	0	110.1
7	G	27.4	Very low	30.4	Very low	72 Å²	72	129.9 Å²	129.9	74%	0.742	83%	0.833	S	S	*	*			trans	-161.5	86	171.7	0	0	0	0	0	111.9
8	D	27.6	Very low	30.5	Very low	168 Å²	168	129.2 Å²	129.2	90%	0.898	83%	0.829	S	S	*	*			trans	40.9	128.9	148	-74.2	-29.4	0	0	0	122.6
9	G	31.8	Very low	30.5	Very low	79 Å²	79	128.2 Å²	128.2	81%	0.814	83%	0.826	S	S	*	*			trans	-69.6	145.7	163	0	0	0	0	0	112.9
10	A	30.8	Very low	30.7	Very low	99 Å²	99	127.1 Å²	127.1	82%	0.818	83%	0.828	S	S	*	*			trans	-135.4	110.1	158	0	0	0	0	0	106.9	G12	A10-G12 PolarHBondContact O-N 2.85Å
11	G	31.9	Very low	30.8	Very low	85 Å²	85	126.2 Å²	126.2	88%	0.876	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-64.2	118.6	171.5	0	0	0	0	0	110.1
12	G	29.8	Very low	31.4	Very low	61 Å²	61	124.4 Å²	124.4	63%	0.629	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-75.6	147.5	162.7	0	0	0	0	0	110.4	A10 Q14	A10-G12 PolarHBondContact O-N 2.85Å; G12-Q14 PolarHBondContact O-N 2.79Å
13	P	30.5	Very low	31.5	Very low	117 Å²	117	122.4 Å²	122.4	76%	0.76	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-63.7	121.5	-170	23.9	-32.1	0	0	0	111.8	H15	P13-H15 PolarHBondContact O-N 3.39Å; P13-H15 VanDerWaalsContact O-N 3.16Å
14	Q	30.5	Very low	32.1	Very low	192 Å²	192	123.2 Å²	123.2	90%	0.897	80%	0.803	S	S	*	*			trans	-66.5	108.4	165.2	-68.8	177	0.1	0	0	107.8	G12	G12-Q14 PolarHBondContact O-N 2.79Å
15	H	30.3	Very low	32.2	Very low	167 Å²	167	124 Å²	124	77%	0.773	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-65.6	128.2	166	-79.6	-83	0	0	0	108.5	P13 V17	P13-H15 PolarHBondContact O-N 3.39Å; P13-H15 VanDerWaalsContact O-N 3.16Å; H15-V17 PolarHBondContact O-N 2.88Å
16	P	31.6	Very low	32.2	Very low	114 Å²	114	123.1 Å²	123.1	74%	0.74	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-64.9	127.6	179.1	23.8	-29.9	0	0	0	109.8	P18	P16-P18 WeakPolarHBondContact O-CD 3.43Å
17	V	34.6	Very low	32.5	Very low	137 Å²	137	122.8 Å²	122.8	83%	0.83	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-59.7	119.9	167.7	-178.5	0	0	0	0	107.4	H15 S19	H15-V17 PolarHBondContact O-N 2.88Å; V17-S19 PolarHBondContact O-N 2.58Å
18	P	31.2	Very low	33.2	Very low	116 Å²	116	129.2 Å²	129.2	75%	0.753	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-66.7	126.8	176.2	-13.8	27.7	0	0	0	109.2	P16 A20	P16-P18 WeakPolarHBondContact O-CD 3.43Å; P18-A20 PolarHBondContact O-N 3.26Å
19	S	31.5	Very low	33.8	Very low	111 Å²	111	129.5 Å²	129.5	78%	0.776	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-53.6	127.2	166	51.4	0	0	0	0	110	V17 S21	V17-S19 PolarHBondContact O-N 2.58Å; S19-S21 PolarHBondContact O-N 2.65Å
20	A	35.1	Very low	34.4	Very low	105 Å²	105	131.9 Å²	131.9	87%	0.868	78%	0.784	S	S	*	*			trans	-53.1	103.2	178.3	0	0	0	0	0	111.2	P18	P18-A20 PolarHBondContact O-N 3.26Å
21	S	31.9	Very low	35.1	Very low	109 Å²	109	133.2 Å²	133.2	76%	0.762	78%	0.784	S	S	*	*			trans	-91.2	122.8	163.8	54.9	0	0	0	0	108.2	S19 G23	S19-S21 PolarHBondContact O-N 2.65Å; S21-G23 PolarHBondContact O-N 2.95Å; S21-G23 VanDerWaalsContact O-N 3.1Å
22	H	44.6	Very low	35.9	Very low	205 Å²	205	136 Å²	136	95%	0.949	77%	0.774	S	S	*	*			trans	-43.6	113.5	171.3	-84.5	-92.2	0	0	0	111.4
23	G	31.2	Very low	36.8	Very low	63 Å²	63	139.7 Å²	139.7	65%	0.649	78%	0.779	S	S	*	*			trans	-123.5	130.3	174.3	0	0	0	0	0	110.1	S21 F25	S21-G23 PolarHBondContact O-N 2.95Å; S21-G23 VanDerWaalsContact O-N 3.1Å; G23-F25 VanDerWaalsContact C-N 3.3Å; G23-F25 PolarHBondContact O-N 3.1Å; G23-F25 VanDerWaalsContact O-N 3.09Å
24	S	40.4	Very low	37.9	Very low	109 Å²	109	139.2 Å²	139.2	76%	0.762	77%	0.767	S	S	*	*	S	Bend	trans	-82.2	59.9	-176.4	62.2	0	0	0	0	112.8
25	F	29.1	Very low	39.4	Very low	179 Å²	179	134 Å²	134	79%	0.785	75%	0.748	S	S	*	*	S	Bend	trans	-144.3	150.1	172.4	-70.9	-81.4	0	0	0	110.6	G23 E27	G23-F25 VanDerWaalsContact C-N 3.3Å; G23-F25 PolarHBondContact O-N 3.1Å; G23-F25 VanDerWaalsContact O-N 3.09Å; F25-E27 PolarHBondContact O-N 3.06Å
26	P	35	Very low	41.9	Very low	99 Å²	99	136.4 Å²	136.4	64%	0.643	75%	0.75	S	S	*	*			trans	-69.4	118.9	-177	-10.2	25.4	0	0	0	110.1	Y28	P26-Y28 HydrophobicContact CB-CD2 3.94Å; P26-Y28 HydrophobicContact CB-CE2 3.86Å; P26-Y28 HydrophobicContact CG-CE2 4.22Å; P26-Y28 PolarHBondContact O-N 3.13Å
27	E	35	Very low	44.7	Very low	191 Å²	191	133 Å²	133	89%	0.893	73%	0.732	S	S	*	*			trans	-64.6	88.6	159.5	-79.3	179.5	156.7	0	0	107.9	F25 E29	F25-E27 PolarHBondContact O-N 3.06Å; E27-E29 VanDerWaalsContact C-N 3.31Å; E27-E29 PolarHBondContact O-N 3.35Å
28	Y	42.5	Very low	47.6	Very low	207 Å²	207	129.2 Å²	129.2	81%	0.812	71%	0.705	S	S	*	*			trans	-72.6	95.1	161.6	-83.2	-83.1	0	0	0	107.6	P26	P26-Y28 HydrophobicContact CB-CD2 3.94Å; P26-Y28 HydrophobicContact CB-CE2 3.86Å; P26-Y28 HydrophobicContact CG-CE2 4.22Å; P26-Y28 PolarHBondContact O-N 3.13Å
29	E	39.8	Very low	50.7	Low	174 Å²	174	127.1 Å²	127.1	81%	0.813	69%	0.685	S	S	*	*			trans	167.2	87.6	140.8	-92.3	173.8	-161.7	0	0	107.2	E27 P31	E27-E29 VanDerWaalsContact C-N 3.31Å; E27-E29 PolarHBondContact O-N 3.35Å; E29-P31 VanDerWaalsContact O-CD 3.22Å; E29-P31 WeakPolarHBondContact O-CD 3.4Å
30	L	44.4	Very low	53.8	Low	129 Å²	129	121.8 Å²	121.8	68%	0.675	65%	0.648	S	S	*	*			trans	-74.8	114.2	156.3	-75.7	169.8	0	0	0	106.4	E32 L33	L30-E32 PolarHBondContact O-N 2.85Å; L30-L33 HydrophobicContact CB-CD1 4.46Å; L30-L33 HydrophobicContact CB-CG 4.28Å
31	P	47.3	Very low	56.7	Low	127 Å²	127	117.1 Å²	117.1	83%	0.825	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	15.1	-175.8	-18.4	33.6	0	0	0	114.9	E29	E29-P31 VanDerWaalsContact O-CD 3.22Å; E29-P31 WeakPolarHBondContact O-CD 3.4Å
32	E	47.6	Very low	59.7	Low	143 Å²	143	113.6 Å²	113.6	67%	0.668	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.3	22.1	-169.6	-67.1	-175.1	177.9	0	0	113.8	L30 H34 T35	L30-E32 PolarHBondContact O-N 2.85Å; E32-H34 PolarHBondContact O-N 3.31Å; E32-H34 VanDerWaalsContact O-N 3.12Å; E32-T35 HydrophobicContact CB-CG2 3.87Å; E32-T35 HydrophobicContact CG-CG2 4.45Å; E32-T35 WeakPolarHBondContact O-CB 3.43Å; E32-T35 VanDerWaalsContact O-CG2 3.24Å; E32-T35 WeakPolarHBondContact O-CG2 3.31Å; E32-T35 PolarHBondContact O-N 3.13Å; E32-T35 PolarHBondContact O-OG1 3.22Å
33	L	48.3	Very low	62	Low	139 Å²	139	106.4 Å²	106.4	73%	0.728	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	-16.2	-175.9	-84.9	158	0	0	0	115.1	L30	L30-L33 HydrophobicContact CB-CD1 4.46Å; L30-L33 HydrophobicContact CB-CG 4.28Å
34	H	53.9	Low	65	Low	107 Å²	107	103.4 Å²	103.4	50%	0.495	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	15.7	178.3	-57.8	-54.4	0	0	0	114.5	E32 K300 L301	E32-H34 PolarHBondContact O-N 3.31Å; E32-H34 VanDerWaalsContact O-N 3.12Å; H34-K300 VanDerWaalsContact O-CD 3.32Å; H34-K300 WeakPolarHBondContact O-CD 3.49Å; H34-L301 PolarHBondContact CE1-O 3.35Å; H34-L301 PolarHBondContact ND1-O 3.26Å
35	T	62.2	Low	67.5	Low	84 Å²	84	104.3 Å²	104.3	52%	0.515	51%	0.514	S	S	.	.			trans	-86	-31.2	-164.7	50.6	0	0	0	0	115.5	E32 K300	E32-T35 HydrophobicContact CB-CG2 3.87Å; E32-T35 HydrophobicContact CG-CG2 4.45Å; E32-T35 WeakPolarHBondContact O-CB 3.43Å; E32-T35 VanDerWaalsContact O-CG2 3.24Å; E32-T35 WeakPolarHBondContact O-CG2 3.31Å; E32-T35 PolarHBondContact O-N 3.13Å; E32-T35 PolarHBondContact O-OG1 3.22Å; T35-K300 WeakPolarHBondContact O-CE 3.43Å
36	R	83.3	Confident	70.5	Confident	216 Å²	216	101.5 Å²	101.5	82%	0.815	51%	0.507	S	S	*	.			trans	-105.7	119	-170.7	-72.1	-174.4	168.9	-174	-2.7	112.5
37	A	90.8	Very high	73.2	Confident	44 Å²	44	102.4 Å²	102.4	36%	0.364	50%	0.498	S	S	.	.			trans	-68.9	141.6	168.9	0	0	0	0	0	110.2	E251 I299 K300	A37-E251 HydrophobicContact CB-CG 4.06Å; A37-I299 CarbonylContact C-O 3.56Å; A37-I299 WeakPolarHBondContact CA-O 3.43Å; A37-K300 HydrophobicContact CB-CG 4.09Å
38	F	93.6	Very high	75.9	Confident	57 Å²	57	97.2 Å²	97.2	25%	0.25	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	154.4	171.4	64	-90.3	0	0	0	110.4	F43 N298 I299 L301 I322	F38-F43 HydrophobicContact CD2-CB 3.89Å; F38-F43 HydrophobicContact CD2-CD2 4.47Å; F38-F43 HydrophobicContact CD2-CG 4.39Å; F38-F43 HydrophobicContact CE2-CB 3.99Å; F38-F43 HydrophobicContact CE2-CD2 4.21Å; F38-F43 HydrophobicContact CE2-CG 4.08Å; F38-N298 CarbonylContact O-C 3.57Å; F38-N298 VanDerWaalsContact O-CA 3.31Å; F38-N298 WeakPolarHBondContact O-CA 3.38Å; F38-I299 WeakPolarHBondContact CD1-O 3.45Å; F38-I299 HydrophobicContact CE1-CG1 4.48Å; F38-I299 HydrophobicContact CE2-CG1 4.4Å; F38-I299 HydrophobicContact CZ-CD1 4.44Å; F38-I299 HydrophobicContact CZ-CG1 4.16Å; F38-I299 PolarHBondContact N-O 2.98Å; F38-I299 PolarHBondContact O-N 2.93Å; F38-L301 HydrophobicContact CE1-CD1 4.26Å; F38-L301 HydrophobicContact CE1-CG 3.9Å; F38-L301 HydrophobicContact CZ-CD1 4.16Å; F38-L301 HydrophobicContact CZ-CD2 4.31Å; F38-L301 HydrophobicContact CZ-CG 3.87Å; F38-I322 HydrophobicContact CE2-CD1 4.08Å; F38-I322 HydrophobicContact CZ-CD1 4.03Å
39	H	97.1	Very high	78	Confident	71 Å²	71	90.7 Å²	90.7	33%	0.329	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	122.8	176.9	-176.4	-102.8	0	0	0	110.3	G41 A42 F43 N295 L297 N298	H39-G41 PolarHBondContact O-N 3.41Å; H39-A42 HydrophobicContact CB-CB 3.99Å; H39-A42 PolarHBondContact ND1-N 2.73Å; H39-A42 VanDerWaalsContact ND1-N 3.11Å; H39-A42 PolarHBondContact O-N 3.33Å; H39-F43 PolarHBondContact O-N 2.77Å; H39-N295 PolarHBondContact CE1-O 3.02Å; H39-N295 PolarHBondContact NE2-O 3.02Å; H39-L297 WeakPolarHBondContact CA-O 3.45Å; H39-N298 WeakPolarHBondContact CA-OD1 3.37Å; H39-N298 WeakPolarHBondContact CB-OD1 3.34Å; H39-N298 PolarHBondContact N-OD1 3.04Å
40	V	96.7	Very high	80.3	Confident	0 Å²	0	92.7 Å²	92.7	0%	0	47%	0.465	C	S	.	.	H	α-helix	trans	-61.4	-48	-173.2	173.9	0	0	0	0	111.7	A42 F43 G44 L176 L178 F294 L297 I299 I322	V40-A42 VanDerWaalsContact C-N 3.29Å; V40-A42 PolarHBondContact O-N 2.97Å; V40-F43 WeakPolarHBondContact O-CB 3.46Å; V40-F43 PolarHBondContact O-N 3.48Å; V40-G44 PolarHBondContact O-N 2.95Å; V40-G44 VanDerWaalsContact O-N 3.08Å; V40-L176 HydrophobicContact CG1-CD1 3.77Å; V40-L176 WeakPolarHBondContact O-CD1 3.38Å; V40-L178 HydrophobicContact CG1-CD2 4.14Å; V40-L178 HydrophobicContact CG2-CD2 4.45Å; V40-F294 VanDerWaalsContact CB-O 3.25Å; V40-F294 WeakPolarHBondContact CB-O 3.15Å; V40-F294 WeakPolarHBondContact CG1-O 3.41Å; V40-L297 HydrophobicContact CG2-CB 4.39Å; V40-L297 PolarHBondContact N-O 3.5Å; V40-I299 HydrophobicContact CG2-CD1 3.99Å; V40-I299 HydrophobicContact CG2-CG1 3.8Å; V40-I299 HydrophobicContact CG2-CG2 4.36Å; V40-I322 HydrophobicContact CG1-CD1 4.35Å; V40-I322 HydrophobicContact CG2-CD1 4.14Å
41	G	95.6	Very high	82.4	Confident	7 Å²	7	89.1 Å²	89.1	7%	0.072	45%	0.446	C	S	.	.	H	α-helix	trans	-63.1	-37	-179.7	0	0	0	0	0	112.5	H39 G44 E45 N295	H39-G41 PolarHBondContact O-N 3.41Å; G41-G44 PolarHBondContact O-N 3.24Å; G41-E45 WeakPolarHBondContact O-CG 3.43Å; G41-E45 PolarHBondContact O-N 2.85Å; G41-N295 WeakPolarHBondContact CA-O 3.46Å; G41-N295 PolarHBondContact N-O 3.32Å
42	A	95.7	Very high	84.2	Confident	34 Å²	34	84.3 Å²	84.3	28%	0.281	42%	0.42	S	S	.	.	H	α-helix	trans	-70.3	-36.2	178.7	0	0	0	0	0	111.3	H39 V40 G44 E45 L46	H39-A42 HydrophobicContact CB-CB 3.99Å; H39-A42 PolarHBondContact ND1-N 2.73Å; H39-A42 VanDerWaalsContact ND1-N 3.11Å; H39-A42 PolarHBondContact O-N 3.33Å; V40-A42 VanDerWaalsContact C-N 3.29Å; V40-A42 PolarHBondContact O-N 2.97Å; A42-G44 VanDerWaalsContact C-N 3.35Å; A42-E45 PolarHBondContact O-N 3.3Å; A42-L46 WeakPolarHBondContact O-CB 3.38Å; A42-L46 VanDerWaalsContact O-CG 3.27Å; A42-L46 WeakPolarHBondContact O-CG 3.4Å; A42-L46 PolarHBondContact O-N 2.82Å
43	F	93.3	Very high	86	Confident	54 Å²	54	83 Å²	83	24%	0.237	42%	0.424	C	S	.	.	H	α-helix	trans	-57.9	-47.8	170.5	169.5	-89.7	0	0	0	110.9	F38 H39 V40 E45 L46 W47 L176 I322	F38-F43 HydrophobicContact CD2-CB 3.89Å; F38-F43 HydrophobicContact CD2-CD2 4.47Å; F38-F43 HydrophobicContact CD2-CG 4.39Å; F38-F43 HydrophobicContact CE2-CB 3.99Å; F38-F43 HydrophobicContact CE2-CD2 4.21Å; F38-F43 HydrophobicContact CE2-CG 4.08Å; H39-F43 PolarHBondContact O-N 2.77Å; V40-F43 WeakPolarHBondContact O-CB 3.46Å; V40-F43 PolarHBondContact O-N 3.48Å; F43-E45 PolarHBondContact O-N 2.71Å; F43-L46 PolarHBondContact O-N 2.97Å; F43-W47 AromaticContact CD1-CD1 3.9Å; F43-W47 AromaticContact CD2-CD1 3.87Å; F43-W47 AromaticContact CD2-NE1 3.79Å; F43-W47 AromaticContact CE1-CD1 3.57Å; F43-W47 AromaticContact CE1-NE1 3.75Å; F43-W47 AromaticContact CE2-CD1 3.56Å; F43-W47 AromaticContact CE2-NE1 3.08Å; F43-W47 AromaticContact CZ-CD1 3.41Å; F43-W47 VanDerWaalsContact CZ-CD1 3.41Å; F43-W47 AromaticContact CZ-NE1 3.07Å; F43-W47 VanDerWaalsContact O-CD1 3.29Å; F43-W47 PolarHBondContact O-N 3.02Å; F43-W47 VanDerWaalsContact O-N 3.09Å; F43-L176 HydrophobicContact CD1-CD1 4.49Å; F43-L176 HydrophobicContact CD1-CD2 4.32Å; F43-L176 HydrophobicContact CE1-CD2 4.36Å; F43-I322 HydrophobicContact CD1-CG2 3.98Å; F43-I322 HydrophobicContact CE1-CB 4.23Å; F43-I322 HydrophobicContact CE1-CG2 3.65Å
44	G	92.5	Very high	87.7	Confident	0 Å²	0	87.4 Å²	87.4	0%	0	43%	0.431	C	S	.	.	H	α-helix	trans	-62	-42.8	177.2	0	0	0	0	0	113.4	V40 G41 A42 W47 R48	V40-G44 PolarHBondContact O-N 2.95Å; V40-G44 VanDerWaalsContact O-N 3.08Å; G41-G44 PolarHBondContact O-N 3.24Å; A42-G44 VanDerWaalsContact C-N 3.35Å; G44-W47 PolarHBondContact O-N 3.17Å; G44-R48 WeakPolarHBondContact O-CG 3.46Å; G44-R48 PolarHBondContact O-N 3.33Å
45	E	93.4	Very high	89.2	Confident	128 Å²	128	87.5 Å²	87.5	60%	0.598	44%	0.435	S	S	*	.	H	α-helix	trans	-61.4	-43.5	176.1	-72.5	174.8	175.3	0	0	112.7	G41 A42 F43 W47 R48 G49	G41-E45 WeakPolarHBondContact O-CG 3.43Å; G41-E45 PolarHBondContact O-N 2.85Å; A42-E45 PolarHBondContact O-N 3.3Å; F43-E45 PolarHBondContact O-N 2.71Å; E45-W47 VanDerWaalsContact C-N 3.34Å; E45-W47 PolarHBondContact O-N 2.74Å; E45-R48 PolarHBondContact O-N 3.38Å; E45-G49 PolarHBondContact O-N 3.16Å
46	L	92.8	Very high	90.5	Very high	121 Å²	121	84.6 Å²	84.6	63%	0.634	42%	0.416	S	S	*	.	H	α-helix	trans	-64.1	-39	178.1	-73.3	170.9	0	0	0	112	A42 F43 G49 R50	A42-L46 WeakPolarHBondContact O-CB 3.38Å; A42-L46 VanDerWaalsContact O-CG 3.27Å; A42-L46 WeakPolarHBondContact O-CG 3.4Å; A42-L46 PolarHBondContact O-N 2.82Å; F43-L46 PolarHBondContact O-N 2.97Å; L46-G49 PolarHBondContact O-N 3.5Å; L46-R50 WeakPolarHBondContact O-CG 3.21Å; L46-R50 PolarHBondContact O-N 3.38Å
47	W	90.8	Very high	90.9	Very high	118 Å²	118	76.3 Å²	76.3	45%	0.447	39%	0.391	S	S	.	.	H	α-helix	trans	-67.4	-47.8	174.8	-85.9	104.7	0	0	0	112.1	F43 G44 E45 G49 R50 L51 L324	F43-W47 AromaticContact CD1-CD1 3.9Å; F43-W47 AromaticContact CD2-CD1 3.87Å; F43-W47 AromaticContact CD2-NE1 3.79Å; F43-W47 AromaticContact CE1-CD1 3.57Å; F43-W47 AromaticContact CE1-NE1 3.75Å; F43-W47 AromaticContact CE2-CD1 3.56Å; F43-W47 AromaticContact CE2-NE1 3.08Å; F43-W47 AromaticContact CZ-CD1 3.41Å; F43-W47 VanDerWaalsContact CZ-CD1 3.41Å; F43-W47 AromaticContact CZ-NE1 3.07Å; F43-W47 VanDerWaalsContact O-CD1 3.29Å; F43-W47 PolarHBondContact O-N 3.02Å; F43-W47 VanDerWaalsContact O-N 3.09Å; G44-W47 PolarHBondContact O-N 3.17Å; E45-W47 VanDerWaalsContact C-N 3.34Å; E45-W47 PolarHBondContact O-N 2.74Å; W47-G49 PolarHBondContact O-N 3.19Å; W47-R50 PolarHBondContact O-N 3.48Å; W47-L51 HydrophobicContact CE3-CD1 4.08Å; W47-L51 HydrophobicContact CE3-CG 4.27Å; W47-L51 WeakPolarHBondContact O-CG 3.3Å; W47-L51 PolarHBondContact O-N 3.24Å; W47-L324 HydrophobicContact CB-CD1 4.16Å
48	R	91.6	Very high	90.8	Very high	82 Å²	82	75 Å²	75	31%	0.309	38%	0.378	S	S	.	.	H	α-helix	trans	-59.2	-31.9	174.9	-72.8	-173.2	-65.1	-100.7	1.5	112.7	G44 E45 R50 L56 G174 L324	G44-R48 WeakPolarHBondContact O-CG 3.46Å; G44-R48 PolarHBondContact O-N 3.33Å; E45-R48 PolarHBondContact O-N 3.38Å; R48-R50 VanDerWaalsContact C-N 3.33Å; R48-L56 HydrophobicContact CB-CD1 4.41Å; R48-L56 HydrophobicContact CG-CD1 4.19Å; R48-L56 HydrophobicContact CG-CD2 4.39Å; R48-G174 PolarHBondContact NH1-O 2.99Å; R48-L324 HydrophobicContact CG-CD2 4.33Å
49	G	88.2	Confident	90.4	Very high	69 Å²	69	76.2 Å²	76.2	71%	0.711	39%	0.394	S	S	*	.	H	α-helix	trans	-74.2	-19.5	175.7	0	0	0	0	0	114.7	E45 L46 W47	E45-G49 PolarHBondContact O-N 3.16Å; L46-G49 PolarHBondContact O-N 3.5Å; W47-G49 PolarHBondContact O-N 3.19Å
50	R	88	Confident	89.1	Confident	217 Å²	217	78.8 Å²	78.8	82%	0.819	41%	0.406	S	S	*	.	H	α-helix	trans	-95.4	-28.2	177.3	-73.4	-168.4	-179.3	-162.8	2.1	113.5	L46 W47 R48	L46-R50 WeakPolarHBondContact O-CG 3.21Å; L46-R50 PolarHBondContact O-N 3.38Å; W47-R50 PolarHBondContact O-N 3.48Å; R48-R50 VanDerWaalsContact C-N 3.33Å
51	L	87.8	Confident	87.4	Confident	53 Å²	53	83.3 Å²	83.3	28%	0.277	44%	0.435	S	S	.	.	S	Bend	trans	-89.8	147.9	-177.1	-66.4	177.6	0	0	0	111.4	W47 D55 L56 L324	W47-L51 HydrophobicContact CE3-CD1 4.08Å; W47-L51 HydrophobicContact CE3-CG 4.27Å; W47-L51 WeakPolarHBondContact O-CG 3.3Å; W47-L51 PolarHBondContact O-N 3.24Å; L51-D55 HydrophobicContact CB-CB 4Å; L51-D55 HydrophobicContact CD2-CB 4.13Å; L51-D55 HydrophobicContact CG-CB 4.43Å; L51-L56 HydrophobicContact CB-CD2 4.25Å; L51-L56 HydrophobicContact CB-CG 4.35Å; L51-L56 HydrophobicContact CD1-CD2 4.04Å; L51-L324 HydrophobicContact CD1-CD1 3.36Å
52	G	84.6	Confident	85.2	Confident	26 Å²	26	91.7 Å²	91.7	27%	0.268	47%	0.472	S	S	.	.			trans	-83.2	167.9	175.6	0	0	0	0	0	112.4	R54 D55 L56	G52-R54 PolarHBondContact O-N 2.82Å; G52-R54 VanDerWaalsContact O-N 3.13Å; G52-D55 PolarHBondContact N-OD2 3.4Å; G52-D55 PolarHBondContact O-N 3.04Å; G52-L56 PolarHBondContact O-N 3.46Å
53	P	85.5	Confident	82.5	Confident	115 Å²	115	94.4 Å²	94.4	75%	0.747	50%	0.495	S	S	*	.	H	α-helix	trans	-57.2	-28.3	175.6	-25.7	34.6	0	0	0	114.1	S57	P53-S57 PolarHBondContact O-N 2.84Å
54	R	85.3	Confident	80	Confident	232 Å²	232	98.2 Å²	98.2	88%	0.875	52%	0.522	S	S	*	.	H	α-helix	trans	-68.7	-36.3	176.7	-71.4	-173.5	175.2	-167.3	-3.1	112.5	G52 L56 S57	G52-R54 PolarHBondContact O-N 2.82Å; G52-R54 VanDerWaalsContact O-N 3.13Å; R54-L56 VanDerWaalsContact C-N 3.31Å; R54-S57 WeakPolarHBondContact O-CB 3.47Å; R54-S57 PolarHBondContact O-N 3.37Å
55	D	84.9	Confident	77.1	Confident	109 Å²	109	101.5 Å²	101.5	58%	0.583	55%	0.55	S	S	*	.	H	α-helix	trans	-75.5	-24.5	-177.8	-52	-46.6	0	0	0	112.1	L51 G52	L51-D55 HydrophobicContact CB-CB 4Å; L51-D55 HydrophobicContact CD2-CB 4.13Å; L51-D55 HydrophobicContact CG-CB 4.43Å; G52-D55 PolarHBondContact N-OD2 3.4Å; G52-D55 PolarHBondContact O-N 3.04Å
56	L	89.7	Confident	74.4	Confident	24 Å²	24	104.5 Å²	104.5	13%	0.126	56%	0.564	C	S	.	*	H	α-helix	trans	-93.8	-8.5	178.8	-59.2	178.3	0	0	0	113.2	R48 L51 G52 R54 L58 E173 L324	R48-L56 HydrophobicContact CB-CD1 4.41Å; R48-L56 HydrophobicContact CG-CD1 4.19Å; R48-L56 HydrophobicContact CG-CD2 4.39Å; L51-L56 HydrophobicContact CB-CD2 4.25Å; L51-L56 HydrophobicContact CB-CG 4.35Å; L51-L56 HydrophobicContact CD1-CD2 4.04Å; G52-L56 PolarHBondContact O-N 3.46Å; R54-L56 VanDerWaalsContact C-N 3.31Å; L56-L58 PolarHBondContact O-N 2.91Å; L56-E173 HydrophobicContact CB-CB 4.47Å; L56-E173 WeakPolarHBondContact O-CB 3.41Å; L56-E173 WeakPolarHBondContact O-CG 3.4Å; L56-L324 HydrophobicContact CD2-CD1 3.76Å
57	S	90.6	Very high	71.6	Confident	42 Å²	42	106.8 Å²	106.8	29%	0.294	57%	0.571	S	S	.	*			trans	-63.4	127.7	-174	166.5	0	0	0	0	111.3	P53 R54 S59 E173	P53-S57 PolarHBondContact O-N 2.84Å; R54-S57 WeakPolarHBondContact O-CB 3.47Å; R54-S57 PolarHBondContact O-N 3.37Å; S57-S59 PolarHBondContact OG-N 3.49Å; S57-E173 WeakPolarHBondContact CA-OE1 3.39Å
58	L	89.8	Confident	69	Low	16 Å²	16	106 Å²	106	8%	0.084	59%	0.589	C	S	.	*			trans	-92.8	-0.1	172.5	-64.6	176.9	0	0	0	113.2	L56 I171 E173 V325 H327 L331	L56-L58 PolarHBondContact O-N 2.91Å; L58-I171 VanDerWaalsContact CD1-O 3.3Å; L58-I171 WeakPolarHBondContact CD1-O 3.25Å; L58-E173 HydrophobicContact CB-CG 4.42Å; L58-E173 HydrophobicContact CD1-CG 4.14Å; L58-E173 HydrophobicContact CG-CG 4.01Å; L58-E173 PolarHBondContact N-OE1 3.44Å; L58-V325 HydrophobicContact CD1-CG1 4.2Å; L58-V325 HydrophobicContact CD2-CB 4.48Å; L58-V325 HydrophobicContact CD2-CG1 4.01Å; L58-V325 HydrophobicContact CD2-CG2 3.97Å; L58-H327 WeakPolarHBondContact O-CB 3.34Å; L58-L331 HydrophobicContact CB-CD1 4.3Å; L58-L331 HydrophobicContact CD1-CD2 4.17Å; L58-L331 HydrophobicContact CD2-CD2 4.04Å
59	S	84.3	Confident	66.2	Low	82 Å²	82	108.9 Å²	108.9	57%	0.573	61%	0.611	S	S	*	*	S	Bend	trans	-70.5	134.6	169.8	-60.1	0	0	0	0	109.5	S57	S57-S59 PolarHBondContact OG-N 3.49Å
60	E	69.6	Low	64	Low	126 Å²	126	109.8 Å²	109.8	59%	0.589	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-53.5	130.3	169.1	-81.1	161.9	-137.6	0	0	108.6	Q62 K163	E60-Q62 PolarHBondContact O-N 2.94Å; E60-K163 IonicContact OE1-NZ 3.84Å; E60-K163 PolarHBondContact OE1-NZ 3.24Å
61	P	62.5	Low	61.4	Low	94 Å²	94	102.6 Å²	102.6	61%	0.61	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-56.4	118.3	169.8	22.5	-30	0	0	0	105.4	A63 H327	P61-A63 PolarHBondContact O-N 3.31Å; P61-H327 WeakPolarHBondContact CD-CD2 3.18Å; P61-H327 WeakPolarHBondContact CD-NE2 3.44Å
62	Q	48.4	Very low	59.1	Low	184 Å²	184	105 Å²	105	86%	0.86	64%	0.641	S	S	*	*			trans	-51	109.3	175.3	-73.7	-178	-10.7	0	0	105.8	E60 V64	E60-Q62 PolarHBondContact O-N 2.94Å; Q62-V64 PolarHBondContact O-N 3.42Å
63	A	39.9	Very low	57.3	Low	91 Å²	91	107.6 Å²	107.6	75%	0.752	66%	0.655	S	S	*	*			trans	-44.8	113.8	179.4	0	0	0	0	0	105.3	P61 A65	P61-A63 PolarHBondContact O-N 3.31Å; A63-A65 VanDerWaalsContact C-N 3.26Å; A63-A65 PolarHBondContact O-N 3.08Å
64	V	39.1	Very low	55.9	Low	133 Å²	133	107.1 Å²	107.1	81%	0.806	65%	0.646	S	S	*	*			trans	-38.4	100.6	-170.8	177.5	0	0	0	0	106.1	Q62 Q66	Q62-V64 PolarHBondContact O-N 3.42Å; V64-Q66 VanDerWaalsContact C-N 3.33Å; V64-Q66 PolarHBondContact O-N 3.02Å
65	A	33.3	Very low	54.9	Low	70 Å²	70	100.3 Å²	100.3	58%	0.579	63%	0.628	S	S	*	*			trans	-56.9	116.7	174	0	0	0	0	0	101	A63 Q67	A63-A65 VanDerWaalsContact C-N 3.26Å; A63-A65 PolarHBondContact O-N 3.08Å; A65-Q67 PolarHBondContact O-N 3.34Å
66	Q	35.5	Very low	54.2	Low	191 Å²	191	96.6 Å²	96.6	89%	0.893	62%	0.615	S	S	*	*			trans	-57.8	82	171.1	-73.1	172.7	-21.5	0	0	105.5	V64 A68	V64-Q66 VanDerWaalsContact C-N 3.33Å; V64-Q66 PolarHBondContact O-N 3.02Å; Q66-A68 PolarHBondContact O-N 2.94Å
67	Q	34.7	Very low	53.4	Low	169 Å²	169	101.4 Å²	101.4	79%	0.79	64%	0.64	S	S	*	*			trans	-74.9	83.4	167	-78.3	-167.4	5.6	0	0	103.3	A65 D69	A65-Q67 PolarHBondContact O-N 3.34Å; Q67-D69 PolarHBondContact O-N 2.83Å
68	A	35.3	Very low	52.7	Low	101 Å²	101	104.3 Å²	104.3	84%	0.835	65%	0.649	S	S	*	*			trans	-61.9	68.4	150.6	0	0	0	0	0	108.1	Q66	Q66-A68 PolarHBondContact O-N 2.94Å
69	D	34.3	Very low	52.5	Low	142 Å²	142	104.3 Å²	104.3	76%	0.759	65%	0.649	S	S	*	*	S	Bend	trans	-161.4	98.1	155	-138.5	3.8	0	0	0	112.5	Q67 G71	Q67-D69 PolarHBondContact O-N 2.83Å; D69-G71 VanDerWaalsContact C-N 3.31Å; D69-G71 PolarHBondContact O-N 2.93Å
70	G	42.1	Very low	52.5	Low	89 Å²	89	101.6 Å²	101.6	92%	0.918	63%	0.632	S	S	*	*			trans	53.1	12.5	130.6	0	0	0	0	0	122.8
71	G	32.5	Very low	53.1	Low	65 Å²	65	97 Å²	97	67%	0.67	62%	0.615	S	S	*	*			trans	-97.3	138.7	179.7	0	0	0	0	0	114.1	D69 S73	D69-G71 VanDerWaalsContact C-N 3.31Å; D69-G71 PolarHBondContact O-N 2.93Å; G71-S73 PolarHBondContact O-N 2.92Å
72	A	39.3	Very low	54.2	Low	104 Å²	104	95.1 Å²	95.1	86%	0.86	60%	0.602	S	S	*	*	S	Bend	trans	-47.4	117.7	-175.8	0	0	0	0	0	115.4	D74	A72-D74 PolarHBondContact O-N 3.1Å
73	S	47	Very low	56	Low	80 Å²	80	86.9 Å²	86.9	56%	0.559	57%	0.565	S	S	*	*			trans	0.4	90.7	173.9	67.1	0	0	0	0	119.3	G71 N75 G76	G71-S73 PolarHBondContact O-N 2.92Å; S73-N75 PolarHBondContact O-N 3.25Å; S73-G76 PolarHBondContact O-N 3.37Å
74	D	56.4	Low	58.2	Low	105 Å²	105	91 Å²	91	56%	0.561	56%	0.561	S	S	*	*	H	α-helix	trans	-54.2	-38.7	160.3	-158.9	16	0	0	0	111.2	A72 G76 L77 E78	A72-D74 PolarHBondContact O-N 3.1Å; D74-G76 PolarHBondContact O-N 2.96Å; D74-G76 VanDerWaalsContact O-N 3.1Å; D74-L77 WeakPolarHBondContact O-CB 3.47Å; D74-L77 PolarHBondContact O-N 2.91Å; D74-E78 PolarHBondContact O-N 3.09Å; D74-E78 VanDerWaalsContact O-N 3.13Å
75	N	63.4	Low	60.3	Low	90 Å²	90	91.1 Å²	91.1	48%	0.481	56%	0.557	S	S	.	*	H	α-helix	trans	-48.5	-37.3	171	-70	4.8	0	0	0	114.4	S73 D79 R97	S73-N75 PolarHBondContact O-N 3.25Å; N75-D79 WeakPolarHBondContact O-CB 3.41Å; N75-D79 PolarHBondContact O-N 3.38Å; N75-R97 VanDerWaalsContact CB-NH1 3.31Å; N75-R97 PolarHBondContact O-NH1 2.96Å
76	G	69.8	Low	62.8	Low	30 Å²	30	93.2 Å²	93.2	31%	0.309	56%	0.558	S	S	.	*	H	α-helix	trans	-74.6	-27.4	-179.8	0	0	0	0	0	113.2	S73 D74 A80	S73-G76 PolarHBondContact O-N 3.37Å; D74-G76 PolarHBondContact O-N 2.96Å; D74-G76 VanDerWaalsContact O-N 3.1Å; G76-A80 VanDerWaalsContact O-CB 3.31Å; G76-A80 WeakPolarHBondContact O-CB 3.28Å; G76-A80 PolarHBondContact O-N 3.35Å; G76-A80 VanDerWaalsContact O-N 3.17Å
77	L	72.9	Confident	65.3	Low	126 Å²	126	87.4 Å²	87.4	66%	0.66	55%	0.549	S	S	*	.	H	α-helix	trans	-76.3	-39.1	174.8	-70.6	168.6	0	0	0	111.1	D74 A80 A81	D74-L77 WeakPolarHBondContact O-CB 3.47Å; D74-L77 PolarHBondContact O-N 2.91Å; L77-A80 PolarHBondContact O-N 3.01Å; L77-A81 PolarHBondContact O-N 2.85Å
78	E	76.6	Confident	68	Low	103 Å²	103	81.3 Å²	81.3	48%	0.481	53%	0.525	S	S	.	.	H	α-helix	trans	-64.8	-47	173.4	-67.1	-176.7	159.4	0	0	111.7	D74 A80 A81 V82	D74-E78 PolarHBondContact O-N 3.09Å; D74-E78 VanDerWaalsContact O-N 3.13Å; E78-A80 PolarHBondContact O-N 3.48Å; E78-A81 WeakPolarHBondContact O-CB 3.49Å; E78-A81 PolarHBondContact O-N 3.15Å; E78-V82 WeakPolarHBondContact O-CG2 3.49Å; E78-V82 PolarHBondContact O-N 3.44Å
79	D	85.2	Confident	70.7	Confident	16 Å²	16	79.5 Å²	79.5	9%	0.086	51%	0.506	C	S	.	.	H	α-helix	trans	-59	-39.1	175.3	-73.2	-22.9	0	0	0	111.6	N75 A81 V82 A83 L90 A93 R97	N75-D79 WeakPolarHBondContact O-CB 3.41Å; N75-D79 PolarHBondContact O-N 3.38Å; D79-A81 VanDerWaalsContact C-N 3.32Å; D79-A81 PolarHBondContact O-N 3.1Å; D79-V82 PolarHBondContact O-N 2.64Å; D79-A83 WeakPolarHBondContact O-CB 3.28Å; D79-A83 PolarHBondContact O-N 3.29Å; D79-L90 HydrophobicContact CB-CD2 4.47Å; D79-A93 HydrophobicContact CB-CB 4.18Å; D79-A93 VanDerWaalsContact O-CB 3.25Å; D79-A93 WeakPolarHBondContact O-CB 3.48Å; D79-R97 VanDerWaalsContact CG-CZ 3.46Å; D79-R97 IonicContact OD1-CZ 2.92Å; D79-R97 IonicContact OD1-NE 3.55Å; D79-R97 IonicContact OD1-NH1 2.65Å; D79-R97 PolarHBondContact OD1-NH1 2.91Å; D79-R97 IonicContact OD1-NH2 3.44Å; D79-R97 PolarHBondContact OD1-NH2 3.26Å; D79-R97 IonicContact OD2-CZ 3.08Å; D79-R97 IonicContact OD2-NH1 2.73Å; D79-R97 PolarHBondContact OD2-NH1 3.41Å; D79-R97 IonicContact OD2-NH2 3.33Å; D79-R97 PolarHBondContact OD2-NH2 2.78Å
80	A	85	Confident	73.5	Confident	25 Å²	25	77.8 Å²	77.8	21%	0.207	50%	0.497	C	S	.	.	H	α-helix	trans	-67.8	-31.7	176.4	0	0	0	0	0	112.8	G76 L77 E78 R84 L90	G76-A80 VanDerWaalsContact O-CB 3.31Å; G76-A80 WeakPolarHBondContact O-CB 3.28Å; G76-A80 PolarHBondContact O-N 3.35Å; G76-A80 VanDerWaalsContact O-N 3.17Å; L77-A80 PolarHBondContact O-N 3.01Å; E78-A80 PolarHBondContact O-N 3.48Å; A80-R84 VanDerWaalsContact O-CG 3.28Å; A80-R84 WeakPolarHBondContact O-CG 3.39Å; A80-R84 PolarHBondContact O-N 3.27Å; A80-L90 HydrophobicContact CB-CD2 3.87Å
81	A	82.5	Confident	75.8	Confident	29 Å²	29	81.2 Å²	81.2	24%	0.24	49%	0.489	C	S	.	.	H	α-helix	trans	-69.3	-51.4	172.9	0	0	0	0	0	110.9	L77 E78 D79 A83 R84 D85	L77-A81 PolarHBondContact O-N 2.85Å; E78-A81 WeakPolarHBondContact O-CB 3.49Å; E78-A81 PolarHBondContact O-N 3.15Å; D79-A81 VanDerWaalsContact C-N 3.32Å; D79-A81 PolarHBondContact O-N 3.1Å; A81-A83 VanDerWaalsContact C-N 3.31Å; A81-A83 PolarHBondContact O-N 2.84Å; A81-R84 WeakPolarHBondContact O-CB 3.47Å; A81-R84 PolarHBondContact O-N 3.17Å; A81-R84 VanDerWaalsContact O-N 3.08Å; A81-D85 PolarHBondContact O-N 3.28Å
82	V	84.1	Confident	78.5	Confident	55 Å²	55	79.4 Å²	79.4	33%	0.333	47%	0.468	S	S	.	.	H	α-helix	trans	-57.5	-44	177.5	173.9	0	0	0	0	111.5	E78 D79 R84 D85 L86 A93	E78-V82 WeakPolarHBondContact O-CG2 3.49Å; E78-V82 PolarHBondContact O-N 3.44Å; D79-V82 PolarHBondContact O-N 2.64Å; V82-R84 VanDerWaalsContact C-N 3.33Å; V82-R84 PolarHBondContact O-N 3.43Å; V82-D85 PolarHBondContact O-N 3Å; V82-L86 HydrophobicContact CG1-CD1 3.69Å; V82-L86 HydrophobicContact CG1-CG 4.37Å; V82-L86 WeakPolarHBondContact O-CB 3.16Å; V82-L86 PolarHBondContact O-N 2.86Å; V82-A93 HydrophobicContact CB-CB 4.09Å; V82-A93 HydrophobicContact CG1-CB 3.94Å
83	A	87.8	Confident	80.9	Confident	10 Å²	10	74.5 Å²	74.5	8%	0.083	43%	0.427	C	S	.	.	H	α-helix	trans	-60.8	-40.2	177.1	0	0	0	0	0	112.5	D79 A81 G87 C88 L90 A93	D79-A83 WeakPolarHBondContact O-CB 3.28Å; D79-A83 PolarHBondContact O-N 3.29Å; A81-A83 VanDerWaalsContact C-N 3.31Å; A81-A83 PolarHBondContact O-N 2.84Å; A83-G87 CarbonylContact O-C 3.48Å; A83-G87 VanDerWaalsContact O-CA 3.27Å; A83-G87 WeakPolarHBondContact O-CA 3.13Å; A83-G87 PolarHBondContact O-N 2.95Å; A83-C88 WeakPolarHBondContact CB-O 3.27Å; A83-C88 PolarHBondContact O-N 3.42Å; A83-L90 HydrophobicContact CB-CD2 4.07Å; A83-A93 HydrophobicContact CB-CB 3.9Å
84	R	86.4	Confident	82.9	Confident	178 Å²	178	72 Å²	72	67%	0.672	41%	0.411	S	S	*	.	H	α-helix	trans	-68	-45.2	175.7	-75.8	-172.6	-49.1	-110.9	-0.1	111.9	A80 A81 V82 G87	A80-R84 VanDerWaalsContact O-CG 3.28Å; A80-R84 WeakPolarHBondContact O-CG 3.39Å; A80-R84 PolarHBondContact O-N 3.27Å; A81-R84 WeakPolarHBondContact O-CB 3.47Å; A81-R84 PolarHBondContact O-N 3.17Å; A81-R84 VanDerWaalsContact O-N 3.08Å; V82-R84 VanDerWaalsContact C-N 3.33Å; V82-R84 PolarHBondContact O-N 3.43Å; R84-G87 PolarHBondContact O-N 2.75Å
85	D	81.4	Confident	84.5	Confident	135 Å²	135	73.3 Å²	73.3	72%	0.722	41%	0.414	S	S	*	.	H	α-helix	trans	-71.9	-39.5	-172.8	-66.2	-11.1	0	0	0	111.9	A81 V82	A81-D85 PolarHBondContact O-N 3.28Å; V82-D85 PolarHBondContact O-N 3Å
86	L	85.8	Confident	85.6	Confident	114 Å²	114	72.3 Å²	72.3	60%	0.597	41%	0.408	S	S	*	.	H	α-helix	trans	-87.2	-6.6	176.3	-62.3	177.9	0	0	0	113.3	V82 C88 L96	V82-L86 HydrophobicContact CG1-CD1 3.69Å; V82-L86 HydrophobicContact CG1-CG 4.37Å; V82-L86 WeakPolarHBondContact O-CB 3.16Å; V82-L86 PolarHBondContact O-N 2.86Å; L86-C88 VanDerWaalsContact C-N 3.29Å; L86-C88 PolarHBondContact O-N 2.9Å; L86-L96 HydrophobicContact CD1-CD1 3.66Å
87	G	88.6	Confident	86.4	Confident	69 Å²	69	74.7 Å²	74.7	71%	0.711	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	34.9	-176.1	0	0	0	0	0	113.4	A83 R84	A83-G87 CarbonylContact O-C 3.48Å; A83-G87 VanDerWaalsContact O-CA 3.27Å; A83-G87 WeakPolarHBondContact O-CA 3.13Å; A83-G87 PolarHBondContact O-N 2.95Å; R84-G87 PolarHBondContact O-N 2.75Å
88	C	91.1	Very high	87	Confident	42 Å²	42	72.8 Å²	72.8	28%	0.284	40%	0.401	S	S	.	.			trans	-111	175.1	-177.9	72.9	0	0	0	0	112.5	A83 L86 A92	A83-C88 WeakPolarHBondContact CB-O 3.27Å; A83-C88 PolarHBondContact O-N 3.42Å; L86-C88 VanDerWaalsContact C-N 3.29Å; L86-C88 PolarHBondContact O-N 2.9Å; C88-A92 HydrophobicContact CB-CB 4.13Å
89	S	92.9	Very high	87.4	Confident	63 Å²	63	72.1 Å²	72.1	44%	0.441	40%	0.404	S	S	.	.			trans	-74.1	155.9	176.4	66.7	0	0	0	0	111.2	E91 A92 A93	S89-E91 PolarHBondContact O-N 3.46Å; S89-A92 PolarHBondContact O-N 3.24Å; S89-A92 VanDerWaalsContact O-N 3.09Å; S89-A92 WeakPolarHBondContact OG-CB 3.25Å; S89-A92 PolarHBondContact OG-N 3.41Å; S89-A92 VanDerWaalsContact OG-N 3.1Å; S89-A93 PolarHBondContact O-N 3.12Å
90	L	92.1	Very high	87.2	Confident	106 Å²	106	75.9 Å²	75.9	56%	0.555	43%	0.431	S	S	*	.	H	α-helix	trans	-57.4	-34	172.9	-75.2	170.9	0	0	0	112.3	D79 A80 A83 A93 A94	D79-L90 HydrophobicContact CB-CD2 4.47Å; A80-L90 HydrophobicContact CB-CD2 3.87Å; A83-L90 HydrophobicContact CB-CD2 4.07Å; L90-A93 PolarHBondContact O-N 2.93Å; L90-A94 WeakPolarHBondContact O-CB 3.37Å; L90-A94 PolarHBondContact O-N 3.48Å
91	E	90	Very high	86.8	Confident	160 Å²	160	75.3 Å²	75.3	75%	0.748	43%	0.427	S	S	*	.	H	α-helix	trans	-65.7	-44	175.7	-66.2	166.8	178.6	0	0	111.2	S89 A94 E95	S89-E91 PolarHBondContact O-N 3.46Å; E91-A94 PolarHBondContact O-N 3.06Å; E91-E95 WeakPolarHBondContact O-CB 3.4Å; E91-E95 PolarHBondContact O-N 3.46Å
92	A	89.6	Confident	86.4	Confident	28 Å²	28	81.1 Å²	81.1	23%	0.231	45%	0.453	C	S	.	.	H	α-helix	trans	-66.9	-38	176.3	0	0	0	0	0	111.9	C88 S89 E95 L96	C88-A92 HydrophobicContact CB-CB 4.13Å; S89-A92 PolarHBondContact O-N 3.24Å; S89-A92 VanDerWaalsContact O-N 3.09Å; S89-A92 WeakPolarHBondContact OG-CB 3.25Å; S89-A92 PolarHBondContact OG-N 3.41Å; S89-A92 VanDerWaalsContact OG-N 3.1Å; A92-E95 PolarHBondContact O-N 3.29Å; A92-L96 WeakPolarHBondContact O-CB 3.16Å; A92-L96 VanDerWaalsContact O-CG 3.25Å; A92-L96 WeakPolarHBondContact O-CG 3.38Å; A92-L96 PolarHBondContact O-N 3.48Å
93	A	89.7	Confident	85.9	Confident	1 Å²	1	84 Å²	84	1%	0.008	47%	0.467	C	S	.	.	H	α-helix	trans	-63.8	-42.6	173.6	0	0	0	0	0	112	D79 V82 A83 S89 L90 E95 L96 R97	D79-A93 HydrophobicContact CB-CB 4.18Å; D79-A93 VanDerWaalsContact O-CB 3.25Å; D79-A93 WeakPolarHBondContact O-CB 3.48Å; V82-A93 HydrophobicContact CB-CB 4.09Å; V82-A93 HydrophobicContact CG1-CB 3.94Å; A83-A93 HydrophobicContact CB-CB 3.9Å; S89-A93 PolarHBondContact O-N 3.12Å; L90-A93 PolarHBondContact O-N 2.93Å; A93-E95 VanDerWaalsContact C-N 3.34Å; A93-E95 PolarHBondContact O-N 3.04Å; A93-L96 PolarHBondContact O-N 2.75Å; A93-R97 PolarHBondContact O-N 3.16Å
94	A	89	Confident	85.5	Confident	28 Å²	28	89 Å²	89	23%	0.231	49%	0.487	C	S	.	.	H	α-helix	trans	-64.3	-39.3	175.5	0	0	0	0	0	112.1	L90 E91 V98	L90-A94 WeakPolarHBondContact O-CB 3.37Å; L90-A94 PolarHBondContact O-N 3.48Å; E91-A94 PolarHBondContact O-N 3.06Å; A94-V98 WeakPolarHBondContact O-CG2 3.48Å; A94-V98 PolarHBondContact O-N 3.02Å
95	E	89.9	Confident	84.7	Confident	132 Å²	132	86 Å²	86	62%	0.617	48%	0.483	S	S	*	.	H	α-helix	trans	-63.3	-46.7	172.8	-174.6	-179.4	178.7	0	0	111.1	E91 A92 A93 R97 V98 V99	E91-E95 WeakPolarHBondContact O-CB 3.4Å; E91-E95 PolarHBondContact O-N 3.46Å; A92-E95 PolarHBondContact O-N 3.29Å; A93-E95 VanDerWaalsContact C-N 3.34Å; A93-E95 PolarHBondContact O-N 3.04Å; E95-R97 VanDerWaalsContact C-N 3.32Å; E95-R97 PolarHBondContact O-N 3.38Å; E95-V98 WeakPolarHBondContact O-CB 3.25Å; E95-V98 PolarHBondContact O-N 3.03Å; E95-V99 HydrophobicContact CG-CG2 4.26Å; E95-V99 WeakPolarHBondContact O-CG2 3.4Å; E95-V99 PolarHBondContact O-N 3.13Å
96	L	86.7	Confident	83.8	Confident	69 Å²	69	89.4 Å²	89.4	36%	0.361	49%	0.486	S	S	.	.	H	α-helix	trans	-57.5	-43	177.1	-77.8	170.3	0	0	0	111.9	L86 A92 A93 V98 V99 C100	L86-L96 HydrophobicContact CD1-CD1 3.66Å; A92-L96 WeakPolarHBondContact O-CB 3.16Å; A92-L96 VanDerWaalsContact O-CG 3.25Å; A92-L96 WeakPolarHBondContact O-CG 3.38Å; A92-L96 PolarHBondContact O-N 3.48Å; A93-L96 PolarHBondContact O-N 2.75Å; L96-V98 VanDerWaalsContact C-N 3.28Å; L96-V98 PolarHBondContact O-N 2.76Å; L96-V99 PolarHBondContact O-N 2.9Å; L96-C100 WeakPolarHBondContact O-CA 3.35Å; L96-C100 VanDerWaalsContact O-CB 3.22Å; L96-C100 WeakPolarHBondContact O-CB 3.11Å; L96-C100 PolarHBondContact O-N 3.28Å
97	R	86.4	Confident	82.4	Confident	79 Å²	79	89.1 Å²	89.1	30%	0.298	49%	0.493	S	S	.	.	H	α-helix	trans	-60.6	-37.8	174.7	-178.2	-175.2	57.4	-130.7	-21.7	112.2	N75 D79 A93 E95 G101	N75-R97 VanDerWaalsContact CB-NH1 3.31Å; N75-R97 PolarHBondContact O-NH1 2.96Å; D79-R97 VanDerWaalsContact CG-CZ 3.46Å; D79-R97 IonicContact OD1-CZ 2.92Å; D79-R97 IonicContact OD1-NE 3.55Å; D79-R97 IonicContact OD1-NH1 2.65Å; D79-R97 PolarHBondContact OD1-NH1 2.91Å; D79-R97 IonicContact OD1-NH2 3.44Å; D79-R97 PolarHBondContact OD1-NH2 3.26Å; D79-R97 IonicContact OD2-CZ 3.08Å; D79-R97 IonicContact OD2-NH1 2.73Å; D79-R97 PolarHBondContact OD2-NH1 3.41Å; D79-R97 IonicContact OD2-NH2 3.33Å; D79-R97 PolarHBondContact OD2-NH2 2.78Å; A93-R97 PolarHBondContact O-N 3.16Å; E95-R97 VanDerWaalsContact C-N 3.32Å; E95-R97 PolarHBondContact O-N 3.38Å; R97-G101 WeakPolarHBondContact O-CA 3.32Å; R97-G101 PolarHBondContact O-N 3.33Å
98	V	85.9	Confident	80.9	Confident	86 Å²	86	90.8 Å²	90.8	52%	0.521	49%	0.485	S	S	.	.	H	α-helix	trans	-71.6	-37.5	178.6	173.1	0	0	0	0	111.5	A94 E95 L96 K104	A94-V98 WeakPolarHBondContact O-CG2 3.48Å; A94-V98 PolarHBondContact O-N 3.02Å; E95-V98 WeakPolarHBondContact O-CB 3.25Å; E95-V98 PolarHBondContact O-N 3.03Å; L96-V98 VanDerWaalsContact C-N 3.28Å; L96-V98 PolarHBondContact O-N 2.76Å; V98-K104 WeakPolarHBondContact O-CE 3.29Å; V98-K104 VanDerWaalsContact O-CG 3.29Å; V98-K104 WeakPolarHBondContact O-CG 3.09Å
99	V	84.4	Confident	79.8	Confident	90 Å²	90	95 Å²	95	55%	0.545	50%	0.5	S	S	.	.	H	α-helix	trans	-81	-34.1	-177.7	177.6	0	0	0	0	112.1	E95 L96 K104	E95-V99 HydrophobicContact CG-CG2 4.26Å; E95-V99 WeakPolarHBondContact O-CG2 3.4Å; E95-V99 PolarHBondContact O-N 3.13Å; L96-V99 PolarHBondContact O-N 2.9Å; V99-K104 WeakPolarHBondContact O-CG 3.41Å
100	C	81.2	Confident	78.1	Confident	95 Å²	95	102 Å²	102	64%	0.642	53%	0.526	S	S	*	.	S	Bend	trans	-106.4	13.1	-177.7	-56.4	0	0	0	0	112.9	L96	L96-C100 WeakPolarHBondContact O-CA 3.35Å; L96-C100 VanDerWaalsContact O-CB 3.22Å; L96-C100 WeakPolarHBondContact O-CB 3.11Å; L96-C100 PolarHBondContact O-N 3.28Å
101	G	77.7	Confident	76.8	Confident	12 Å²	12	100.9 Å²	100.9	12%	0.124	54%	0.54	C	S	.	.	S	Bend	trans	-66.5	157	-179.4	0	0	0	0	0	112.7	R97 D103 K104	R97-G101 WeakPolarHBondContact O-CA 3.32Å; R97-G101 PolarHBondContact O-N 3.33Å; G101-D103 PolarHBondContact O-N 3.03Å; G101-D103 VanDerWaalsContact O-N 3.15Å; G101-K104 WeakPolarHBondContact O-CB 3.32Å; G101-K104 PolarHBondContact O-N 3.23Å
102	L	73.5	Confident	75.8	Confident	151 Å²	151	97.4 Å²	97.4	79%	0.791	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-58.3	-27	176.6	-65.1	176.5	0	0	0	112.2	K104 L105	L102-K104 PolarHBondContact O-N 3.36Å; L102-L105 HydrophobicContact CD2-CD1 3.63Å; L102-L105 WeakPolarHBondContact O-CB 3.3Å; L102-L105 PolarHBondContact O-N 3.13Å
103	D	74.6	Confident	74.8	Confident	116 Å²	116	100.5 Å²	100.5	62%	0.62	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-68.1	-19.3	174.5	66.6	-62.8	0	0	0	113.6	G101	G101-D103 PolarHBondContact O-N 3.03Å; G101-D103 VanDerWaalsContact O-N 3.15Å
104	K	78.8	Confident	73.7	Confident	115 Å²	115	103.5 Å²	103.5	50%	0.5	56%	0.556	S	S	.	*	G	3₁₀ helix	trans	-90.3	-15.7	174.8	-56.2	-54.4	-179	-152.5	0	112.9	V98 V99 G101 L102 R106	V98-K104 WeakPolarHBondContact O-CE 3.29Å; V98-K104 VanDerWaalsContact O-CG 3.29Å; V98-K104 WeakPolarHBondContact O-CG 3.09Å; V99-K104 WeakPolarHBondContact O-CG 3.41Å; G101-K104 WeakPolarHBondContact O-CB 3.32Å; G101-K104 PolarHBondContact O-N 3.23Å; L102-K104 PolarHBondContact O-N 3.36Å; K104-R106 PolarHBondContact O-N 3.36Å; K104-R106 VanDerWaalsContact O-N 3.13Å
105	L	69.3	Low	72.9	Confident	114 Å²	114	105.9 Å²	105.9	60%	0.597	56%	0.562	S	S	*	*	S	Bend	trans	-68.8	109.1	169.2	-61.7	177.7	0	0	0	107.7	L102 C107	L102-L105 HydrophobicContact CD2-CD1 3.63Å; L102-L105 WeakPolarHBondContact O-CB 3.3Å; L102-L105 PolarHBondContact O-N 3.13Å; L105-C107 PolarHBondContact O-N 2.89Å
106	R	61.7	Low	72.4	Confident	207 Å²	207	104.7 Å²	104.7	78%	0.781	56%	0.564	S	S	*	*			trans	-68.3	102.6	167.4	-79.1	-166.7	-177.4	-143.1	1.5	108.3	K104	K104-R106 PolarHBondContact O-N 3.36Å; K104-R106 VanDerWaalsContact O-N 3.13Å
107	C	57.8	Low	71.9	Confident	109 Å²	109	102.5 Å²	102.5	74%	0.736	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-68.9	140.9	154	-60.8	0	0	0	0	107.5	L105 E109	L105-C107 PolarHBondContact O-N 2.89Å; C107-E109 PolarHBondContact O-N 3.42Å
108	L	57.3	Low	71.6	Confident	104 Å²	104	102.9 Å²	102.9	55%	0.545	57%	0.565	S	S	.	*	P	Polyproline II helix	trans	-49.6	123.5	176.8	-73.4	156.6	0	0	0	109.8	E112 P114	L108-E112 HydrophobicContact CD2-CB 4.02Å; L108-P114 HydrophobicContact CD1-CB 3.99Å; L108-P114 HydrophobicContact CD1-CG 3.94Å; L108-P114 HydrophobicContact CD2-CB 3.89Å; L108-P114 HydrophobicContact CD2-CG 4.35Å
109	E	66.6	Low	70.7	Confident	131 Å²	131	107 Å²	107	61%	0.612	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-67.7	151.6	170	-66.3	-173.9	-177.3	0	0	109.1	C107 G111 E112	C107-E109 PolarHBondContact O-N 3.42Å; E109-G111 PolarHBondContact O-N 3.11Å; E109-E112 HydrophobicContact CB-CG 4.2Å; E109-E112 PolarHBondContact O-N 2.65Å
110	E	57.4	Low	69.9	Low	208 Å²	208	110.1 Å²	110.1	97%	0.972	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.6	110.6	178.3	-81.8	-174	160.7	0	0	110.5
111	G	65	Low	69.3	Low	83 Å²	83	107.2 Å²	107.2	86%	0.856	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	103.4	-1.8	178.5	0	0	0	0	0	115.6	E109	E109-G111 PolarHBondContact O-N 3.11Å
112	E	68.4	Low	69.3	Low	87 Å²	87	114.4 Å²	114.4	41%	0.407	61%	0.607	S	S	.	*			trans	-78	127.5	167.6	-71.2	-171.2	153.9	0	0	110.5	L108 E109	L108-E112 HydrophobicContact CD2-CB 4.02Å; E109-E112 HydrophobicContact CB-CG 4.2Å; E109-E112 PolarHBondContact O-N 2.65Å
113	D	68.7	Low	69.5	Low	93 Å²	93	112.2 Å²	112.2	50%	0.497	60%	0.595	S	S	.	*			trans	-90.8	114.7	174.4	-178.7	-5.2	0	0	0	109.6	E115 V116	D113-E115 PolarHBondContact O-N 3.33Å; D113-E115 VanDerWaalsContact O-N 3.09Å; D113-E115 WeakPolarHBondContact OD1-CB 3.27Å; D113-E115 PolarHBondContact OD1-N 3.17Å; D113-V116 HydrophobicContact CB-CG2 3.86Å; D113-V116 PolarHBondContact O-N 2.96Å; D113-V116 VanDerWaalsContact O-N 3.07Å
114	P	67.9	Low	69.8	Low	65 Å²	65	112 Å²	112	42%	0.422	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64	-11.6	-179.7	26.5	-34.3	0	0	0	114.2	L108 R129	L108-P114 HydrophobicContact CD1-CB 3.99Å; L108-P114 HydrophobicContact CD1-CG 3.94Å; L108-P114 HydrophobicContact CD2-CB 3.89Å; L108-P114 HydrophobicContact CD2-CG 4.35Å; P114-R129 PolarHBondContact O-NH2 3.33Å
115	E	72.5	Confident	69.6	Low	77 Å²	77	111.5 Å²	111.5	36%	0.36	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.7	-7.8	176.1	-58.7	-54.1	151	0	0	113.2	D113 I117 R129 L133	D113-E115 PolarHBondContact O-N 3.33Å; D113-E115 VanDerWaalsContact O-N 3.09Å; D113-E115 WeakPolarHBondContact OD1-CB 3.27Å; D113-E115 PolarHBondContact OD1-N 3.17Å; E115-I117 PolarHBondContact O-N 3.39Å; E115-R129 IonicContact OE1-NH2 3.33Å; E115-R129 PolarHBondContact OE1-NH2 3.33Å; E115-R129 IonicContact OE2-CZ 3.93Å; E115-R129 IonicContact OE2-NE 3.28Å; E115-R129 PolarHBondContact OE2-NE 3.09Å; E115-R129 IonicContact OE2-NH2 2.87Å; E115-R129 PolarHBondContact OE2-NH2 2.99Å; E115-L133 HydrophobicContact CB-CD1 4.17Å; E115-L133 HydrophobicContact CB-CD2 4.28Å; E115-L133 HydrophobicContact CG-CD2 4.32Å; E115-L133 VanDerWaalsContact O-CD1 3.23Å; E115-L133 WeakPolarHBondContact O-CD1 3.42Å; E115-L133 WeakPolarHBondContact OE2-CD1 3.4Å; E115-L133 VanDerWaalsContact OE2-CD2 3.25Å; E115-L133 WeakPolarHBondContact OE2-CD2 2.84Å
116	V	78.3	Confident	70	Confident	107 Å²	107	108.2 Å²	108.2	65%	0.648	59%	0.588	S	S	*	*			trans	-81.1	104.6	175.8	178.4	0	0	0	0	110.2	D113	D113-V116 HydrophobicContact CB-CG2 3.86Å; D113-V116 PolarHBondContact O-N 2.96Å; D113-V116 VanDerWaalsContact O-N 3.07Å
117	I	77.4	Confident	70.8	Confident	24 Å²	24	102 Å²	102	12%	0.123	58%	0.575	C	S	.	*			trans	-85.9	128.3	-180	-61.6	173	0	0	0	110.3	E115 E119 L126 R129 K130 L133	E115-I117 PolarHBondContact O-N 3.39Å; I117-E119 PolarHBondContact O-N 2.98Å; I117-L126 HydrophobicContact CG2-CB 4.04Å; I117-L126 HydrophobicContact CG2-CD2 4.39Å; I117-R129 HydrophobicContact CD1-CB 3.84Å; I117-R129 HydrophobicContact CD1-CG 3.84Å; I117-K130 HydrophobicContact CD1-CB 3.69Å; I117-K130 HydrophobicContact CD1-CG 4.48Å; I117-K130 VanDerWaalsContact CD1-N 3.28Å; I117-L133 HydrophobicContact CD1-CD1 3.81Å; I117-L133 HydrophobicContact CG1-CD1 4.27Å
118	P	79.3	Confident	71.9	Confident	87 Å²	87	101.5 Å²	101.5	57%	0.565	57%	0.568	S	S	*	*			trans	-59.1	134.9	177.6	-23.1	32.7	0	0	0	112.9	N120 T121	P118-N120 VanDerWaalsContact C-N 3.25Å; P118-N120 PolarHBondContact O-N 3.25Å; P118-T121 PolarHBondContact O-OG1 3.41Å
119	E	67.7	Low	72.9	Confident	172 Å²	172	101 Å²	101	80%	0.804	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-25.8	-173.2	-65.4	-176	162.3	0	0	114.6	I117	I117-E119 PolarHBondContact O-N 2.98Å
120	N	66	Low	73.7	Confident	155 Å²	155	99 Å²	99	83%	0.829	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	46.9	-173	-61.9	-41.3	0	0	0	112.6	P118	P118-N120 VanDerWaalsContact C-N 3.25Å; P118-N120 PolarHBondContact O-N 3.25Å
121	T	69.6	Low	74.8	Confident	34 Å²	34	91.1 Å²	91.1	21%	0.209	52%	0.523	C	S	.	.			trans	-107.6	119.7	-176.2	-47.3	0	0	0	0	112.1	P118 L123 L126	P118-T121 PolarHBondContact O-OG1 3.41Å; T121-L123 VanDerWaalsContact C-N 3.27Å; T121-L123 HydrophobicContact CG2-CB 3.68Å; T121-L123 HydrophobicContact CG2-CD1 3.93Å; T121-L123 HydrophobicContact CG2-CG 3.93Å; T121-L123 PolarHBondContact O-N 3.21Å; T121-L126 HydrophobicContact CG2-CB 4Å; T121-L126 HydrophobicContact CG2-CD1 3.32Å; T121-L126 HydrophobicContact CG2-CG 4.23Å
122	D	78.2	Confident	75.5	Confident	163 Å²	163	91.8 Å²	91.8	87%	0.872	51%	0.506	S	S	*	.			trans	-84.3	0.6	175	-60.5	-32.3	0	0	0	113.2	V124	D122-V124 PolarHBondContact O-N 3.3Å
123	L	77.8	Confident	76	Confident	105 Å²	105	89.2 Å²	89.2	55%	0.55	50%	0.495	S	S	.	.			trans	-77.7	116.2	-177.5	-66.3	165.3	0	0	0	110.6	T121 T125 L126 C127	T121-L123 VanDerWaalsContact C-N 3.27Å; T121-L123 HydrophobicContact CG2-CB 3.68Å; T121-L123 HydrophobicContact CG2-CD1 3.93Å; T121-L123 HydrophobicContact CG2-CG 3.93Å; T121-L123 PolarHBondContact O-N 3.21Å; L123-T125 PolarHBondContact O-N 2.81Å; L123-T125 VanDerWaalsContact O-N 3.15Å; L123-L126 HydrophobicContact CB-CB 4.38Å; L123-L126 HydrophobicContact CB-CD1 4.34Å; L123-L126 HydrophobicContact CB-CG 4.41Å; L123-L126 HydrophobicContact CD1-CD1 3.99Å; L123-L126 PolarHBondContact O-N 3.36Å; L123-C127 PolarHBondContact O-N 3.35Å; L123-C127 VanDerWaalsContact O-N 3.09Å
124	V	79.9	Confident	76.7	Confident	113 Å²	113	88 Å²	88	69%	0.685	49%	0.489	S	S	*	.	H	α-helix	trans	-52.1	-39	179.1	179.5	0	0	0	0	112.4	D122 L126 C127 V128	D122-V124 PolarHBondContact O-N 3.3Å; V124-L126 VanDerWaalsContact C-N 3.34Å; V124-L126 PolarHBondContact O-N 3.08Å; V124-C127 WeakPolarHBondContact O-CB 3.14Å; V124-C127 PolarHBondContact O-N 3.34Å; V124-V128 HydrophobicContact CG1-CG2 4.47Å; V124-V128 WeakPolarHBondContact O-CG2 3.48Å; V124-V128 PolarHBondContact O-N 2.75Å
125	T	74.8	Confident	77.2	Confident	104 Å²	104	91.4 Å²	91.4	64%	0.638	49%	0.494	S	S	*	.	H	α-helix	trans	-62.3	-39.1	178.4	49.1	0	0	0	0	112.8	L123 V128 R129	L123-T125 PolarHBondContact O-N 2.81Å; L123-T125 VanDerWaalsContact O-N 3.15Å; T125-V128 PolarHBondContact O-N 3.36Å; T125-R129 WeakPolarHBondContact O-CB 3.27Å; T125-R129 PolarHBondContact O-N 3.49Å
126	L	78.6	Confident	77.3	Confident	45 Å²	45	93.4 Å²	93.4	24%	0.236	50%	0.498	C	S	.	.	H	α-helix	trans	-74.9	-33.2	176.7	-71.9	177.5	0	0	0	111.7	I117 T121 L123 V124 R129 K130	I117-L126 HydrophobicContact CG2-CB 4.04Å; I117-L126 HydrophobicContact CG2-CD2 4.39Å; T121-L126 HydrophobicContact CG2-CB 4Å; T121-L126 HydrophobicContact CG2-CD1 3.32Å; T121-L126 HydrophobicContact CG2-CG 4.23Å; L123-L126 HydrophobicContact CB-CB 4.38Å; L123-L126 HydrophobicContact CB-CD1 4.34Å; L123-L126 HydrophobicContact CB-CG 4.41Å; L123-L126 HydrophobicContact CD1-CD1 3.99Å; L123-L126 PolarHBondContact O-N 3.36Å; V124-L126 VanDerWaalsContact C-N 3.34Å; V124-L126 PolarHBondContact O-N 3.08Å; L126-R129 PolarHBondContact O-N 3.17Å; L126-K130 VanDerWaalsContact O-CB 3.32Å; L126-K130 WeakPolarHBondContact O-CB 3.28Å; L126-K130 PolarHBondContact O-N 3.09Å
127	C	78	Confident	77.2	Confident	75 Å²	75	96 Å²	96	51%	0.507	50%	0.503	S	S	.	.	H	α-helix	trans	-62.1	-44.2	170.1	-65.5	0	0	0	0	112	L123 V124 K130 G131	L123-C127 PolarHBondContact O-N 3.35Å; L123-C127 VanDerWaalsContact O-N 3.09Å; V124-C127 WeakPolarHBondContact O-CB 3.14Å; V124-C127 PolarHBondContact O-N 3.34Å; C127-K130 PolarHBondContact O-N 2.92Å; C127-G131 PolarHBondContact O-N 2.81Å
128	V	79.9	Confident	77.3	Confident	99 Å²	99	102.4 Å²	102.4	60%	0.6	53%	0.533	S	S	*	.	H	α-helix	trans	-64	-44.6	175.6	172.5	0	0	0	0	110.9	V124 T125 K130 G131 L132	V124-V128 HydrophobicContact CG1-CG2 4.47Å; V124-V128 WeakPolarHBondContact O-CG2 3.48Å; V124-V128 PolarHBondContact O-N 2.75Å; T125-V128 PolarHBondContact O-N 3.36Å; V128-K130 VanDerWaalsContact C-N 3.35Å; V128-K130 PolarHBondContact O-N 3.48Å; V128-G131 PolarHBondContact O-N 3.34Å; V128-L132 PolarHBondContact O-N 3.41Å
129	R	79.1	Confident	76.9	Confident	94 Å²	94	102.3 Å²	102.3	36%	0.355	53%	0.528	S	S	.	.	H	α-helix	trans	-60.6	-43.8	176.2	-171.2	-176.7	176.8	169.2	-2.7	111.4	P114 E115 I117 T125 L126 L132 L133	P114-R129 PolarHBondContact O-NH2 3.33Å; E115-R129 IonicContact OE1-NH2 3.33Å; E115-R129 PolarHBondContact OE1-NH2 3.33Å; E115-R129 IonicContact OE2-CZ 3.93Å; E115-R129 IonicContact OE2-NE 3.28Å; E115-R129 PolarHBondContact OE2-NE 3.09Å; E115-R129 IonicContact OE2-NH2 2.87Å; E115-R129 PolarHBondContact OE2-NH2 2.99Å; I117-R129 HydrophobicContact CD1-CB 3.84Å; I117-R129 HydrophobicContact CD1-CG 3.84Å; T125-R129 WeakPolarHBondContact O-CB 3.27Å; T125-R129 PolarHBondContact O-N 3.49Å; L126-R129 PolarHBondContact O-N 3.17Å; R129-L132 WeakPolarHBondContact O-CB 3.48Å; R129-L132 PolarHBondContact O-N 2.68Å; R129-L132 VanDerWaalsContact O-N 3.14Å; R129-L133 HydrophobicContact CG-CD1 4.24Å; R129-L133 WeakPolarHBondContact O-CG 3.22Å; R129-L133 PolarHBondContact O-N 2.64Å
130	K	82.8	Confident	76.7	Confident	89 Å²	89	98.4 Å²	98.4	39%	0.387	51%	0.511	S	S	.	.	H	α-helix	trans	-58.8	-48.9	176.6	-171.6	172.8	-179.8	171.3	0	111.3	I117 L126 C127 V128 L132 L133 D134	I117-K130 HydrophobicContact CD1-CB 3.69Å; I117-K130 HydrophobicContact CD1-CG 4.48Å; I117-K130 VanDerWaalsContact CD1-N 3.28Å; L126-K130 VanDerWaalsContact O-CB 3.32Å; L126-K130 WeakPolarHBondContact O-CB 3.28Å; L126-K130 PolarHBondContact O-N 3.09Å; C127-K130 PolarHBondContact O-N 2.92Å; V128-K130 VanDerWaalsContact C-N 3.35Å; V128-K130 PolarHBondContact O-N 3.48Å; K130-L132 VanDerWaalsContact C-N 3.25Å; K130-L132 PolarHBondContact O-N 2.81Å; K130-L133 PolarHBondContact O-N 3.02Å; K130-L133 VanDerWaalsContact O-N 3.09Å; K130-D134 PolarHBondContact O-N 2.83Å
131	G	80.4	Confident	76.4	Confident	42 Å²	42	97.7 Å²	97.7	43%	0.433	51%	0.513	S	S	.	.	H	α-helix	trans	-59.4	-34.3	175.4	0	0	0	0	0	113.7	C127 V128 Y135	C127-G131 PolarHBondContact O-N 2.81Å; V128-G131 PolarHBondContact O-N 3.34Å; G131-Y135 VanDerWaalsContact O-CB 3.3Å; G131-Y135 WeakPolarHBondContact O-CB 3.26Å; G131-Y135 PolarHBondContact O-N 3.32Å; G131-Y135 VanDerWaalsContact O-N 3.09Å
132	L	79.3	Confident	75.8	Confident	97 Å²	97	102 Å²	102	51%	0.508	53%	0.533	S	S	.	.	H	α-helix	trans	-70.2	-39.9	174.7	-170.4	71	0	0	0	112	V128 R129 K130 R136	V128-L132 PolarHBondContact O-N 3.41Å; R129-L132 WeakPolarHBondContact O-CB 3.48Å; R129-L132 PolarHBondContact O-N 2.68Å; R129-L132 VanDerWaalsContact O-N 3.14Å; K130-L132 VanDerWaalsContact C-N 3.25Å; K130-L132 PolarHBondContact O-N 2.81Å; L132-R136 WeakPolarHBondContact O-CB 3.43Å; L132-R136 VanDerWaalsContact O-CG 3.27Å; L132-R136 WeakPolarHBondContact O-CG 3.29Å; L132-R136 PolarHBondContact O-N 3.18Å
133	L	80.4	Confident	74.5	Confident	34 Å²	34	101.9 Å²	101.9	18%	0.178	53%	0.533	C	S	.	.	H	α-helix	trans	-67.4	-46.6	177.7	-70.3	171.7	0	0	0	111.9	E115 I117 R129 K130 Y135 R136 E137	E115-L133 HydrophobicContact CB-CD1 4.17Å; E115-L133 HydrophobicContact CB-CD2 4.28Å; E115-L133 HydrophobicContact CG-CD2 4.32Å; E115-L133 VanDerWaalsContact O-CD1 3.23Å; E115-L133 WeakPolarHBondContact O-CD1 3.42Å; E115-L133 WeakPolarHBondContact OE2-CD1 3.4Å; E115-L133 VanDerWaalsContact OE2-CD2 3.25Å; E115-L133 WeakPolarHBondContact OE2-CD2 2.84Å; I117-L133 HydrophobicContact CD1-CD1 3.81Å; I117-L133 HydrophobicContact CG1-CD1 4.27Å; R129-L133 HydrophobicContact CG-CD1 4.24Å; R129-L133 WeakPolarHBondContact O-CG 3.22Å; R129-L133 PolarHBondContact O-N 2.64Å; K130-L133 PolarHBondContact O-N 3.02Å; K130-L133 VanDerWaalsContact O-N 3.09Å; L133-Y135 VanDerWaalsContact C-N 3.31Å; L133-Y135 PolarHBondContact O-N 2.93Å; L133-R136 WeakPolarHBondContact O-CA 3.27Å; L133-R136 WeakPolarHBondContact O-CB 3.46Å; L133-R136 PolarHBondContact O-N 3.43Å; L133-E137 PolarHBondContact O-N 3.18Å
134	D	82.4	Confident	73.3	Confident	66 Å²	66	106.9 Å²	106.9	35%	0.353	54%	0.544	S	S	.	.	H	α-helix	trans	-58.4	-46	175.5	-62.3	-16.4	0	0	0	110	K130 R136 E137 E138	K130-D134 PolarHBondContact O-N 2.83Å; D134-R136 VanDerWaalsContact C-N 3.33Å; D134-R136 PolarHBondContact O-N 2.69Å; D134-E137 PolarHBondContact O-N 3.1Å; D134-E138 WeakPolarHBondContact O-CB 3.42Å; D134-E138 VanDerWaalsContact O-CG 3.29Å; D134-E138 WeakPolarHBondContact O-CG 3.39Å; D134-E138 PolarHBondContact O-N 2.89Å
135	Y	78.7	Confident	72.1	Confident	137 Å²	137	105.1 Å²	105.1	54%	0.537	54%	0.541	S	S	.	.	H	α-helix	trans	-59.3	-41.6	174.4	176.2	-93.2	0	0	0	112.5	G131 L133 N139	G131-Y135 VanDerWaalsContact O-CB 3.3Å; G131-Y135 WeakPolarHBondContact O-CB 3.26Å; G131-Y135 PolarHBondContact O-N 3.32Å; G131-Y135 VanDerWaalsContact O-N 3.09Å; L133-Y135 VanDerWaalsContact C-N 3.31Å; L133-Y135 PolarHBondContact O-N 2.93Å; Y135-N139 WeakPolarHBondContact CD2-ND2 3.32Å; Y135-N139 HydrophobicContact CE1-CB 4.33Å; Y135-N139 HydrophobicContact CE2-CB 4.23Å; Y135-N139 VanDerWaalsContact CE2-ND2 3.3Å; Y135-N139 WeakPolarHBondContact CE2-ND2 3.38Å; Y135-N139 VanDerWaalsContact O-CB 3.25Å; Y135-N139 WeakPolarHBondContact O-CB 3.41Å; Y135-N139 PolarHBondContact O-N 2.81Å; Y135-N139 PolarHBondContact O-ND2 2.95Å
136	R	74.1	Confident	71.4	Confident	119 Å²	119	102.5 Å²	102.5	45%	0.449	53%	0.527	S	S	.	.	H	α-helix	trans	-63.4	-48.2	177.4	-77.8	-177.6	160.6	-175.6	-6.9	110.9	L132 L133 D134 E138 N139 I140	L132-R136 WeakPolarHBondContact O-CB 3.43Å; L132-R136 VanDerWaalsContact O-CG 3.27Å; L132-R136 WeakPolarHBondContact O-CG 3.29Å; L132-R136 PolarHBondContact O-N 3.18Å; L133-R136 WeakPolarHBondContact O-CA 3.27Å; L133-R136 WeakPolarHBondContact O-CB 3.46Å; L133-R136 PolarHBondContact O-N 3.43Å; D134-R136 VanDerWaalsContact C-N 3.33Å; D134-R136 PolarHBondContact O-N 2.69Å; R136-E138 VanDerWaalsContact C-N 3.32Å; R136-E138 PolarHBondContact O-N 2.78Å; R136-N139 PolarHBondContact O-N 3.14Å; R136-I140 HydrophobicContact CB-CD1 3.91Å; R136-I140 HydrophobicContact CB-CG1 4.42Å; R136-I140 HydrophobicContact CG-CD1 3.61Å; R136-I140 WeakPolarHBondContact O-CA 3.47Å; R136-I140 WeakPolarHBondContact O-CB 3.4Å; R136-I140 WeakPolarHBondContact O-CG1 3.4Å; R136-I140 PolarHBondContact O-N 3.41Å
137	E	77.1	Confident	70.8	Confident	162 Å²	162	108.5 Å²	108.5	76%	0.757	55%	0.547	S	S	*	.	H	α-helix	trans	-61.4	-41.1	179.1	-170.9	175.3	-168.3	0	0	111.8	L133 D134	L133-E137 PolarHBondContact O-N 3.18Å; D134-E137 PolarHBondContact O-N 3.1Å
138	E	78.8	Confident	70.1	Confident	158 Å²	158	108 Å²	108	74%	0.738	54%	0.537	S	S	*	.	H	α-helix	trans	-73.2	-35.1	-179.9	-72	179.2	173.9	0	0	113.8	D134 R136	D134-E138 WeakPolarHBondContact O-CB 3.42Å; D134-E138 VanDerWaalsContact O-CG 3.29Å; D134-E138 WeakPolarHBondContact O-CG 3.39Å; D134-E138 PolarHBondContact O-N 2.89Å; R136-E138 VanDerWaalsContact C-N 3.32Å; R136-E138 PolarHBondContact O-N 2.78Å
139	N	70.6	Confident	69.4	Low	86 Å²	86	109 Å²	109	46%	0.46	54%	0.535	S	S	.	.	H	α-helix	trans	-112.1	-20.9	-167.8	-63.3	-85.6	0	0	0	114.5	Y135 R136 T141	Y135-N139 WeakPolarHBondContact CD2-ND2 3.32Å; Y135-N139 HydrophobicContact CE1-CB 4.33Å; Y135-N139 HydrophobicContact CE2-CB 4.23Å; Y135-N139 VanDerWaalsContact CE2-ND2 3.3Å; Y135-N139 WeakPolarHBondContact CE2-ND2 3.38Å; Y135-N139 VanDerWaalsContact O-CB 3.25Å; Y135-N139 WeakPolarHBondContact O-CB 3.41Å; Y135-N139 PolarHBondContact O-N 2.81Å; Y135-N139 PolarHBondContact O-ND2 2.95Å; R136-N139 PolarHBondContact O-N 3.14Å; N139-T141 PolarHBondContact O-N 3.14Å
140	I	65.3	Low	68.9	Low	89 Å²	89	108 Å²	108	46%	0.456	54%	0.54	S	S	.	.			trans	-95.5	99.8	-178.2	-57.1	-176.7	0	0	0	109.5	R136	R136-I140 HydrophobicContact CB-CD1 3.91Å; R136-I140 HydrophobicContact CB-CG1 4.42Å; R136-I140 HydrophobicContact CG-CD1 3.61Å; R136-I140 WeakPolarHBondContact O-CA 3.47Å; R136-I140 WeakPolarHBondContact O-CB 3.4Å; R136-I140 WeakPolarHBondContact O-CG1 3.4Å; R136-I140 PolarHBondContact O-N 3.41Å
141	T	58.2	Low	68.2	Low	140 Å²	140	106.8 Å²	106.8	86%	0.859	53%	0.534	S	S	*	.			trans	-85.6	-8.9	179.4	27.6	0	0	0	0	114	N139	N139-T141 PolarHBondContact O-N 3.14Å
142	I	58.1	Low	67.7	Low	124 Å²	124	106.7 Å²	106.7	64%	0.636	53%	0.525	S	S	*	.			trans	-133.8	99.9	-178.8	-60	171.4	0	0	0	108.3	R144	I142-R144 VanDerWaalsContact C-N 3.27Å; I142-R144 HydrophobicContact CG2-CB 4.1Å; I142-R144 HydrophobicContact CG2-CG 4.11Å; I142-R144 PolarHBondContact O-N 3.07Å; I142-R144 VanDerWaalsContact O-N 3.13Å
143	D	49.5	Very low	67.2	Low	162 Å²	162	109.7 Å²	109.7	87%	0.866	53%	0.531	S	S	*	.			trans	-81.4	77.3	165.5	-175.7	35	0	0	0	109
144	R	54.4	Low	66.9	Low	209 Å²	209	112.2 Å²	112.2	79%	0.789	54%	0.542	S	S	*	.			trans	-103.1	130.1	159.9	-93.8	-179.3	169.7	167.4	-2.1	105.6	I142 C146	I142-R144 VanDerWaalsContact C-N 3.27Å; I142-R144 HydrophobicContact CG2-CB 4.1Å; I142-R144 HydrophobicContact CG2-CG 4.11Å; I142-R144 PolarHBondContact O-N 3.07Å; I142-R144 VanDerWaalsContact O-N 3.13Å; R144-C146 PolarHBondContact O-N 3.18Å
145	A	54.7	Low	66.6	Low	76 Å²	76	111 Å²	111	63%	0.628	54%	0.535	S	S	*	.			trans	-40.8	112.3	160.5	0	0	0	0	0	107.2	R147	A145-R147 PolarHBondContact O-N 3.21Å
146	C	59.7	Low	66.3	Low	50 Å²	50	108.5 Å²	108.5	34%	0.338	53%	0.528	S	S	.	.			trans	-59.2	118.6	-174.3	-178.2	0	0	0	0	104.8	R144 Q148 E149 T150	R144-C146 PolarHBondContact O-N 3.18Å; C146-Q148 CarbonylContact O-C 3.46Å; C146-Q148 PolarHBondContact O-N 3.39Å; C146-Q148 PolarHBondContact SG-OE1 2.83Å; C146-E149 HydrophobicContact CB-CB 4.13Å; C146-E149 HydrophobicContact CB-CG 3.82Å; C146-E149 WeakPolarHBondContact O-CA 3.43Å; C146-E149 WeakPolarHBondContact O-CB 3.4Å; C146-E149 PolarHBondContact O-N 3.29Å; C146-T150 PolarHBondContact O-N 2.81Å
147	R	64.4	Low	66.3	Low	171 Å²	171	104.8 Å²	104.8	65%	0.645	52%	0.52	S	S	*	.	H	α-helix	trans	-51.8	-32.7	-174.9	-169.2	-176.4	176.8	-176	-3.8	110.7	A145 F151	A145-R147 PolarHBondContact O-N 3.21Å; R147-F151 HydrophobicContact CG-CD2 3.92Å; R147-F151 HydrophobicContact CG-CE2 3.49Å; R147-F151 VanDerWaalsContact CG-CE2 3.49Å; R147-F151 HydrophobicContact CG-CZ 4.36Å; R147-F151 VanDerWaalsContact NE-CE2 3.3Å; R147-F151 WeakPolarHBondContact O-CD2 3.2Å; R147-F151 PolarHBondContact O-N 3.22Å; R147-F151 VanDerWaalsContact O-N 3.11Å
148	Q	64.3	Low	66.2	Low	63 Å²	63	102 Å²	102	29%	0.294	51%	0.507	S	S	.	.	H	α-helix	trans	-62.1	-42.5	172.6	-65.8	83	-13.4	0	0	113.9	C146 F151 V152 W344	C146-Q148 CarbonylContact O-C 3.46Å; C146-Q148 PolarHBondContact O-N 3.39Å; C146-Q148 PolarHBondContact SG-OE1 2.83Å; Q148-F151 PolarHBondContact O-N 3.11Å; Q148-V152 VanDerWaalsContact O-CG2 3.27Å; Q148-V152 WeakPolarHBondContact O-CG2 3.47Å; Q148-V152 PolarHBondContact O-N 3.5Å; Q148-W344 HydrophobicContact CG-CB 3.98Å; Q148-W344 HydrophobicContact CG-CG 4.1Å
149	E	65.4	Low	66.3	Low	122 Å²	122	94.9 Å²	94.9	57%	0.57	48%	0.475	S	S	*	.	H	α-helix	trans	-66.3	-41	176.9	-71	172.4	172.4	0	0	111.4	C146 F151 V152 Y153	C146-E149 HydrophobicContact CB-CB 4.13Å; C146-E149 HydrophobicContact CB-CG 3.82Å; C146-E149 WeakPolarHBondContact O-CA 3.43Å; C146-E149 WeakPolarHBondContact O-CB 3.4Å; C146-E149 PolarHBondContact O-N 3.29Å; E149-F151 VanDerWaalsContact C-N 3.34Å; E149-F151 PolarHBondContact O-N 3.3Å; E149-V152 PolarHBondContact O-N 2.95Å; E149-Y153 WeakPolarHBondContact O-CB 3.41Å; E149-Y153 PolarHBondContact O-N 3.2Å
150	T	67.8	Low	66.7	Low	73 Å²	73	96.1 Å²	96.1	45%	0.448	48%	0.481	S	S	.	.	H	α-helix	trans	-60.3	-43.8	174.3	-51.1	0	0	0	0	111.6	C146 Y153 E154	C146-T150 PolarHBondContact O-N 2.81Å; T150-Y153 PolarHBondContact O-N 2.88Å; T150-E154 WeakPolarHBondContact O-CB 3.18Å; T150-E154 PolarHBondContact O-N 2.85Å
151	F	69.3	Low	67.4	Low	63 Å²	63	93.6 Å²	93.6	28%	0.276	48%	0.477	S	S	.	.	H	α-helix	trans	-67.8	-38.7	177.4	-76.6	-56.6	0	0	0	113.3	R147 Q148 E149 Y153 E154 M155 W344	R147-F151 HydrophobicContact CG-CD2 3.92Å; R147-F151 HydrophobicContact CG-CE2 3.49Å; R147-F151 VanDerWaalsContact CG-CE2 3.49Å; R147-F151 HydrophobicContact CG-CZ 4.36Å; R147-F151 VanDerWaalsContact NE-CE2 3.3Å; R147-F151 WeakPolarHBondContact O-CD2 3.2Å; R147-F151 PolarHBondContact O-N 3.22Å; R147-F151 VanDerWaalsContact O-N 3.11Å; Q148-F151 PolarHBondContact O-N 3.11Å; E149-F151 VanDerWaalsContact C-N 3.34Å; E149-F151 PolarHBondContact O-N 3.3Å; F151-Y153 VanDerWaalsContact C-N 3.33Å; F151-E154 PolarHBondContact O-N 3.34Å; F151-M155 WeakPolarHBondContact O-CB 3.46Å; F151-M155 PolarHBondContact O-N 3.26Å; F151-W344 HydrophobicContact CB-CZ3 4.35Å; F151-W344 HydrophobicContact CD1-CZ3 4.42Å; F151-W344 AromaticContact CD2-CE3 3.89Å; F151-W344 HydrophobicContact CD2-CE3 3.89Å; F151-W344 AromaticContact CD2-CH2 3.72Å; F151-W344 HydrophobicContact CD2-CH2 3.72Å; F151-W344 AromaticContact CD2-CZ3 3.27Å; F151-W344 HydrophobicContact CD2-CZ3 3.27Å; F151-W344 HydrophobicContact CE2-CE3 4.36Å; F151-W344 AromaticContact CE2-CH2 3.34Å; F151-W344 HydrophobicContact CE2-CH2 3.34Å; F151-W344 HydrophobicContact CE2-CZ2 4.2Å; F151-W344 AromaticContact CE2-CZ3 3.44Å; F151-W344 HydrophobicContact CE2-CZ3 3.44Å; F151-W344 VanDerWaalsContact CE2-CZ3 3.44Å; F151-W344 HydrophobicContact CG-CE3 4.46Å; F151-W344 AromaticContact CG-CZ3 3.81Å; F151-W344 HydrophobicContact CG-CZ3 3.81Å; F151-W344 AromaticContact CZ-CH2 3.91Å; F151-W344 HydrophobicContact CZ-CH2 3.91Å; F151-W344 HydrophobicContact CZ-CZ3 4.13Å
152	V	68.6	Low	68.8	Low	40 Å²	40	91.2 Å²	91.2	24%	0.242	46%	0.455	C	S	.	.	H	α-helix	trans	-61.5	-45.8	174.7	169.6	0	0	0	0	109.9	Q148 E149 E154 M155 E156	Q148-V152 VanDerWaalsContact O-CG2 3.27Å; Q148-V152 WeakPolarHBondContact O-CG2 3.47Å; Q148-V152 PolarHBondContact O-N 3.5Å; E149-V152 PolarHBondContact O-N 2.95Å; V152-E154 PolarHBondContact O-N 3.02Å; V152-M155 HydrophobicContact CG2-CE 4.46Å; V152-M155 PolarHBondContact O-N 2.83Å; V152-E156 HydrophobicContact CG1-CG 4.48Å; V152-E156 WeakPolarHBondContact O-CG 3.41Å; V152-E156 PolarHBondContact O-N 2.98Å
153	Y	69.1	Low	70.4	Confident	159 Å²	159	90.5 Å²	90.5	62%	0.624	45%	0.447	S	S	*	.	H	α-helix	trans	-62.7	-42.3	176.1	-179.3	-96.8	0	0	0	112.5	E149 T150 F151 E156 S157	E149-Y153 WeakPolarHBondContact O-CB 3.41Å; E149-Y153 PolarHBondContact O-N 3.2Å; T150-Y153 PolarHBondContact O-N 2.88Å; F151-Y153 VanDerWaalsContact C-N 3.33Å; Y153-E156 PolarHBondContact O-N 2.99Å; Y153-S157 WeakPolarHBondContact O-CB 3.15Å; Y153-S157 PolarHBondContact O-N 2.98Å; Y153-S157 PolarHBondContact O-OG 2.92Å
154	E	75.6	Confident	72.4	Confident	87 Å²	87	83.8 Å²	83.8	41%	0.407	41%	0.412	S	S	.	.	H	α-helix	trans	-61.1	-45.1	176.4	-172.7	172.7	-163.1	0	0	111.1	T150 F151 V152 S157 H158	T150-E154 WeakPolarHBondContact O-CB 3.18Å; T150-E154 PolarHBondContact O-N 2.85Å; F151-E154 PolarHBondContact O-N 3.34Å; V152-E154 PolarHBondContact O-N 3.02Å; E154-S157 WeakPolarHBondContact CA-OG 3.34Å; E154-S157 PolarHBondContact O-N 3.47Å; E154-S157 PolarHBondContact O-OG 2.82Å; E154-H158 WeakPolarHBondContact CG-NE2 3.44Å; E154-H158 WeakPolarHBondContact O-CB 3.46Å; E154-H158 PolarHBondContact O-CD2 2.91Å; E154-H158 VanDerWaalsContact O-CG 3.23Å; E154-H158 PolarHBondContact O-N 3.4Å; E154-H158 IonicContact OE1-NE2 2.71Å
155	M	75.8	Confident	74.2	Confident	42 Å²	42	83.5 Å²	83.5	21%	0.207	42%	0.42	C	S	.	.	H	α-helix	trans	-61.9	-45.9	175.5	178.6	176.4	43.2	0	0	112.8	F151 V152 L339 I340	F151-M155 WeakPolarHBondContact O-CB 3.46Å; F151-M155 PolarHBondContact O-N 3.26Å; V152-M155 HydrophobicContact CG2-CE 4.46Å; V152-M155 PolarHBondContact O-N 2.83Å; M155-L339 WeakPolarHBondContact CG-O 3.49Å; M155-L339 HydrophobicContact SD-CD2 4.17Å; M155-L339 HydrophobicContact SD-CG 3.95Å; M155-I340 WeakPolarHBondContact CE-O 3.48Å
156	E	72.3	Confident	76	Confident	83 Å²	83	83.5 Å²	83.5	39%	0.388	41%	0.409	S	S	.	.	H	α-helix	trans	-65.1	-47.1	177.4	-72.5	175.2	178.7	0	0	111.1	V152 Y153 H158 A159 I340	V152-E156 HydrophobicContact CG1-CG 4.48Å; V152-E156 WeakPolarHBondContact O-CG 3.41Å; V152-E156 PolarHBondContact O-N 2.98Å; Y153-E156 PolarHBondContact O-N 2.99Å; E156-H158 VanDerWaalsContact C-N 3.29Å; E156-H158 PolarHBondContact O-N 3.34Å; E156-A159 PolarHBondContact O-N 3.01Å; E156-I340 WeakPolarHBondContact CG-O 3.31Å
157	S	73.7	Confident	77.5	Confident	41 Å²	41	86 Å²	86	29%	0.287	43%	0.425	S	S	.	.	H	α-helix	trans	-66.7	-26.8	-177.9	63.5	0	0	0	0	113.8	Y153 E154 A159 L160	Y153-S157 WeakPolarHBondContact O-CB 3.15Å; Y153-S157 PolarHBondContact O-N 2.98Å; Y153-S157 PolarHBondContact O-OG 2.92Å; E154-S157 WeakPolarHBondContact CA-OG 3.34Å; E154-S157 PolarHBondContact O-N 3.47Å; E154-S157 PolarHBondContact O-OG 2.82Å; S157-A159 PolarHBondContact O-N 2.88Å; S157-A159 VanDerWaalsContact O-N 3.09Å; S157-L160 PolarHBondContact O-N 2.82Å
158	H	75.3	Confident	78.9	Confident	104 Å²	104	85.4 Å²	85.4	48%	0.481	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-21.7	177.7	-87	-45.9	0	0	0	114	E154 E156 K162	E154-H158 WeakPolarHBondContact CG-NE2 3.44Å; E154-H158 WeakPolarHBondContact O-CB 3.46Å; E154-H158 PolarHBondContact O-CD2 2.91Å; E154-H158 VanDerWaalsContact O-CG 3.23Å; E154-H158 PolarHBondContact O-N 3.4Å; E154-H158 IonicContact OE1-NE2 2.71Å; E156-H158 VanDerWaalsContact C-N 3.29Å; E156-H158 PolarHBondContact O-N 3.34Å; H158-K162 WeakPolarHBondContact O-CD 3.38Å; H158-K162 WeakPolarHBondContact O-CE 3.49Å; H158-K162 PolarHBondContact O-NZ 3.01Å
159	A	79.8	Confident	80.3	Confident	8 Å²	8	83.9 Å²	83.9	7%	0.066	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-15.2	-176.1	0	0	0	0	0	113.9	E156 S157 G161 K162 C330 L338	E156-A159 PolarHBondContact O-N 3.01Å; S157-A159 PolarHBondContact O-N 2.88Å; S157-A159 VanDerWaalsContact O-N 3.09Å; A159-G161 PolarHBondContact O-N 2.66Å; A159-K162 PolarHBondContact O-N 2.87Å; A159-C330 HydrophobicContact CB-CB 4.09Å; A159-C330 VanDerWaalsContact O-CA 3.28Å; A159-C330 WeakPolarHBondContact O-CA 3.46Å; A159-C330 WeakPolarHBondContact O-CB 3.34Å; A159-C330 PolarHBondContact O-N 2.93Å; A159-L338 HydrophobicContact CB-CD1 3.57Å; A159-L338 HydrophobicContact CB-CD2 3.48Å; A159-L338 VanDerWaalsContact CB-CD2 3.48Å; A159-L338 HydrophobicContact CB-CG 4.09Å
160	L	79.8	Confident	81.7	Confident	113 Å²	113	82.2 Å²	82.2	59%	0.592	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	128.2	-178.5	-69.3	175.1	0	0	0	111.5	S157 K162	S157-L160 PolarHBondContact O-N 2.82Å; L160-K162 PolarHBondContact O-N 3.41Å
161	G	79.8	Confident	83	Confident	36 Å²	36	79 Å²	79	37%	0.371	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.4	12.5	177.5	0	0	0	0	0	115.5	A159 K163 D328 D329	A159-G161 PolarHBondContact O-N 2.66Å; G161-K163 PolarHBondContact O-N 3.27Å; G161-D328 PolarHBondContact N-O 3.18Å; G161-D329 WeakPolarHBondContact CA-O 3.38Å; G161-D329 PolarHBondContact N-O 3.22Å
162	K	88.1	Confident	84.1	Confident	90 Å²	90	78.1 Å²	78.1	39%	0.391	41%	0.407	S	S	.	.			trans	-67	133.5	178.9	-90.2	-166.9	171.5	159.5	0	110.7	H158 A159 L160 L331 D332 L335	H158-K162 WeakPolarHBondContact O-CD 3.38Å; H158-K162 WeakPolarHBondContact O-CE 3.49Å; H158-K162 PolarHBondContact O-NZ 3.01Å; A159-K162 PolarHBondContact O-N 2.87Å; L160-K162 PolarHBondContact O-N 3.41Å; K162-L331 PolarHBondContact O-N 2.79Å; K162-D332 PolarHBondContact O-N 2.84Å; K162-L335 HydrophobicContact CB-CD1 4.48Å; K162-L335 HydrophobicContact CD-CD1 3.65Å
163	K	90.9	Very high	85.3	Confident	109 Å²	109	81.4 Å²	81.4	47%	0.474	42%	0.419	S	S	.	.			trans	-115.1	142.4	174.1	-63.5	177.4	-172.2	168.6	0	108.7	E60 G161 L331	E60-K163 IonicContact OE1-NZ 3.84Å; E60-K163 PolarHBondContact OE1-NZ 3.24Å; G161-K163 PolarHBondContact O-N 3.27Å; K163-L331 HydrophobicContact CG-CB 4.48Å; K163-L331 HydrophobicContact CG-CD1 4.34Å
164	P	92.7	Very high	86.5	Confident	20 Å²	20	73.9 Å²	73.9	13%	0.13	39%	0.39	C	S	.	.			trans	-69.4	152.7	-178.1	29.4	-34.7	0	0	0	111.1	N166 D169 L170 D332	P164-N166 VanDerWaalsContact C-N 3.29Å; P164-N166 WeakPolarHBondContact CB-O 3.4Å; P164-N166 WeakPolarHBondContact CG-O 3.36Å; P164-D169 HydrophobicContact CB-CB 3.87Å; P164-D169 HydrophobicContact CG-CB 4.4Å; P164-L170 HydrophobicContact CG-CB 4.07Å; P164-L170 HydrophobicContact CG-CD1 3.99Å; P164-D332 HydrophobicContact CB-CB 3.93Å; P164-D332 HydrophobicContact CG-CB 4.47Å
165	E	90.3	Very high	87.5	Confident	204 Å²	204	71.2 Å²	71.2	95%	0.953	38%	0.378	S	S	*	.	S	Bend	trans	-68.4	-33.9	170	-64.3	-173.5	171.8	0	0	111.5
166	N	92.8	Very high	88.5	Confident	76 Å²	76	69.2 Å²	69.2	41%	0.406	37%	0.368	S	S	.	.	S	Bend	trans	-99.9	122.6	179.7	180	16.8	0	0	0	110.7	P164 E168 D169	P164-N166 VanDerWaalsContact C-N 3.29Å; P164-N166 WeakPolarHBondContact CB-O 3.4Å; P164-N166 WeakPolarHBondContact CG-O 3.36Å; N166-E168 PolarHBondContact O-N 3.19Å; N166-E168 VanDerWaalsContact O-N 3.16Å; N166-E168 PolarHBondContact OD1-N 3.12Å; N166-D169 WeakPolarHBondContact CB-OD2 3.38Å; N166-D169 PolarHBondContact ND2-OD2 2.76Å; N166-D169 PolarHBondContact O-N 3.27Å
167	P	92.1	Very high	89.8	Confident	103 Å²	103	65.3 Å²	65.3	67%	0.669	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-58.6	-26.8	179.5	-26.5	35.2	0	0	0	115.2	D169 L170	P167-D169 PolarHBondContact O-N 2.85Å; P167-L170 WeakPolarHBondContact O-CB 3.48Å; P167-L170 PolarHBondContact O-N 3.38Å
168	E	93	Very high	90.9	Very high	158 Å²	158	63.3 Å²	63.3	74%	0.738	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-69.2	-18.8	177.5	-61.2	-64	141.7	0	0	113	N166 L170	N166-E168 PolarHBondContact O-N 3.19Å; N166-E168 VanDerWaalsContact O-N 3.16Å; N166-E168 PolarHBondContact OD1-N 3.12Å; E168-L170 VanDerWaalsContact C-N 3.3Å
169	D	93.5	Very high	92	Very high	31 Å²	31	59.2 Å²	59.2	17%	0.166	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-93.1	5.9	177.4	-64.9	-51.8	0	0	0	112.2	P164 N166 P167 R333 T334	P164-D169 HydrophobicContact CB-CB 3.87Å; P164-D169 HydrophobicContact CG-CB 4.4Å; N166-D169 WeakPolarHBondContact CB-OD2 3.38Å; N166-D169 PolarHBondContact ND2-OD2 2.76Å; N166-D169 PolarHBondContact O-N 3.27Å; P167-D169 PolarHBondContact O-N 2.85Å; D169-R333 WeakPolarHBondContact O-CB 3.31Å; D169-R333 PolarHBondContact O-N 3Å; D169-R333 IonicContact OD1-NH2 3.1Å; D169-R333 PolarHBondContact OD1-NH2 3.31Å; D169-R333 VanDerWaalsContact OD1-NH2 3.1Å; D169-T334 HydrophobicContact CB-CG2 3.87Å
170	L	95.1	Very high	92.8	Very high	86 Å²	86	58.9 Å²	58.9	45%	0.45	32%	0.316	S	S	.	.	B	Isolated β-bridge	trans	-72.5	132.3	174.9	-168.2	72.4	0	0	0	110.2	P164 P167 E168 G172 L331	P164-L170 HydrophobicContact CG-CB 4.07Å; P164-L170 HydrophobicContact CG-CD1 3.99Å; P167-L170 WeakPolarHBondContact O-CB 3.48Å; P167-L170 PolarHBondContact O-N 3.38Å; E168-L170 VanDerWaalsContact C-N 3.3Å; L170-G172 PolarHBondContact O-N 2.74Å; L170-L331 WeakPolarHBondContact CA-O 3.48Å; L170-L331 HydrophobicContact CD1-CB 3.81Å; L170-L331 HydrophobicContact CD1-CD1 4.47Å
171	I	95.3	Very high	93.5	Very high	6 Å²	6	55 Å²	55	3%	0.031	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-66.2	133.9	171.8	-66.9	173.2	0	0	0	109.7	L58 E175 L203 V325 C330 L331 R333 Y336	L58-I171 VanDerWaalsContact CD1-O 3.3Å; L58-I171 WeakPolarHBondContact CD1-O 3.25Å; I171-E175 HydrophobicContact CG2-CB 3.51Å; I171-E175 HydrophobicContact CG2-CG 3.78Å; I171-L203 HydrophobicContact CD1-CD1 3.95Å; I171-L203 HydrophobicContact CD1-CD2 3.78Å; I171-L203 HydrophobicContact CG1-CD1 4.06Å; I171-V325 HydrophobicContact CG2-CB 4.28Å; I171-V325 HydrophobicContact CG2-CG1 4.12Å; I171-V325 HydrophobicContact CG2-CG2 4.02Å; I171-C330 VanDerWaalsContact CD1-O 3.3Å; I171-C330 WeakPolarHBondContact CD1-O 3.39Å; I171-L331 PolarHBondContact N-O 2.72Å; I171-R333 HydrophobicContact CG1-CB 4.01Å; I171-Y336 HydrophobicContact CD1-CD2 3.97Å; I171-Y336 HydrophobicContact CD1-CE2 3.48Å; I171-Y336 VanDerWaalsContact CD1-CE2 3.48Å
172	G	93.2	Very high	94.2	Very high	45 Å²	45	53.2 Å²	53.2	46%	0.464	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-73	150.5	178.8	0	0	0	0	0	113.1	L170 G174 E175	L170-G172 PolarHBondContact O-N 2.74Å; G172-G174 PolarHBondContact O-N 2.95Å; G172-E175 VanDerWaalsContact O-CB 3.32Å; G172-E175 WeakPolarHBondContact O-CB 3.35Å; G172-E175 PolarHBondContact O-N 3.31Å
173	E	94.3	Very high	94.4	Very high	108 Å²	108	50 Å²	50	51%	0.505	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	133.7	174.3	-63.5	-170.9	159	0	0	111.3	L56 S57 L58 E175	L56-E173 HydrophobicContact CB-CB 4.47Å; L56-E173 WeakPolarHBondContact O-CB 3.41Å; L56-E173 WeakPolarHBondContact O-CG 3.4Å; S57-E173 WeakPolarHBondContact CA-OE1 3.39Å; L58-E173 HydrophobicContact CB-CG 4.42Å; L58-E173 HydrophobicContact CD1-CG 4.14Å; L58-E173 HydrophobicContact CG-CG 4.01Å; L58-E173 PolarHBondContact N-OE1 3.44Å; E173-E175 VanDerWaalsContact C-N 3.29Å; E173-E175 PolarHBondContact O-N 3.23Å
174	G	92.8	Very high	94.2	Very high	2 Å²	2	45 Å²	45	2%	0.021	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.9	15.7	-178.5	0	0	0	0	0	115.3	R48 G172 L324	R48-G174 PolarHBondContact NH1-O 2.99Å; G172-G174 PolarHBondContact O-N 2.95Å; G174-L324 VanDerWaalsContact O-CD2 3.32Å; G174-L324 WeakPolarHBondContact O-CD2 3.48Å
175	E	97.1	Very high	93.7	Very high	31 Å²	31	44.2 Å²	44.2	15%	0.145	24%	0.238	C	C	.	.			trans	-58.4	149.1	163.6	-177	60.2	-103.5	0	0	110.8	I171 G172 E173 L203 G204 S205 L324 V325	I171-E175 HydrophobicContact CG2-CB 3.51Å; I171-E175 HydrophobicContact CG2-CG 3.78Å; G172-E175 VanDerWaalsContact O-CB 3.32Å; G172-E175 WeakPolarHBondContact O-CB 3.35Å; G172-E175 PolarHBondContact O-N 3.31Å; E173-E175 VanDerWaalsContact C-N 3.29Å; E173-E175 PolarHBondContact O-N 3.23Å; E175-L203 HydrophobicContact CG-CB 4.24Å; E175-L203 HydrophobicContact CG-CD2 4.19Å; E175-G204 PolarHBondContact OE1-N 3.46Å; E175-S205 VanDerWaalsContact CD-OG 3.25Å; E175-S205 PolarHBondContact OE1-N 2.94Å; E175-S205 VanDerWaalsContact OE2-CB 3.26Å; E175-S205 WeakPolarHBondContact OE2-CB 3.45Å; E175-S205 PolarHBondContact OE2-OG 3.18Å; E175-L324 WeakPolarHBondContact O-CA 3.4Å; E175-V325 HydrophobicContact CB-CB 4.5Å; E175-V325 HydrophobicContact CB-CG1 3.93Å; E175-V325 PolarHBondContact O-N 3.39Å
176	L	97.7	Very high	93	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	139.9	175.7	-70.1	178.6	0	0	0	110.6	V40 F43 L178 L203 G204 I322 R323 L324	V40-L176 HydrophobicContact CG1-CD1 3.77Å; V40-L176 WeakPolarHBondContact O-CD1 3.38Å; F43-L176 HydrophobicContact CD1-CD1 4.49Å; F43-L176 HydrophobicContact CD1-CD2 4.32Å; F43-L176 HydrophobicContact CE1-CD2 4.36Å; L176-L178 HydrophobicContact CB-CD1 4.42Å; L176-L203 CarbonylContact O-C 3.48Å; L176-L203 VanDerWaalsContact O-CA 3.29Å; L176-L203 WeakPolarHBondContact O-CA 3.24Å; L176-G204 PolarHBondContact O-N 3.4Å; L176-I322 HydrophobicContact CD1-CG2 4.35Å; L176-I322 HydrophobicContact CD2-CG2 4.05Å; L176-R323 CarbonylContact C-O 3.44Å; L176-R323 WeakPolarHBondContact CA-O 3.45Å; L176-L324 HydrophobicContact CD2-CD2 3.83Å; L176-L324 HydrophobicContact CD2-CG 4.4Å
177	I	97.8	Very high	91.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	126.6	168.7	-60.1	179	0	0	0	107.8	L201 V202 L203 I322 R323 V325 D329	I177-L201 HydrophobicContact CG2-CB 3.9Å; I177-L201 HydrophobicContact CG2-CD1 4.25Å; I177-L201 HydrophobicContact CG2-CD2 4.12Å; I177-L201 HydrophobicContact CG2-CG 4.32Å; I177-V202 WeakPolarHBondContact CA-O 3.48Å; I177-L203 HydrophobicContact CG1-CD2 4.02Å; I177-I322 WeakPolarHBondContact O-CA 3.43Å; I177-R323 HydrophobicContact CB-CG 4.48Å; I177-R323 PolarHBondContact N-O 2.98Å; I177-R323 PolarHBondContact O-N 3.42Å; I177-V325 HydrophobicContact CD1-CB 3.98Å; I177-V325 HydrophobicContact CD1-CG2 4.01Å; I177-V325 HydrophobicContact CG1-CB 4.31Å; I177-D329 HydrophobicContact CD1-CB 4.23Å; I177-D329 WeakPolarHBondContact CD1-OD2 3.44Å
178	L	98.1	Very high	90.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	132.5	176.5	-56.4	85.2	0	0	0	109.6	V40 L176 V180 L201 V202 F294 I319 D321 I322	V40-L178 HydrophobicContact CG1-CD2 4.14Å; V40-L178 HydrophobicContact CG2-CD2 4.45Å; L176-L178 HydrophobicContact CB-CD1 4.42Å; L178-V180 HydrophobicContact CB-CG2 4.45Å; L178-L201 WeakPolarHBondContact O-CA 3.38Å; L178-V202 HydrophobicContact CB-CG2 3.74Å; L178-V202 HydrophobicContact CD1-CG2 4.22Å; L178-V202 HydrophobicContact CG-CG2 4.45Å; L178-V202 PolarHBondContact N-O 3.45Å; L178-V202 PolarHBondContact O-N 3.4Å; L178-F294 HydrophobicContact CD1-CB 4.01Å; L178-F294 HydrophobicContact CD2-CB 4.25Å; L178-F294 HydrophobicContact CD2-CD1 4.11Å; L178-I319 HydrophobicContact CB-CG2 4.35Å; L178-I319 HydrophobicContact CD2-CD1 4.36Å; L178-I319 HydrophobicContact CD2-CG2 4.21Å; L178-D321 WeakPolarHBondContact CA-O 3.42Å; L178-I322 HydrophobicContact CB-CG1 4.31Å; L178-I322 HydrophobicContact CD2-CD1 3.71Å; L178-I322 HydrophobicContact CD2-CG1 3.91Å; L178-I322 HydrophobicContact CG-CD1 4.11Å; L178-I322 HydrophobicContact CG-CG1 3.81Å; L178-I322 HydrophobicContact CG-CG2 4.36Å
179	S	97.1	Very high	89.1	Confident	18 Å²	18	35.7 Å²	35.7	13%	0.126	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	112.2	172	-63.5	0	0	0	0	110.2	L201 I319 T320 D321	S179-L201 WeakPolarHBondContact OG-CD2 3.46Å; S179-I319 WeakPolarHBondContact O-CA 3.46Å; S179-T320 PolarHBondContact O-N 3.29Å; S179-T320 PolarHBondContact O-OG1 3.38Å; S179-D321 PolarHBondContact N-O 3.02Å
180	V	97.5	Very high	87.5	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.006	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	114.5	-175.4	-170.6	0	0	0	0	110.1	L178 I182 T199 M200 V202 L211 V317 I319	L178-V180 HydrophobicContact CB-CG2 4.45Å; V180-I182 HydrophobicContact CG1-CG1 4.24Å; V180-T199 WeakPolarHBondContact O-CA 3.33Å; V180-M200 PolarHBondContact N-O 3.11Å; V180-M200 PolarHBondContact O-N 3.36Å; V180-V202 HydrophobicContact CG2-CG1 4.18Å; V180-V202 HydrophobicContact CG2-CG2 3.57Å; V180-L211 HydrophobicContact CG1-CD2 4.04Å; V180-V317 HydrophobicContact CG1-CG1 3.49Å; V180-V317 VanDerWaalsContact CG1-CG1 3.49Å; V180-I319 HydrophobicContact CG2-CG1 4.35Å
181	N	95.1	Very high	85.9	Confident	30 Å²	30	41.5 Å²	41.5	16%	0.16	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	128.1	171.7	-76.4	-31	0	0	0	110.1	L183 P196 T199 V317 V318 T320	N181-L183 HydrophobicContact CB-CD1 4.44Å; N181-P196 HydrophobicContact CB-CB 4.08Å; N181-T199 WeakPolarHBondContact OD1-CB 3.32Å; N181-T199 WeakPolarHBondContact OD1-CG2 3.21Å; N181-T199 PolarHBondContact OD1-OG1 3.5Å; N181-V317 CarbonylContact O-C 3.54Å; N181-V317 WeakPolarHBondContact O-CA 3.5Å; N181-V318 HydrophobicContact CB-CB 4.34Å; N181-V318 PolarHBondContact N-O 3.26Å; N181-V318 PolarHBondContact O-N 3.25Å; N181-T320 WeakPolarHBondContact ND2-CG2 3.49Å
182	I	94.5	Very high	84.1	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	116.3	176.5	-60	165.2	0	0	0	106.9	V180 Y197 Q198 M200 L211 I215 H315 V317	V180-I182 HydrophobicContact CG1-CG1 4.24Å; I182-Y197 WeakPolarHBondContact O-CA 3.39Å; I182-Y197 WeakPolarHBondContact O-CB 3.39Å; I182-Y197 PolarHBondContact O-N 2.94Å; I182-Q198 HydrophobicContact CB-CG 3.67Å; I182-Q198 HydrophobicContact CD1-CG 4.05Å; I182-Q198 HydrophobicContact CG1-CG 4.34Å; I182-Q198 HydrophobicContact CG2-CG 4.23Å; I182-Q198 PolarHBondContact N-O 3.01Å; I182-Q198 PolarHBondContact O-N 2.87Å; I182-Q198 VanDerWaalsContact O-N 3.12Å; I182-M200 HydrophobicContact CD1-SD 4.3Å; I182-L211 HydrophobicContact CD1-CD1 4.17Å; I182-I215 HydrophobicContact CD1-CD1 3.72Å; I182-I215 HydrophobicContact CD1-CG1 3.7Å; I182-H315 HydrophobicContact CG2-CB 4.19Å; I182-V317 HydrophobicContact CG1-CG2 4.35Å
183	L	91.1	Very high	82.5	Confident	22 Å²	22	50.5 Å²	50.5	12%	0.115	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	168	-178.4	-78.1	67.9	0	0	0	110.4	N181 R192 H315 V316 V318	N181-L183 HydrophobicContact CB-CD1 4.44Å; L183-R192 WeakPolarHBondContact CD2-O 3.46Å; L183-H315 PolarHBondContact O-ND1 3.44Å; L183-V316 HydrophobicContact CB-CB 4.19Å; L183-V316 HydrophobicContact CD2-CB 4.29Å; L183-V316 HydrophobicContact CD2-CG1 4.46Å; L183-V316 PolarHBondContact N-O 2.82Å; L183-V318 HydrophobicContact CD1-CG2 4.16Å
184	Y	86.5	Confident	81.1	Confident	5 Å²	5	53.4 Å²	53.4	2%	0.02	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55	150.4	173.4	-84.3	-87.3	0	0	0	111.6	V186 F188 H191 Y197 H343 L345	Y184-V186 PolarHBondContact O-N 3Å; Y184-F188 HydrophobicContact CD1-CB 4.26Å; Y184-F188 HydrophobicContact CD1-CD2 4.39Å; Y184-F188 HydrophobicContact CD1-CG 4.19Å; Y184-H191 HydrophobicContact CD2-CB 3.46Å; Y184-H191 VanDerWaalsContact CD2-CB 3.46Å; Y184-H191 HydrophobicContact CE2-CB 3.75Å; Y184-H191 HydrophobicContact CG-CB 3.98Å; Y184-Y197 HydrophobicContact CD1-CD2 4.23Å; Y184-Y197 HydrophobicContact CD1-CG 4.48Å; Y184-Y197 AromaticContact CE1-CD2 3.56Å; Y184-Y197 HydrophobicContact CE1-CD2 3.56Å; Y184-Y197 HydrophobicContact CE1-CE2 4.14Å; Y184-Y197 HydrophobicContact CE1-CG 4.23Å; Y184-Y197 AromaticContact CE2-CD2 3.94Å; Y184-Y197 HydrophobicContact CE2-CD2 3.94Å; Y184-Y197 HydrophobicContact CE2-CG 4.37Å; Y184-Y197 AromaticContact CZ-CD2 3.38Å; Y184-Y197 WeakPolarHBondContact OH-CD2 3.23Å; Y184-H343 HydrophobicContact CE2-CB 4.46Å; Y184-H343 AromaticContact CZ-ND1 3.86Å; Y184-H343 WeakPolarHBondContact OH-CB 3.47Å; Y184-H343 VanDerWaalsContact OH-CG 3.23Å; Y184-H343 PolarHBondContact OH-ND1 2.79Å; Y184-L345 WeakPolarHBondContact OH-CD2 3.41Å
185	P	83.4	Confident	80.1	Confident	3 Å²	3	57.7 Å²	57.7	2%	0.019	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.9	141.5	169.2	-17.6	24	0	0	0	110.4	I187 F188 E314 H315	P185-I187 HydrophobicContact CB-CD1 4.26Å; P185-I187 HydrophobicContact CB-CG1 3.62Å; P185-I187 PolarHBondContact O-N 3.2Å; P185-F188 HydrophobicContact CB-CD2 3.92Å; P185-F188 HydrophobicContact CB-CE2 4.4Å; P185-F188 HydrophobicContact CG-CD2 3.7Å; P185-F188 HydrophobicContact CG-CE2 3.88Å; P185-F188 WeakPolarHBondContact O-CB 3.38Å; P185-F188 PolarHBondContact O-N 3.22Å; P185-E314 CarbonylContact C-O 3.5Å; P185-E314 WeakPolarHBondContact CA-O 3.22Å; P185-H315 VanDerWaalsContact CD-CE1 3.46Å; P185-H315 WeakPolarHBondContact CD-CE1 3.47Å; P185-H315 WeakPolarHBondContact CG-CE1 3.24Å
186	V	75.5	Confident	79.3	Confident	27 Å²	27	57.7 Å²	57.7	16%	0.164	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-29	180	160.8	0	0	0	0	112.6	Y184 F188 R192 E314	Y184-V186 PolarHBondContact O-N 3Å; V186-F188 PolarHBondContact O-N 3.12Å; V186-R192 VanDerWaalsContact CG1-NH2 3.3Å; V186-E314 HydrophobicContact CB-CB 4.18Å; V186-E314 HydrophobicContact CG2-CB 3.89Å; V186-E314 WeakPolarHBondContact CG2-O 3.43Å; V186-E314 PolarHBondContact N-O 3.46Å
187	I	69	Low	78.7	Confident	106 Å²	106	57.9 Å²	57.9	54%	0.544	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-17	175.5	56.6	168.4	0	0	0	114.3	P185 N189	P185-I187 HydrophobicContact CB-CD1 4.26Å; P185-I187 HydrophobicContact CB-CG1 3.62Å; P185-I187 PolarHBondContact O-N 3.2Å; I187-N189 PolarHBondContact O-N 2.89Å
188	F	65.4	Low	78.4	Confident	80 Å²	80	58 Å²	58	35%	0.351	28%	0.276	S	S	.	.			trans	-91.9	90.8	177.1	-77.3	-89.1	0	0	0	112.1	Y184 P185 V186 K190 H191 R192	Y184-F188 HydrophobicContact CD1-CB 4.26Å; Y184-F188 HydrophobicContact CD1-CD2 4.39Å; Y184-F188 HydrophobicContact CD1-CG 4.19Å; P185-F188 HydrophobicContact CB-CD2 3.92Å; P185-F188 HydrophobicContact CB-CE2 4.4Å; P185-F188 HydrophobicContact CG-CD2 3.7Å; P185-F188 HydrophobicContact CG-CE2 3.88Å; P185-F188 WeakPolarHBondContact O-CB 3.38Å; P185-F188 PolarHBondContact O-N 3.22Å; V186-F188 PolarHBondContact O-N 3.12Å; F188-K190 VanDerWaalsContact C-N 3.28Å; F188-K190 PolarHBondContact O-N 2.8Å; F188-K190 VanDerWaalsContact O-N 3.13Å; F188-H191 PolarHBondContact O-N 2.98Å; F188-R192 PolarHBondContact O-N 2.9Å
189	N	62.1	Low	78.1	Confident	148 Å²	148	58.5 Å²	58.5	79%	0.791	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-30	-175.7	-71	-20.5	0	0	0	115.7	I187	I187-N189 PolarHBondContact O-N 2.89Å
190	K	58.3	Low	78	Confident	181 Å²	181	58 Å²	58	79%	0.787	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-26.7	-171.2	-166.9	179.6	176.5	-177.1	0	114.2	F188	F188-K190 VanDerWaalsContact C-N 3.28Å; F188-K190 PolarHBondContact O-N 2.8Å; F188-K190 VanDerWaalsContact O-N 3.13Å
191	H	62.6	Low	78	Confident	58 Å²	58	58.7 Å²	58.7	27%	0.269	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.5	12	-167.6	-62.4	-50.5	0	0	0	113.9	Y184 F188 E193	Y184-H191 HydrophobicContact CD2-CB 3.46Å; Y184-H191 VanDerWaalsContact CD2-CB 3.46Å; Y184-H191 HydrophobicContact CE2-CB 3.75Å; Y184-H191 HydrophobicContact CG-CB 3.98Å; F188-H191 PolarHBondContact O-N 2.98Å; H191-E193 VanDerWaalsContact C-N 3.3Å; H191-E193 PolarHBondContact O-N 3.5Å
192	R	58	Low	78.1	Confident	99 Å²	99	57.3 Å²	57.3	37%	0.374	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-30.5	-171.4	-175.6	-180	173.5	-177.1	0.7	114.6	L183 V186 F188	L183-R192 WeakPolarHBondContact CD2-O 3.46Å; V186-R192 VanDerWaalsContact CG1-NH2 3.3Å; F188-R192 PolarHBondContact O-N 2.9Å
193	E	59.6	Low	78.3	Confident	141 Å²	141	57.3 Å²	57.3	66%	0.659	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.4	-15.3	-163.2	-64	-179	-177.2	0	0	115.4	H191	H191-E193 VanDerWaalsContact C-N 3.3Å; H191-E193 PolarHBondContact O-N 3.5Å
194	H	64.4	Low	78.6	Confident	169 Å²	169	56.3 Å²	56.3	78%	0.782	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.2	-13.3	-165.7	-52.9	-32.8	0	0	0	115.2
195	K	72	Confident	79.2	Confident	92 Å²	92	58.4 Å²	58.4	40%	0.4	28%	0.281	S	S	.	.			trans	-130.7	115	-176.2	-161.4	172.4	-168.2	178.4	0	110.5	Y197 H343	K195-Y197 PolarHBondContact O-N 3.15Å; K195-H343 WeakPolarHBondContact CE-CD2 3.29Å; K195-H343 PolarHBondContact NZ-CD2 2.88Å; K195-H343 PolarHBondContact NZ-NE2 2.89Å
196	P	79.3	Confident	79.9	Confident	31 Å²	31	58.6 Å²	58.6	20%	0.201	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	133.5	170.9	25.7	-31.9	0	0	0	108.5	N181 Q198	N181-P196 HydrophobicContact CB-CB 4.08Å; P196-Q198 VanDerWaalsContact C-N 3.35Å
197	Y	85.3	Confident	80.9	Confident	5 Å²	5	61.6 Å²	61.6	2%	0.02	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	-40.2	173	172.4	-117.4	0	0	0	110	I182 Y184 K195 C216 K342 H343 L345	I182-Y197 WeakPolarHBondContact O-CA 3.39Å; I182-Y197 WeakPolarHBondContact O-CB 3.39Å; I182-Y197 PolarHBondContact O-N 2.94Å; Y184-Y197 HydrophobicContact CD1-CD2 4.23Å; Y184-Y197 HydrophobicContact CD1-CG 4.48Å; Y184-Y197 AromaticContact CE1-CD2 3.56Å; Y184-Y197 HydrophobicContact CE1-CD2 3.56Å; Y184-Y197 HydrophobicContact CE1-CE2 4.14Å; Y184-Y197 HydrophobicContact CE1-CG 4.23Å; Y184-Y197 AromaticContact CE2-CD2 3.94Å; Y184-Y197 HydrophobicContact CE2-CD2 3.94Å; Y184-Y197 HydrophobicContact CE2-CG 4.37Å; Y184-Y197 AromaticContact CZ-CD2 3.38Å; Y184-Y197 WeakPolarHBondContact OH-CD2 3.23Å; K195-Y197 PolarHBondContact O-N 3.15Å; Y197-C216 WeakPolarHBondContact CE1-O 3.38Å; Y197-C216 PolarHBondContact OH-O 2.78Å; Y197-K342 CarbonylContact O-C 3.57Å; Y197-K342 WeakPolarHBondContact O-CA 3.42Å; Y197-K342 WeakPolarHBondContact OH-CE 3.41Å; Y197-H343 HydrophobicContact CD2-CB 4.17Å; Y197-H343 PolarHBondContact O-N 2.96Å; Y197-L345 HydrophobicContact CE2-CD1 3.94Å; Y197-L345 HydrophobicContact CE2-CG 4.5Å
198	Q	90.8	Very high	82.3	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	148.1	174.5	60.8	-170.9	13.6	0	0	110.6	I182 P196 L339 K341	I182-Q198 HydrophobicContact CB-CG 3.67Å; I182-Q198 HydrophobicContact CD1-CG 4.05Å; I182-Q198 HydrophobicContact CG1-CG 4.34Å; I182-Q198 HydrophobicContact CG2-CG 4.23Å; I182-Q198 PolarHBondContact N-O 3.01Å; I182-Q198 PolarHBondContact O-N 2.87Å; I182-Q198 VanDerWaalsContact O-N 3.12Å; P196-Q198 VanDerWaalsContact C-N 3.35Å; Q198-L339 HydrophobicContact CB-CD1 3.88Å; Q198-K341 CarbonylContact C-O 3.47Å; Q198-K341 WeakPolarHBondContact CA-O 3.35Å
199	T	93	Very high	83.9	Confident	12 Å²	12	53.1 Å²	53.1	7%	0.074	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	128.4	169.9	-53.4	0	0	0	0	107.9	V180 N181 I340 K341	V180-T199 WeakPolarHBondContact O-CA 3.33Å; N181-T199 WeakPolarHBondContact OD1-CB 3.32Å; N181-T199 WeakPolarHBondContact OD1-CG2 3.21Å; N181-T199 PolarHBondContact OD1-OG1 3.5Å; T199-I340 HydrophobicContact CG2-CD1 3.76Å; T199-I340 HydrophobicContact CG2-CG1 3.81Å; T199-I340 WeakPolarHBondContact O-CG1 3.33Å; T199-I340 PolarHBondContact O-N 3.35Å; T199-K341 PolarHBondContact N-O 2.9Å; T199-K341 PolarHBondContact O-N 3.33Å; T199-K341 VanDerWaalsContact O-N 3.15Å
200	M	95	Very high	85.6	Confident	6 Å²	6	49.1 Å²	49.1	3%	0.03	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	143.4	-178.7	-65.4	-177.9	152.7	0	0	110.1	V180 I182 L211 S214 L338 L339	V180-M200 PolarHBondContact N-O 3.11Å; V180-M200 PolarHBondContact O-N 3.36Å; I182-M200 HydrophobicContact CD1-SD 4.3Å; M200-L211 HydrophobicContact CB-CD1 4.45Å; M200-L211 HydrophobicContact SD-CD1 3.67Å; M200-S214 VanDerWaalsContact CE-O 3.3Å; M200-S214 WeakPolarHBondContact CE-O 3.28Å; M200-L338 CarbonylContact C-O 3.55Å; M200-L338 VanDerWaalsContact CA-O 3.24Å; M200-L338 WeakPolarHBondContact CA-O 3.35Å; M200-L339 HydrophobicContact CE-CB 4.27Å; M200-L339 HydrophobicContact CE-CD1 3.83Å; M200-L339 HydrophobicContact CG-CD1 4.03Å
201	L	96.9	Very high	87.4	Confident	17 Å²	17	40.5 Å²	40.5	9%	0.089	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	128.6	164.2	-56.8	-177.1	0	0	0	108.3	I177 L178 S179 Y336 P337 L338 I340	I177-L201 HydrophobicContact CG2-CB 3.9Å; I177-L201 HydrophobicContact CG2-CD1 4.25Å; I177-L201 HydrophobicContact CG2-CD2 4.12Å; I177-L201 HydrophobicContact CG2-CG 4.32Å; L178-L201 WeakPolarHBondContact O-CA 3.38Å; S179-L201 WeakPolarHBondContact OG-CD2 3.46Å; L201-Y336 HydrophobicContact CB-CD1 4.39Å; L201-Y336 HydrophobicContact CB-CE1 3.9Å; L201-Y336 WeakPolarHBondContact O-CD1 3.28Å; L201-P337 CarbonylContact O-C 3.52Å; L201-P337 WeakPolarHBondContact O-CA 3.19Å; L201-L338 HydrophobicContact CB-CB 4.27Å; L201-L338 HydrophobicContact CD1-CD2 4.32Å; L201-L338 PolarHBondContact N-O 3.25Å; L201-L338 PolarHBondContact O-N 3.47Å; L201-I340 HydrophobicContact CD1-CD1 4.43Å; L201-I340 HydrophobicContact CD1-CG2 3.87Å; L201-I340 HydrophobicContact CD2-CD1 3.82Å; L201-I340 HydrophobicContact CG-CD1 3.94Å; L201-I340 HydrophobicContact CG-CG1 4.32Å; L201-I340 HydrophobicContact CG-CG2 3.86Å
202	V	98.1	Very high	89	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	147.5	174.8	-59.6	0	0	0	0	109.5	I177 L178 V180 L211 F294 P337	I177-V202 WeakPolarHBondContact CA-O 3.48Å; L178-V202 HydrophobicContact CB-CG2 3.74Å; L178-V202 HydrophobicContact CD1-CG2 4.22Å; L178-V202 HydrophobicContact CG-CG2 4.45Å; L178-V202 PolarHBondContact N-O 3.45Å; L178-V202 PolarHBondContact O-N 3.4Å; V180-V202 HydrophobicContact CG2-CG1 4.18Å; V180-V202 HydrophobicContact CG2-CG2 3.57Å; V202-L211 HydrophobicContact CG1-CB 4.38Å; V202-L211 HydrophobicContact CG1-CD1 3.87Å; V202-L211 HydrophobicContact CG1-CG 4.47Å; V202-F294 HydrophobicContact CB-CD2 4.16Å; V202-F294 HydrophobicContact CB-CE2 3.93Å; V202-F294 HydrophobicContact CB-CZ 4.32Å; V202-F294 HydrophobicContact CG1-CE2 4.17Å; V202-F294 HydrophobicContact CG1-CZ 4.29Å; V202-F294 HydrophobicContact CG2-CD1 4Å; V202-F294 HydrophobicContact CG2-CD2 3.83Å; V202-F294 HydrophobicContact CG2-CE1 3.94Å; V202-F294 HydrophobicContact CG2-CE2 3.77Å; V202-F294 HydrophobicContact CG2-CG 3.96Å; V202-F294 HydrophobicContact CG2-CZ 3.84Å; V202-P337 HydrophobicContact CG1-CB 3.96Å; V202-P337 HydrophobicContact CG1-CG 4.2Å
203	L	98.4	Very high	90.8	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	149.7	174.2	-50.6	176	0	0	0	110.4	I171 E175 L176 I177 S205 Q206 R333 Y336	I171-L203 HydrophobicContact CD1-CD1 3.95Å; I171-L203 HydrophobicContact CD1-CD2 3.78Å; I171-L203 HydrophobicContact CG1-CD1 4.06Å; E175-L203 HydrophobicContact CG-CB 4.24Å; E175-L203 HydrophobicContact CG-CD2 4.19Å; L176-L203 CarbonylContact O-C 3.48Å; L176-L203 VanDerWaalsContact O-CA 3.29Å; L176-L203 WeakPolarHBondContact O-CA 3.24Å; I177-L203 HydrophobicContact CG1-CD2 4.02Å; L203-S205 PolarHBondContact O-N 3.33Å; L203-Q206 HydrophobicContact CB-CB 4.41Å; L203-Q206 HydrophobicContact CB-CG 3.97Å; L203-Q206 HydrophobicContact CD1-CG 4.43Å; L203-Q206 HydrophobicContact CG-CG 4.36Å; L203-Q206 WeakPolarHBondContact O-CB 3.45Å; L203-Q206 PolarHBondContact O-N 2.98Å; L203-Q206 VanDerWaalsContact O-N 3.11Å; L203-R333 HydrophobicContact CD1-CG 3.82Å; L203-Y336 HydrophobicContact CD1-CD2 4.32Å; L203-Y336 HydrophobicContact CD1-CG 4.11Å; L203-Y336 HydrophobicContact CD2-CD1 3.56Å; L203-Y336 HydrophobicContact CD2-CD2 4.24Å; L203-Y336 HydrophobicContact CD2-CE1 3.53Å; L203-Y336 HydrophobicContact CD2-CE2 4.23Å; L203-Y336 HydrophobicContact CD2-CG 3.92Å; L203-Y336 HydrophobicContact CG-CD1 3.72Å; L203-Y336 HydrophobicContact CG-CD2 4.35Å; L203-Y336 HydrophobicContact CG-CE1 4.24Å; L203-Y336 HydrophobicContact CG-CG 3.79Å
204	G	98	Very high	92.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-40.1	173.1	0	0	0	0	0	111.8	E175 L176 Q206 F294 N295	E175-G204 PolarHBondContact OE1-N 3.46Å; L176-G204 PolarHBondContact O-N 3.4Å; G204-Q206 VanDerWaalsContact C-N 3.3Å; G204-Q206 PolarHBondContact O-N 3.05Å; G204-F294 CarbonylContact O-C 3.58Å; G204-F294 PolarHBondContact O-N 3.42Å; G204-N295 VanDerWaalsContact CA-OD1 3.32Å; G204-N295 WeakPolarHBondContact CA-OD1 3.35Å; G204-N295 VanDerWaalsContact O-CG 3.23Å; G204-N295 PolarHBondContact O-N 3.41Å; G204-N295 PolarHBondContact O-ND2 3.38Å
205	S	97.8	Very high	93.7	Very high	49 Å²	49	24.2 Å²	24.2	34%	0.343	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-11.7	178.4	55.4	0	0	0	0	115.3	E175 L203 T293 N295	E175-S205 VanDerWaalsContact CD-OG 3.25Å; E175-S205 PolarHBondContact OE1-N 2.94Å; E175-S205 VanDerWaalsContact OE2-CB 3.26Å; E175-S205 WeakPolarHBondContact OE2-CB 3.45Å; E175-S205 PolarHBondContact OE2-OG 3.18Å; L203-S205 PolarHBondContact O-N 3.33Å; S205-T293 VanDerWaalsContact O-CG2 3.31Å; S205-T293 WeakPolarHBondContact O-CG2 3.35Å; S205-N295 PolarHBondContact N-ND2 2.95Å
206	Q	97.6	Very high	94.5	Very high	7 Å²	7	21.3 Å²	21.3	3%	0.033	12%	0.117	C	C	.	.	S	Bend	trans	-74.5	145.4	180	-82.9	-172.9	-47.1	0	0	112.6	L203 G204 E210 T293 F294 Y336	L203-Q206 HydrophobicContact CB-CB 4.41Å; L203-Q206 HydrophobicContact CB-CG 3.97Å; L203-Q206 HydrophobicContact CD1-CG 4.43Å; L203-Q206 HydrophobicContact CG-CG 4.36Å; L203-Q206 WeakPolarHBondContact O-CB 3.45Å; L203-Q206 PolarHBondContact O-N 2.98Å; L203-Q206 VanDerWaalsContact O-N 3.11Å; G204-Q206 VanDerWaalsContact C-N 3.3Å; G204-Q206 PolarHBondContact O-N 3.05Å; Q206-E210 WeakPolarHBondContact CG-OE2 3.5Å; Q206-E210 PolarHBondContact NE2-OE2 3.17Å; Q206-T293 CarbonylContact O-C 3.56Å; Q206-T293 WeakPolarHBondContact O-CA 3.34Å; Q206-T293 WeakPolarHBondContact O-CB 3.33Å; Q206-F294 WeakPolarHBondContact O-CD2 3.34Å; Q206-F294 PolarHBondContact O-N 3.32Å; Q206-F294 VanDerWaalsContact O-N 3.07Å; Q206-Y336 PolarHBondContact NE2-O 2.73Å
207	K	98.3	Very high	94.9	Very high	91 Å²	91	19.8 Å²	19.8	40%	0.396	11%	0.108	S	C	.	.	B	Isolated β-bridge	trans	-71.7	148.3	174.7	-64.9	-172.1	172.3	-156.9	0	111	T209 E210 E290 F292 T293	K207-T209 WeakPolarHBondContact CB-OG1 3.31Å; K207-T209 PolarHBondContact O-N 2.81Å; K207-T209 VanDerWaalsContact O-N 3.14Å; K207-E210 HydrophobicContact CB-CG 4.29Å; K207-E210 PolarHBondContact N-OE1 3.07Å; K207-E210 WeakPolarHBondContact O-CB 3.44Å; K207-E210 PolarHBondContact O-N 3.31Å; K207-E290 WeakPolarHBondContact CD-O 3.43Å; K207-E290 WeakPolarHBondContact CE-O 3.49Å; K207-E290 PolarHBondContact NZ-O 2.9Å; K207-F292 WeakPolarHBondContact CA-O 3.38Å; K207-T293 HydrophobicContact CG-CG2 4.41Å
208	L	98.4	Very high	94.9	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-58.7	-30.9	174.8	-54.9	-177.3	0	0	0	112.1	E210 L211 R212 F248 Y255 M289 F292 F294 L297	L208-E210 VanDerWaalsContact C-N 3.26Å; L208-E210 PolarHBondContact O-N 3.09Å; L208-L211 PolarHBondContact O-N 2.92Å; L208-R212 PolarHBondContact O-N 3.4Å; L208-F248 HydrophobicContact CB-CD2 4.23Å; L208-F248 HydrophobicContact CB-CE2 4.43Å; L208-F248 WeakPolarHBondContact O-CE2 3.44Å; L208-Y255 HydrophobicContact CD1-CD1 3.74Å; L208-Y255 HydrophobicContact CD1-CD2 4.33Å; L208-Y255 HydrophobicContact CD1-CE1 4.36Å; L208-Y255 HydrophobicContact CD1-CG 3.72Å; L208-M289 HydrophobicContact CB-CG 3.62Å; L208-M289 HydrophobicContact CB-SD 4.46Å; L208-M289 HydrophobicContact CD1-CG 4.46Å; L208-F292 HydrophobicContact CD1-CB 4.03Å; L208-F292 HydrophobicContact CG-CB 4.33Å; L208-F292 PolarHBondContact N-O 2.83Å; L208-F292 VanDerWaalsContact N-O 3.14Å; L208-F294 HydrophobicContact CD2-CD1 4.14Å; L208-F294 HydrophobicContact CD2-CD2 4.13Å; L208-F294 HydrophobicContact CD2-CE1 3.98Å; L208-F294 HydrophobicContact CD2-CE2 3.96Å; L208-F294 HydrophobicContact CD2-CG 4.2Å; L208-F294 HydrophobicContact CD2-CZ 3.86Å; L208-L297 HydrophobicContact CD1-CD2 4.12Å; L208-L297 HydrophobicContact CD2-CD1 3.78Å; L208-L297 HydrophobicContact CD2-CD2 4.35Å; L208-L297 HydrophobicContact CD2-CG 4.25Å
209	T	97.8	Very high	94.7	Very high	8 Å²	8	20.6 Å²	20.6	5%	0.049	11%	0.113	C	C	.	.	H	α-helix	trans	-62.4	-30.8	175.6	50	0	0	0	0	113.3	K207 R212 D213 R259 M289 E290	K207-T209 WeakPolarHBondContact CB-OG1 3.31Å; K207-T209 PolarHBondContact O-N 2.81Å; K207-T209 VanDerWaalsContact O-N 3.14Å; T209-R212 WeakPolarHBondContact O-CB 3.3Å; T209-R212 PolarHBondContact O-N 2.93Å; T209-D213 PolarHBondContact O-N 2.88Å; T209-R259 HydrophobicContact CG2-CG 4.39Å; T209-M289 HydrophobicContact CG2-CB 4.08Å; T209-M289 HydrophobicContact CG2-CG 3.73Å; T209-M289 HydrophobicContact CG2-SD 3.79Å; T209-E290 HydrophobicContact CG2-CB 4.01Å
210	E	97.8	Very high	94.6	Very high	63 Å²	63	20.2 Å²	20.2	29%	0.294	11%	0.111	S	C	.	.	H	α-helix	trans	-69.7	-41	178.1	-65.6	172.5	-110.6	0	0	110.4	Q206 K207 L208 D213 S214 P337	Q206-E210 WeakPolarHBondContact CG-OE2 3.5Å; Q206-E210 PolarHBondContact NE2-OE2 3.17Å; K207-E210 HydrophobicContact CB-CG 4.29Å; K207-E210 PolarHBondContact N-OE1 3.07Å; K207-E210 WeakPolarHBondContact O-CB 3.44Å; K207-E210 PolarHBondContact O-N 3.31Å; L208-E210 VanDerWaalsContact C-N 3.26Å; L208-E210 PolarHBondContact O-N 3.09Å; E210-D213 PolarHBondContact O-N 3.3Å; E210-S214 WeakPolarHBondContact O-CB 3.43Å; E210-S214 PolarHBondContact O-N 2.65Å; E210-S214 PolarHBondContact O-OG 3.05Å; E210-P337 HydrophobicContact CB-CG 4.29Å
211	L	97.1	Very high	94.1	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-61	-51.1	170.6	179.7	61.1	0	0	0	110.4	V180 I182 M200 V202 L208 D213 S214 I215 F248 F294	V180-L211 HydrophobicContact CG1-CD2 4.04Å; I182-L211 HydrophobicContact CD1-CD1 4.17Å; M200-L211 HydrophobicContact CB-CD1 4.45Å; M200-L211 HydrophobicContact SD-CD1 3.67Å; V202-L211 HydrophobicContact CG1-CB 4.38Å; V202-L211 HydrophobicContact CG1-CD1 3.87Å; V202-L211 HydrophobicContact CG1-CG 4.47Å; L208-L211 PolarHBondContact O-N 2.92Å; L211-D213 VanDerWaalsContact C-N 3.25Å; L211-D213 PolarHBondContact O-N 2.81Å; L211-S214 WeakPolarHBondContact O-CA 3.35Å; L211-S214 WeakPolarHBondContact O-CB 3.42Å; L211-S214 PolarHBondContact O-N 3.37Å; L211-I215 HydrophobicContact CG-CD1 4.47Å; L211-I215 HydrophobicContact CG-CG1 4.48Å; L211-I215 WeakPolarHBondContact O-CG1 3.5Å; L211-I215 PolarHBondContact O-N 3.03Å; L211-I215 VanDerWaalsContact O-N 3.12Å; L211-F248 HydrophobicContact CB-CZ 4.4Å; L211-F248 HydrophobicContact CD2-CE1 4.13Å; L211-F248 HydrophobicContact CD2-CZ 3.91Å; L211-F248 HydrophobicContact CG-CZ 4.06Å; L211-F294 HydrophobicContact CB-CE2 4.12Å; L211-F294 HydrophobicContact CB-CZ 3.91Å; L211-F294 HydrophobicContact CD2-CE1 4.31Å; L211-F294 HydrophobicContact CD2-CZ 3.6Å; L211-F294 HydrophobicContact CG-CZ 4.36Å
212	R	95.8	Very high	93.5	Very high	12 Å²	12	24.8 Å²	24.8	5%	0.045	13%	0.132	C	C	.	.	H	α-helix	trans	-48.4	-49.4	178.4	-177.9	-148	163.6	-157.6	-14.5	111.5	L208 T209 S214 I215 K244 A246 F248 D257 R259 M289 Y307	L208-R212 PolarHBondContact O-N 3.4Å; T209-R212 WeakPolarHBondContact O-CB 3.3Å; T209-R212 PolarHBondContact O-N 2.93Å; R212-S214 PolarHBondContact O-N 3.24Å; R212-I215 PolarHBondContact O-N 2.92Å; R212-K244 PolarHBondContact NH1-O 3.24Å; R212-K244 PolarHBondContact NH2-O 3.31Å; R212-A246 HydrophobicContact CG-CB 4.36Å; R212-F248 HydrophobicContact CB-CE2 4.01Å; R212-F248 HydrophobicContact CB-CZ 4.45Å; R212-D257 WeakPolarHBondContact CD-OD2 3.21Å; R212-D257 IonicContact CZ-OD2 3.66Å; R212-D257 IonicContact NE-OD2 2.88Å; R212-D257 IonicContact NH1-OD1 3.22Å; R212-D257 IonicContact NH1-OD2 2.68Å; R212-D257 PolarHBondContact NH1-OD2 2.83Å; R212-R259 VanDerWaalsContact NH1-NH2 3.11Å; R212-M289 HydrophobicContact CB-SD 4.02Å; R212-M289 HydrophobicContact CG-SD 4.37Å; R212-Y307 HydrophobicContact CG-CE2 3.98Å; R212-Y307 WeakPolarHBondContact CG-OH 3.39Å
213	D	94.8	Very high	93	Very high	69 Å²	69	26.2 Å²	26.2	37%	0.369	14%	0.14	S	C	.	.	H	α-helix	trans	-66.4	-31.9	-175.8	-68	-15.7	0	0	0	111.8	T209 E210 L211 K240 R259	T209-D213 PolarHBondContact O-N 2.88Å; E210-D213 PolarHBondContact O-N 3.3Å; L211-D213 VanDerWaalsContact C-N 3.25Å; L211-D213 PolarHBondContact O-N 2.81Å; D213-K240 PolarHBondContact O-NZ 2.81Å; D213-R259 IonicContact OD1-CZ 2.64Å; D213-R259 IonicContact OD1-NH1 3.94Å; D213-R259 IonicContact OD1-NH2 3.98Å; D213-R259 PolarHBondContact OD1-NH2 3.26Å; D213-R259 IonicContact OD2-CZ 2.68Å; D213-R259 IonicContact OD2-NH1 3.06Å; D213-R259 PolarHBondContact OD2-NH1 3.32Å; D213-R259 IonicContact OD2-NH2 3.58Å; D213-R259 PolarHBondContact OD2-NH2 2.61Å
214	S	93.8	Very high	92.3	Very high	43 Å²	43	28.3 Å²	28.3	30%	0.301	16%	0.161	S	C	.	.	H	α-helix	trans	-77	-21.7	179.3	-54.4	0	0	0	0	113.6	M200 E210 L211 R212 C216 P337	M200-S214 VanDerWaalsContact CE-O 3.3Å; M200-S214 WeakPolarHBondContact CE-O 3.28Å; E210-S214 WeakPolarHBondContact O-CB 3.43Å; E210-S214 PolarHBondContact O-N 2.65Å; E210-S214 PolarHBondContact O-OG 3.05Å; L211-S214 WeakPolarHBondContact O-CA 3.35Å; L211-S214 WeakPolarHBondContact O-CB 3.42Å; L211-S214 PolarHBondContact O-N 3.37Å; R212-S214 PolarHBondContact O-N 3.24Å; S214-C216 PolarHBondContact O-N 2.86Å; S214-P337 WeakPolarHBondContact OG-CD 3.4Å; S214-P337 WeakPolarHBondContact OG-CG 3.33Å
215	I	92.9	Very high	91.8	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	18%	0.18	C	C	.	.			trans	-62	123.1	178.5	-61.4	-174.7	0	0	0	110.3	I182 L211 R212 C217 K240 F248 Y307	I182-I215 HydrophobicContact CD1-CD1 3.72Å; I182-I215 HydrophobicContact CD1-CG1 3.7Å; L211-I215 HydrophobicContact CG-CD1 4.47Å; L211-I215 HydrophobicContact CG-CG1 4.48Å; L211-I215 WeakPolarHBondContact O-CG1 3.5Å; L211-I215 PolarHBondContact O-N 3.03Å; L211-I215 VanDerWaalsContact O-N 3.12Å; R212-I215 PolarHBondContact O-N 2.92Å; I215-C217 HydrophobicContact CG2-CB 4.39Å; I215-K240 PolarHBondContact O-NZ 2.84Å; I215-F248 HydrophobicContact CD1-CE1 4.25Å; I215-F248 HydrophobicContact CD1-CZ 4.02Å; I215-Y307 HydrophobicContact CB-CE1 4.44Å; I215-Y307 HydrophobicContact CD1-CD1 3.62Å; I215-Y307 HydrophobicContact CD1-CD2 4.29Å; I215-Y307 HydrophobicContact CD1-CE1 3.57Å; I215-Y307 HydrophobicContact CD1-CE2 4.25Å; I215-Y307 HydrophobicContact CD1-CG 3.99Å; I215-Y307 HydrophobicContact CG2-CE1 3.99Å
216	C	88.1	Confident	91.6	Very high	30 Å²	30	31 Å²	31	20%	0.203	18%	0.179	C	C	.	.			trans	-103	66.3	-179.8	-177	0	0	0	0	111.4	Y197 S214 K342	Y197-C216 WeakPolarHBondContact CE1-O 3.38Å; Y197-C216 PolarHBondContact OH-O 2.78Å; S214-C216 PolarHBondContact O-N 2.86Å; C216-K342 PolarHBondContact SG-NZ 2.92Å
217	C	88.4	Confident	91.4	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.183	C	C	.	.			trans	-72.7	143.3	-179.9	-179.2	0	0	0	0	112.3	I215 S219 D220 H309 H315	I215-C217 HydrophobicContact CG2-CB 4.39Å; C217-S219 PolarHBondContact O-N 3.13Å; C217-S219 PolarHBondContact SG-N 3.42Å; C217-D220 HydrophobicContact CB-CB 4.37Å; C217-D220 WeakPolarHBondContact O-CB 3.37Å; C217-D220 PolarHBondContact O-N 2.93Å; C217-D220 VanDerWaalsContact O-N 3.1Å; C217-H309 VanDerWaalsContact CB-CE1 3.45Å; C217-H309 WeakPolarHBondContact CB-CE1 3.4Å; C217-H309 WeakPolarHBondContact CB-NE2 3.43Å; C217-H309 PolarHBondContact SG-NE2 3.31Å; C217-H315 VanDerWaalsContact SG-CE1 3.53Å; C217-H315 PolarHBondContact SG-NE2 3.2Å
218	V	84.5	Confident	91.2	Very high	16 Å²	16	27.8 Å²	27.8	10%	0.097	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-60.3	-35.9	173.8	178.3	0	0	0	0	111.8	D220 L221 L345 P403	V218-D220 PolarHBondContact O-N 3.29Å; V218-L221 WeakPolarHBondContact O-CB 3.16Å; V218-L221 PolarHBondContact O-N 2.74Å; V218-L221 VanDerWaalsContact O-N 3.16Å; V218-L345 HydrophobicContact CG2-CD1 4.12Å; V218-P403 HydrophobicContact CG1-CB 4.24Å; V218-P403 HydrophobicContact CG1-CG 3.78Å; V218-P403 HydrophobicContact CG2-CB 3.9Å; V218-P403 HydrophobicContact CG2-CG 4.31Å
219	S	87.4	Confident	90.9	Very high	6 Å²	6	32 Å²	32	4%	0.042	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-64.4	-28.9	176.9	-51.3	0	0	0	0	112.5	C217 L221 Q222 S239 Q310 C313	C217-S219 PolarHBondContact O-N 3.13Å; C217-S219 PolarHBondContact SG-N 3.42Å; S219-L221 PolarHBondContact O-N 3.23Å; S219-Q222 PolarHBondContact O-N 3.48Å; S219-S239 VanDerWaalsContact O-CB 3.26Å; S219-S239 WeakPolarHBondContact O-CB 3.28Å; S219-Q310 PolarHBondContact O-NE2 3.37Å; S219-Q310 PolarHBondContact O-OE1 3.41Å; S219-C313 PolarHBondContact OG-SG 3.28Å
220	D	89.1	Confident	90.6	Very high	5 Å²	5	34.2 Å²	34.2	3%	0.027	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-66.2	-27.8	176.1	-84.9	-17.3	0	0	0	112.8	C217 V218 I238 S239 K240 H309 Q310	C217-D220 HydrophobicContact CB-CB 4.37Å; C217-D220 WeakPolarHBondContact O-CB 3.37Å; C217-D220 PolarHBondContact O-N 2.93Å; C217-D220 VanDerWaalsContact O-N 3.1Å; V218-D220 PolarHBondContact O-N 3.29Å; D220-I238 WeakPolarHBondContact O-CB 3.35Å; D220-S239 PolarHBondContact O-N 2.8Å; D220-K240 HydrophobicContact CB-CB 3.78Å; D220-K240 HydrophobicContact CB-CD 4Å; D220-K240 HydrophobicContact CB-CG 4.17Å; D220-K240 PolarHBondContact O-N 2.81Å; D220-H309 VanDerWaalsContact CG-CE1 3.4Å; D220-H309 IonicContact OD1-CE1 3.5Å; D220-H309 PolarHBondContact OD1-CE1 3.19Å; D220-H309 IonicContact OD1-ND1 2.82Å; D220-H309 PolarHBondContact OD1-ND1 3.37Å; D220-H309 IonicContact OD2-CE1 3.68Å; D220-H309 IonicContact OD2-ND1 3.62Å; D220-Q310 PolarHBondContact OD1-NE2 2.87Å
221	L	84.9	Confident	90.2	Very high	14 Å²	14	31.7 Å²	31.7	7%	0.073	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-88.8	-10.6	-175.8	-57.2	171.1	0	0	0	113	V218 S219 I238 V401 F406	V218-L221 WeakPolarHBondContact O-CB 3.16Å; V218-L221 PolarHBondContact O-N 2.74Å; V218-L221 VanDerWaalsContact O-N 3.16Å; S219-L221 PolarHBondContact O-N 3.23Å; L221-I238 HydrophobicContact CD2-CD1 4.39Å; L221-V401 HydrophobicContact CB-CB 4.37Å; L221-V401 HydrophobicContact CB-CG1 3.95Å; L221-V401 WeakPolarHBondContact O-CB 3.33Å; L221-V401 WeakPolarHBondContact O-CG2 3.35Å; L221-F406 HydrophobicContact CB-CE2 4.39Å; L221-F406 HydrophobicContact CD1-CD2 3.22Å; L221-F406 HydrophobicContact CD1-CE2 3.28Å; L221-F406 HydrophobicContact CD1-CG 4.06Å; L221-F406 HydrophobicContact CD1-CZ 4.13Å; L221-F406 HydrophobicContact CD2-CD2 4.14Å; L221-F406 HydrophobicContact CD2-CE1 4.04Å; L221-F406 HydrophobicContact CD2-CE2 3.58Å; L221-F406 HydrophobicContact CD2-CZ 3.51Å; L221-F406 HydrophobicContact CG-CD2 4.26Å; L221-F406 HydrophobicContact CG-CE2 3.91Å; L221-F406 HydrophobicContact CG-CZ 4.35Å
222	Q	84.9	Confident	89.9	Confident	104 Å²	104	37.8 Å²	37.8	49%	0.486	23%	0.23	S	C	.	.			trans	-68.2	152.1	-178.8	-67.3	-175.4	-3.9	0	0	111	S219 I238 S239	S219-Q222 PolarHBondContact O-N 3.48Å; Q222-I238 CarbonylContact O-C 3.31Å; Q222-S239 WeakPolarHBondContact O-CB 3.12Å; Q222-S239 PolarHBondContact O-N 2.78Å; Q222-S239 PolarHBondContact O-OG 2.66Å
223	I	86.8	Confident	89.5	Confident	31 Å²	31	44 Å²	44	16%	0.159	26%	0.259	C	S	.	.			trans	-114.9	117.5	173.1	-61.2	167.3	0	0	0	106.4	P235 I238 P399 V401	I223-P235 HydrophobicContact CG2-CG 3.75Å; I223-I238 HydrophobicContact CG1-CG2 4.46Å; I223-P399 HydrophobicContact CB-CB 4.04Å; I223-P399 HydrophobicContact CB-CG 4.36Å; I223-P399 HydrophobicContact CD1-CB 3.98Å; I223-P399 HydrophobicContact CG2-CB 4.25Å; I223-P399 HydrophobicContact CG2-CG 4.06Å; I223-V401 HydrophobicContact CD1-CG2 4.1Å; I223-V401 HydrophobicContact CG1-CG2 4.37Å
224	G	83.7	Confident	88.9	Confident	45 Å²	45	42 Å²	42	46%	0.464	25%	0.253	S	S	.	.			trans	-77.2	140	-179.5	0	0	0	0	0	112.2
225	G	87.8	Confident	88.3	Confident	38 Å²	38	42.2 Å²	42.2	39%	0.392	25%	0.253	S	S	.	.	S	Bend	trans	120.2	156.5	171	0	0	0	0	0	114.1	F227 Y398	G225-F227 VanDerWaalsContact O-CD2 3.26Å; G225-F227 WeakPolarHBondContact O-CD2 3Å; G225-F227 VanDerWaalsContact O-CE2 3.31Å; G225-F227 WeakPolarHBondContact O-CE2 3.45Å; G225-Y398 WeakPolarHBondContact O-CD1 3.27Å
226	E	93.4	Very high	87.3	Confident	67 Å²	67	50.8 Å²	50.8	31%	0.313	29%	0.293	S	S	.	.			trans	-100	130.8	177.7	-163.1	-68.2	138.6	0	0	108.7	S228 L396 A397 Y398	E226-S228 VanDerWaalsContact CD-OG 3.3Å; E226-S228 WeakPolarHBondContact OE1-CA 3.44Å; E226-S228 WeakPolarHBondContact OE1-CB 3.25Å; E226-S228 PolarHBondContact OE1-N 2.8Å; E226-S228 PolarHBondContact OE1-OG 2.83Å; E226-S228 PolarHBondContact OE2-N 3.24Å; E226-S228 PolarHBondContact OE2-OG 3.19Å; E226-L396 HydrophobicContact CG-CB 4.06Å; E226-L396 HydrophobicContact CG-CD2 4Å; E226-L396 WeakPolarHBondContact OE1-CA 3.47Å; E226-A397 PolarHBondContact OE1-N 2.82Å; E226-Y398 HydrophobicContact CB-CD1 4.34Å; E226-Y398 HydrophobicContact CB-CE1 3.73Å; E226-Y398 HydrophobicContact CG-CE1 3.9Å; E226-Y398 HydrophobicContact CG-CE2 4.49Å
227	F	94.1	Very high	86.9	Confident	28 Å²	28	55 Å²	55	12%	0.123	31%	0.309	C	S	.	.			trans	-133.9	21.6	-171.5	-61.4	-88.7	0	0	0	113.3	G225 S229 T230 P231 A234 P235 W360 A397 P399	G225-F227 VanDerWaalsContact O-CD2 3.26Å; G225-F227 WeakPolarHBondContact O-CD2 3Å; G225-F227 VanDerWaalsContact O-CE2 3.31Å; G225-F227 WeakPolarHBondContact O-CE2 3.45Å; F227-S229 PolarHBondContact O-N 3.18Å; F227-T230 CarbonylContact O-C 3.58Å; F227-T230 VanDerWaalsContact O-C 3.31Å; F227-T230 PolarHBondContact O-N 3.46Å; F227-P231 VanDerWaalsContact O-CA 3.28Å; F227-P231 WeakPolarHBondContact O-CA 3.48Å; F227-P231 WeakPolarHBondContact O-CD 3.44Å; F227-A234 HydrophobicContact CB-CB 4.46Å; F227-A234 HydrophobicContact CD1-CB 4.16Å; F227-A234 HydrophobicContact CD2-CB 4.33Å; F227-A234 HydrophobicContact CG-CB 4.06Å; F227-P235 VanDerWaalsContact CE1-CD 3.5Å; F227-P235 HydrophobicContact CZ-CG 3.95Å; F227-W360 HydrophobicContact CB-CH2 4.08Å; F227-W360 HydrophobicContact CB-CZ3 3.99Å; F227-A397 PolarHBondContact N-O 2.86Å; F227-P399 HydrophobicContact CD2-CG 3.84Å; F227-P399 HydrophobicContact CE2-CG 4.18Å
228	S	93.6	Very high	86.8	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.014	32%	0.32	C	S	.	.	S	Bend	trans	-62.1	-26	177.5	62.9	0	0	0	0	113.4	E226 Y385 K391 F395	E226-S228 VanDerWaalsContact CD-OG 3.3Å; E226-S228 WeakPolarHBondContact OE1-CA 3.44Å; E226-S228 WeakPolarHBondContact OE1-CB 3.25Å; E226-S228 PolarHBondContact OE1-N 2.8Å; E226-S228 PolarHBondContact OE1-OG 2.83Å; E226-S228 PolarHBondContact OE2-N 3.24Å; E226-S228 PolarHBondContact OE2-OG 3.19Å; S228-Y385 VanDerWaalsContact C-OH 3.3Å; S228-Y385 WeakPolarHBondContact CA-OH 3.2Å; S228-Y385 VanDerWaalsContact O-CE1 3.3Å; S228-Y385 WeakPolarHBondContact O-CE1 3.21Å; S228-Y385 PolarHBondContact O-OH 3.41Å; S228-K391 PolarHBondContact OG-NZ 2.83Å; S228-F395 VanDerWaalsContact CB-CE2 3.46Å; S228-F395 PolarHBondContact OG-O 2.8Å
229	S	92.6	Very high	86.9	Confident	90 Å²	90	56.6 Å²	56.6	63%	0.629	32%	0.318	S	S	*	.	S	Bend	trans	-89	-23.4	178.7	-57.2	0	0	0	0	112.8	F227	F227-S229 PolarHBondContact O-N 3.18Å
230	T	91.6	Very high	87	Confident	54 Å²	54	58.8 Å²	58.8	33%	0.331	33%	0.326	S	S	.	.			trans	-142.7	61.4	-174.5	53.8	0	0	0	0	110.9	F227 D232 Q233	F227-T230 CarbonylContact O-C 3.58Å; F227-T230 VanDerWaalsContact O-C 3.31Å; F227-T230 PolarHBondContact O-N 3.46Å; T230-D232 PolarHBondContact O-N 2.67Å; T230-Q233 PolarHBondContact O-N 3.29Å
231	P	89.4	Confident	86.8	Confident	10 Å²	10	62 Å²	62	7%	0.065	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-63.4	-26.1	-174.1	27.3	-39.6	0	0	0	113.7	F227 Q233 A234 W360 F380 R381 Y385	F227-P231 VanDerWaalsContact O-CA 3.28Å; F227-P231 WeakPolarHBondContact O-CA 3.48Å; F227-P231 WeakPolarHBondContact O-CD 3.44Å; P231-Q233 PolarHBondContact O-N 3.26Å; P231-A234 PolarHBondContact O-N 3.09Å; P231-W360 HydrophobicContact CB-CH2 3.81Å; P231-W360 HydrophobicContact CB-CZ2 3.93Å; P231-F380 HydrophobicContact CB-CE1 3.95Å; P231-R381 VanDerWaalsContact CG-CZ 3.4Å; P231-Y385 HydrophobicContact CG-CE1 4.05Å; P231-Y385 HydrophobicContact CG-CE2 4.28Å
232	D	89.6	Confident	87	Confident	129 Å²	129	66.1 Å²	66.1	69%	0.69	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-74.9	-10	174.9	-60.5	-58.1	0	0	0	114	T230 R381	T230-D232 PolarHBondContact O-N 2.67Å; D232-R381 VanDerWaalsContact CG-NH2 3.35Å; D232-R381 IonicContact OD1-CZ 3.38Å; D232-R381 IonicContact OD1-NH1 2.95Å; D232-R381 PolarHBondContact OD1-NH1 3.43Å; D232-R381 IonicContact OD1-NH2 2.72Å; D232-R381 PolarHBondContact OD1-NH2 3.45Å; D232-R381 IonicContact OD2-CZ 2.76Å; D232-R381 IonicContact OD2-NH1 3.59Å; D232-R381 PolarHBondContact OD2-NH1 2.84Å; D232-R381 IonicContact OD2-NH2 2.74Å
233	Q	88.2	Confident	87.3	Confident	141 Å²	141	67 Å²	67	66%	0.659	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-99.6	4.7	176.9	-59.5	-178.6	17.1	0	0	112.6	T230 P231	T230-Q233 PolarHBondContact O-N 3.29Å; P231-Q233 PolarHBondContact O-N 3.26Å
234	A	82.3	Confident	87.6	Confident	28 Å²	28	68.1 Å²	68.1	23%	0.231	37%	0.368	C	S	.	.			trans	-58.3	124.5	174.9	0	0	0	0	0	109.8	F227 P231 W360 P399	F227-A234 HydrophobicContact CB-CB 4.46Å; F227-A234 HydrophobicContact CD1-CB 4.16Å; F227-A234 HydrophobicContact CD2-CB 4.33Å; F227-A234 HydrophobicContact CG-CB 4.06Å; P231-A234 PolarHBondContact O-N 3.09Å; A234-W360 HydrophobicContact CB-CH2 3.82Å; A234-W360 HydrophobicContact CB-CZ2 4.4Å; A234-P399 HydrophobicContact CB-CG 3.79Å
235	P	80.6	Confident	88.1	Confident	48 Å²	48	66.6 Å²	66.6	31%	0.312	35%	0.351	S	S	.	.			trans	-69.8	151.5	-175.4	27.6	-32.7	0	0	0	110.7	I223 F227	I223-P235 HydrophobicContact CG2-CG 3.75Å; F227-P235 VanDerWaalsContact CE1-CD 3.5Å; F227-P235 HydrophobicContact CZ-CG 3.95Å
236	E	73.1	Confident	88.6	Confident	180 Å²	180	64.9 Å²	64.9	84%	0.841	33%	0.333	S	S	*	.	S	Bend	trans	-82.6	-18.3	171.7	-62.4	-173.1	163.3	0	0	112.2	I238	E236-I238 PolarHBondContact O-N 2.68Å
237	H	78.4	Confident	88.8	Confident	118 Å²	118	61.8 Å²	61.8	55%	0.546	32%	0.318	S	S	.	.			trans	-69.3	128.3	-179.5	-61.4	-56.1	0	0	0	111.3	D241	H237-D241 HydrophobicContact CB-CB 4.47Å
238	I	85.9	Confident	89	Confident	45 Å²	45	60.5 Å²	60.5	23%	0.231	31%	0.313	C	S	.	.			trans	-87.2	162.3	177.4	61	173.5	0	0	0	110.8	D220 L221 Q222 I223 E236 K240 D241	D220-I238 WeakPolarHBondContact O-CB 3.35Å; L221-I238 HydrophobicContact CD2-CD1 4.39Å; Q222-I238 CarbonylContact O-C 3.31Å; I223-I238 HydrophobicContact CG1-CG2 4.46Å; E236-I238 PolarHBondContact O-N 2.68Å; I238-K240 HydrophobicContact CD1-CB 4.02Å; I238-K240 HydrophobicContact CG1-CB 4.14Å; I238-K240 PolarHBondContact O-N 3.37Å; I238-K240 VanDerWaalsContact O-N 3.11Å; I238-D241 PolarHBondContact N-OD2 3.07Å; I238-D241 WeakPolarHBondContact O-CB 3.39Å; I238-D241 PolarHBondContact O-N 3.38Å
239	S	88.6	Confident	89.2	Confident	6 Å²	6	63.2 Å²	63.2	4%	0.042	32%	0.323	C	S	.	.	H	α-helix	trans	-52.2	-35.4	179.2	-77.3	0	0	0	0	113	S219 D220 Q222 D241 L242 Y243	S219-S239 VanDerWaalsContact O-CB 3.26Å; S219-S239 WeakPolarHBondContact O-CB 3.28Å; D220-S239 PolarHBondContact O-N 2.8Å; Q222-S239 WeakPolarHBondContact O-CB 3.12Å; Q222-S239 PolarHBondContact O-N 2.78Å; Q222-S239 PolarHBondContact O-OG 2.66Å; S239-D241 PolarHBondContact O-N 2.9Å; S239-L242 PolarHBondContact O-N 3.12Å; S239-Y243 WeakPolarHBondContact O-CB 3.34Å; S239-Y243 WeakPolarHBondContact O-CD2 3.2Å; S239-Y243 PolarHBondContact O-N 2.75Å
240	K	87.7	Confident	89.4	Confident	52 Å²	52	59 Å²	59	23%	0.226	29%	0.293	C	S	.	.	H	α-helix	trans	-59.4	-32.8	176.8	-162.8	171.7	-177.5	166.7	0	113.3	D213 I215 D220 I238	D213-K240 PolarHBondContact O-NZ 2.81Å; I215-K240 PolarHBondContact O-NZ 2.84Å; D220-K240 HydrophobicContact CB-CB 3.78Å; D220-K240 HydrophobicContact CB-CD 4Å; D220-K240 HydrophobicContact CB-CG 4.17Å; D220-K240 PolarHBondContact O-N 2.81Å; I238-K240 HydrophobicContact CD1-CB 4.02Å; I238-K240 HydrophobicContact CG1-CB 4.14Å; I238-K240 PolarHBondContact O-N 3.37Å; I238-K240 VanDerWaalsContact O-N 3.11Å
241	D	86.6	Confident	89.4	Confident	73 Å²	73	59.4 Å²	59.4	39%	0.39	29%	0.291	S	S	.	.	H	α-helix	trans	-73.5	-35.5	-179.3	-65	-34.8	0	0	0	111.7	H237 I238 S239 K244	H237-D241 HydrophobicContact CB-CB 4.47Å; I238-D241 PolarHBondContact N-OD2 3.07Å; I238-D241 WeakPolarHBondContact O-CB 3.39Å; I238-D241 PolarHBondContact O-N 3.38Å; S239-D241 PolarHBondContact O-N 2.9Å; D241-K244 WeakPolarHBondContact O-CE 3.4Å; D241-K244 PolarHBondContact O-NZ 3.09Å
242	L	88.3	Confident	89.6	Confident	99 Å²	99	59.8 Å²	59.8	52%	0.518	30%	0.297	S	S	.	.	H	α-helix	trans	-87	-44.6	-176.2	-58.3	176.7	0	0	0	112	S239 K244	S239-L242 PolarHBondContact O-N 3.12Å; L242-K244 PolarHBondContact O-N 2.94Å
243	Y	90.7	Very high	90	Very high	123 Å²	123	54.4 Å²	54.4	48%	0.482	27%	0.269	S	S	.	.			trans	-104.8	72.2	-172.3	-54.6	-62.3	0	0	0	111	S239 S245	S239-Y243 WeakPolarHBondContact O-CB 3.34Å; S239-Y243 WeakPolarHBondContact O-CD2 3.2Å; S239-Y243 PolarHBondContact O-N 2.75Å; Y243-S245 VanDerWaalsContact C-N 3.25Å; Y243-S245 PolarHBondContact O-N 3.1Å
244	K	92.7	Very high	90.5	Very high	54 Å²	54	47.9 Å²	47.9	24%	0.235	24%	0.239	C	C	.	.			trans	-75.8	-7.3	-174.3	-57.1	-174.6	-173.3	-60.1	0	114.9	R212 D241 L242 Y260 C263	R212-K244 PolarHBondContact NH1-O 3.24Å; R212-K244 PolarHBondContact NH2-O 3.31Å; D241-K244 WeakPolarHBondContact O-CE 3.4Å; D241-K244 PolarHBondContact O-NZ 3.09Å; L242-K244 PolarHBondContact O-N 2.94Å; K244-Y260 HydrophobicContact CB-CD2 4.41Å; K244-Y260 HydrophobicContact CD-CD1 4.29Å; K244-Y260 HydrophobicContact CD-CD2 3.9Å; K244-Y260 HydrophobicContact CD-CE2 4.41Å; K244-Y260 HydrophobicContact CD-CG 3.83Å; K244-C263 PolarHBondContact O-SG 3.45Å; K244-C263 VanDerWaalsContact O-SG 3.4Å
245	S	95.4	Very high	91.2	Very high	13 Å²	13	47.2 Å²	47.2	9%	0.091	23%	0.23	C	C	.	.			trans	-74.7	130.1	-175.7	-51.8	0	0	0	0	110.3	Y243 R264 Q310	Y243-S245 VanDerWaalsContact C-N 3.25Å; Y243-S245 PolarHBondContact O-N 3.1Å; S245-R264 PolarHBondContact OG-N 3.22Å; S245-Q310 PolarHBondContact O-N 2.99Å; S245-Q310 VanDerWaalsContact O-N 3.13Å
246	A	96.9	Very high	92	Very high	2 Å²	2	45 Å²	45	2%	0.017	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	158	176.3	0	0	0	0	0	111.2	R212 D257 Y307 C308 H309	R212-A246 HydrophobicContact CG-CB 4.36Å; A246-D257 PolarHBondContact O-N 3.49Å; A246-Y307 HydrophobicContact CB-CE2 3.99Å; A246-C308 CarbonylContact C-O 3.56Å; A246-C308 WeakPolarHBondContact CA-O 3.1Å; A246-C308 WeakPolarHBondContact CB-O 3.14Å; A246-H309 HydrophobicContact CB-CB 3.81Å
247	F	97.9	Very high	93.2	Very high	3 Å²	3	36.5 Å²	36.5	1%	0.013	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	154	165.8	67.8	-100.1	0	0	0	112.1	F254 Y255 L266 I270 L306 Y307 C308	F247-F254 AromaticContact CD2-CD1 3.58Å; F247-F254 HydrophobicContact CD2-CD1 3.58Å; F247-F254 HydrophobicContact CD2-CE1 4.15Å; F247-F254 AromaticContact CE2-CD1 3.57Å; F247-F254 HydrophobicContact CE2-CD1 3.57Å; F247-F254 AromaticContact CE2-CE1 3.63Å; F247-F254 HydrophobicContact CE2-CE1 3.63Å; F247-F254 HydrophobicContact CG-CD1 4.13Å; F247-F254 HydrophobicContact CZ-CD1 4.08Å; F247-F254 AromaticContact CZ-CE1 3.93Å; F247-F254 HydrophobicContact CZ-CE1 3.93Å; F247-Y255 WeakPolarHBondContact CA-O 3.39Å; F247-Y255 WeakPolarHBondContact CB-O 3.34Å; F247-L266 HydrophobicContact CD1-CB 3.8Å; F247-L266 HydrophobicContact CD1-CD1 4.43Å; F247-L266 HydrophobicContact CE1-CB 3.94Å; F247-I270 HydrophobicContact CE1-CD1 4.32Å; F247-I270 HydrophobicContact CZ-CD1 3.91Å; F247-L306 HydrophobicContact CE2-CD2 3.8Å; F247-L306 HydrophobicContact CE2-CG 4.08Å; F247-L306 HydrophobicContact CZ-CD2 4.03Å; F247-Y307 WeakPolarHBondContact O-CA 3.5Å; F247-Y307 WeakPolarHBondContact O-CD2 3.18Å; F247-C308 HydrophobicContact CD1-CB 4.06Å; F247-C308 HydrophobicContact CD2-CB 4.38Å; F247-C308 HydrophobicContact CE1-CB 3.53Å; F247-C308 HydrophobicContact CE2-CB 3.86Å; F247-C308 HydrophobicContact CG-CB 4.49Å; F247-C308 HydrophobicContact CZ-CB 3.41Å; F247-C308 VanDerWaalsContact CZ-CB 3.41Å; F247-C308 PolarHBondContact N-O 2.85Å; F247-C308 PolarHBondContact O-N 3.43Å
248	F	98.3	Very high	94	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	146.8	155.1	-69.7	-78.8	0	0	0	109.9	L208 L211 R212 I215 F250 F254 Y255 M289 L306 Y307 V317	L208-F248 HydrophobicContact CB-CD2 4.23Å; L208-F248 HydrophobicContact CB-CE2 4.43Å; L208-F248 WeakPolarHBondContact O-CE2 3.44Å; L211-F248 HydrophobicContact CB-CZ 4.4Å; L211-F248 HydrophobicContact CD2-CE1 4.13Å; L211-F248 HydrophobicContact CD2-CZ 3.91Å; L211-F248 HydrophobicContact CG-CZ 4.06Å; R212-F248 HydrophobicContact CB-CE2 4.01Å; R212-F248 HydrophobicContact CB-CZ 4.45Å; I215-F248 HydrophobicContact CD1-CE1 4.25Å; I215-F248 HydrophobicContact CD1-CZ 4.02Å; F248-F250 HydrophobicContact CB-CD2 3.84Å; F248-F250 HydrophobicContact CB-CE2 3.46Å; F248-F250 VanDerWaalsContact CB-CE2 3.46Å; F248-F250 HydrophobicContact CB-CZ 4.45Å; F248-F250 AromaticContact CD1-CE2 3.95Å; F248-F250 HydrophobicContact CD1-CE2 3.95Å; F248-F250 HydrophobicContact CD1-CZ 4.22Å; F248-F250 AromaticContact CG-CE2 3.85Å; F248-F250 HydrophobicContact CG-CE2 3.85Å; F248-F254 CarbonylContact O-C 3.57Å; F248-F254 WeakPolarHBondContact O-CA 3.06Å; F248-Y255 PolarHBondContact N-O 3.15Å; F248-Y255 PolarHBondContact O-N 3.49Å; F248-M289 HydrophobicContact CD2-CE 3.7Å; F248-M289 HydrophobicContact CD2-CG 4.48Å; F248-M289 HydrophobicContact CD2-SD 4.01Å; F248-M289 HydrophobicContact CE2-CE 4.17Å; F248-M289 HydrophobicContact CE2-SD 4.1Å; F248-L306 CarbonylContact C-O 3.55Å; F248-L306 WeakPolarHBondContact CA-O 3.42Å; F248-Y307 AromaticContact CD1-CD2 3.63Å; F248-Y307 HydrophobicContact CD1-CD2 3.63Å; F248-Y307 HydrophobicContact CD1-CG 4.06Å; F248-Y307 HydrophobicContact CD2-CD2 4.26Å; F248-Y307 AromaticContact CE1-CD2 3.34Å; F248-Y307 HydrophobicContact CE1-CD2 3.34Å; F248-Y307 HydrophobicContact CE1-CE2 4.19Å; F248-Y307 AromaticContact CE1-CG 3.68Å; F248-Y307 HydrophobicContact CE1-CG 3.68Å; F248-Y307 HydrophobicContact CE2-CD2 4.02Å; F248-Y307 HydrophobicContact CE2-CE2 4.2Å; F248-Y307 HydrophobicContact CG-CD2 4.07Å; F248-Y307 AromaticContact CZ-CD2 3.55Å; F248-Y307 HydrophobicContact CZ-CD2 3.55Å; F248-Y307 AromaticContact CZ-CE2 3.93Å; F248-Y307 HydrophobicContact CZ-CE2 3.93Å; F248-Y307 HydrophobicContact CZ-CG 4.22Å; F248-V317 HydrophobicContact CE1-CG2 4.32Å
249	Y	97.6	Very high	94.4	Very high	59 Å²	59	35.8 Å²	35.8	23%	0.231	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	111.7	173.9	172.4	-99.1	0	0	0	109.6	G252 T253 F254 F284 Y305 L306	Y249-G252 WeakPolarHBondContact OH-CA 3.42Å; Y249-G252 PolarHBondContact OH-N 3.09Å; Y249-T253 WeakPolarHBondContact CA-O 3.32Å; Y249-F254 AromaticContact CD2-CD1 3.63Å; Y249-F254 HydrophobicContact CD2-CD1 3.63Å; Y249-F254 HydrophobicContact CD2-CD2 4.02Å; Y249-F254 AromaticContact CD2-CE1 3.46Å; Y249-F254 HydrophobicContact CD2-CE1 3.46Å; Y249-F254 VanDerWaalsContact CD2-CE1 3.46Å; Y249-F254 AromaticContact CD2-CE2 3.86Å; Y249-F254 HydrophobicContact CD2-CE2 3.86Å; Y249-F254 AromaticContact CD2-CG 3.91Å; Y249-F254 HydrophobicContact CD2-CG 3.91Å; Y249-F254 AromaticContact CD2-CZ 3.57Å; Y249-F254 HydrophobicContact CD2-CZ 3.57Å; Y249-F254 HydrophobicContact CE2-CD2 4.36Å; Y249-F254 HydrophobicContact CE2-CE1 4.23Å; Y249-F254 AromaticContact CE2-CE2 3.95Å; Y249-F254 HydrophobicContact CE2-CE2 3.95Å; Y249-F254 AromaticContact CE2-CZ 3.87Å; Y249-F254 HydrophobicContact CE2-CZ 3.87Å; Y249-F254 HydrophobicContact CG-CD1 4.16Å; Y249-F254 AromaticContact CG-CE1 3.89Å; Y249-F254 HydrophobicContact CG-CE1 3.89Å; Y249-F254 HydrophobicContact CG-CZ 4.32Å; Y249-F284 AromaticContact CE2-CD1 3.91Å; Y249-F284 HydrophobicContact CE2-CD1 3.91Å; Y249-F284 HydrophobicContact CE2-CE1 4Å; Y249-F284 AromaticContact CZ-CE1 3.98Å; Y249-F284 VanDerWaalsContact OH-CE1 3.29Å; Y249-F284 WeakPolarHBondContact OH-CE1 3.45Å; Y249-Y305 WeakPolarHBondContact O-CB 3.18Å; Y249-L306 HydrophobicContact CD1-CB 4.48Å; Y249-L306 PolarHBondContact N-O 3.4Å; Y249-L306 PolarHBondContact O-N 3.02Å
250	F	96.8	Very high	94.6	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.009	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	130.6	176.7	-63.6	-82.4	0	0	0	109.7	F248 G252 T253 Y255 L297 I299 Y305 I319	F248-F250 HydrophobicContact CB-CD2 3.84Å; F248-F250 HydrophobicContact CB-CE2 3.46Å; F248-F250 VanDerWaalsContact CB-CE2 3.46Å; F248-F250 HydrophobicContact CB-CZ 4.45Å; F248-F250 AromaticContact CD1-CE2 3.95Å; F248-F250 HydrophobicContact CD1-CE2 3.95Å; F248-F250 HydrophobicContact CD1-CZ 4.22Å; F248-F250 AromaticContact CG-CE2 3.85Å; F248-F250 HydrophobicContact CG-CE2 3.85Å; F250-G252 VanDerWaalsContact C-N 3.32Å; F250-G252 PolarHBondContact O-N 3.13Å; F250-G252 VanDerWaalsContact O-N 3.13Å; F250-T253 PolarHBondContact N-O 2.98Å; F250-T253 VanDerWaalsContact N-O 3.09Å; F250-T253 PolarHBondContact O-N 3.14Å; F250-Y255 HydrophobicContact CB-CE2 3.94Å; F250-Y255 HydrophobicContact CD2-CD2 4.1Å; F250-Y255 HydrophobicContact CD2-CE2 4.13Å; F250-L297 HydrophobicContact CD2-CD1 4.02Å; F250-L297 HydrophobicContact CD2-CD2 4.35Å; F250-L297 HydrophobicContact CE2-CD1 4.03Å; F250-L297 HydrophobicContact CG-CD1 4.29Å; F250-L297 HydrophobicContact CZ-CD1 4.36Å; F250-I299 HydrophobicContact CD1-CG2 4.32Å; F250-Y305 HydrophobicContact CB-CD1 4.26Å; F250-Y305 HydrophobicContact CB-CE1 4.4Å; F250-Y305 AromaticContact CD1-CD1 3.51Å; F250-Y305 HydrophobicContact CD1-CD1 3.51Å; F250-Y305 AromaticContact CD1-CD2 3.48Å; F250-Y305 HydrophobicContact CD1-CD2 3.48Å; F250-Y305 VanDerWaalsContact CD1-CD2 3.48Å; F250-Y305 AromaticContact CD1-CE1 3.98Å; F250-Y305 HydrophobicContact CD1-CE1 3.98Å; F250-Y305 AromaticContact CD1-CE2 3.94Å; F250-Y305 HydrophobicContact CD1-CE2 3.94Å; F250-Y305 AromaticContact CD1-CG 3.23Å; F250-Y305 HydrophobicContact CD1-CG 3.23Å; F250-Y305 HydrophobicContact CE1-CD1 4.24Å; F250-Y305 AromaticContact CE1-CD2 3.53Å; F250-Y305 HydrophobicContact CE1-CD2 3.53Å; F250-Y305 HydrophobicContact CE1-CE2 4.28Å; F250-Y305 AromaticContact CE1-CG 3.49Å; F250-Y305 HydrophobicContact CE1-CG 3.49Å; F250-Y305 VanDerWaalsContact CE1-CG 3.49Å; F250-Y305 HydrophobicContact CG-CD1 4.22Å; F250-Y305 HydrophobicContact CG-CG 4.27Å; F250-I319 HydrophobicContact CE1-CD1 4.19Å
251	E	93.6	Very high	94.9	Very high	62 Å²	62	43.6 Å²	43.6	29%	0.29	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	41.2	52.1	173	-64.8	-60.6	131.1	0	0	114.5	A37 T253 N298 K300 Y305	A37-E251 HydrophobicContact CB-CG 4.06Å; E251-T253 VanDerWaalsContact C-N 3.33Å; E251-T253 PolarHBondContact O-N 3.44Å; E251-N298 HydrophobicContact CB-CB 4.47Å; E251-N298 HydrophobicContact CG-CB 4.32Å; E251-N298 WeakPolarHBondContact CG-O 3.42Å; E251-K300 VanDerWaalsContact OE1-CD 3.31Å; E251-K300 WeakPolarHBondContact OE1-CD 3.42Å; E251-K300 WeakPolarHBondContact OE1-CE 3.45Å; E251-K300 IonicContact OE1-NZ 3.77Å; E251-K300 WeakPolarHBondContact OE2-CE 3.46Å; E251-K300 IonicContact OE2-NZ 3.91Å; E251-K300 PolarHBondContact OE2-NZ 3.26Å; E251-Y305 HydrophobicContact CG-CE1 4.21Å; E251-Y305 WeakPolarHBondContact OE1-CE1 3.41Å; E251-Y305 PolarHBondContact OE1-OH 2.93Å
252	G	93	Very high	95.1	Very high	18 Å²	18	45.8 Å²	45.8	19%	0.186	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.4	1.6	175.9	0	0	0	0	0	115.5	Y249 F250 F284 Q285	Y249-G252 WeakPolarHBondContact OH-CA 3.42Å; Y249-G252 PolarHBondContact OH-N 3.09Å; F250-G252 VanDerWaalsContact C-N 3.32Å; F250-G252 PolarHBondContact O-N 3.13Å; F250-G252 VanDerWaalsContact O-N 3.13Å; G252-F284 WeakPolarHBondContact O-CA 3.37Å; G252-Q285 PolarHBondContact O-N 3.17Å
253	T	97.4	Very high	95.3	Very high	16 Å²	16	42 Å²	42	10%	0.098	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	127.8	-178.9	-54.5	0	0	0	0	111.5	Y249 F250 E251 Y255 Q285 A287	Y249-T253 WeakPolarHBondContact CA-O 3.32Å; F250-T253 PolarHBondContact N-O 2.98Å; F250-T253 VanDerWaalsContact N-O 3.09Å; F250-T253 PolarHBondContact O-N 3.14Å; E251-T253 VanDerWaalsContact C-N 3.33Å; E251-T253 PolarHBondContact O-N 3.44Å; T253-Y255 HydrophobicContact CG2-CD1 4.48Å; T253-Y255 HydrophobicContact CG2-CD2 4.25Å; T253-Y255 HydrophobicContact CG2-CE1 4.04Å; T253-Y255 HydrophobicContact CG2-CE2 3.76Å; T253-Y255 WeakPolarHBondContact O-CD2 3.17Å; T253-Y255 WeakPolarHBondContact O-CE2 3.38Å; T253-Q285 WeakPolarHBondContact CA-O 3.26Å; T253-Q285 HydrophobicContact CG2-CB 4.11Å; T253-A287 HydrophobicContact CG2-CB 4.03Å
254	F	98.1	Very high	95.4	Very high	5 Å²	5	45.5 Å²	45.5	2%	0.022	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	109	170.4	-66.4	-81.9	0	0	0	110.8	F247 F248 Y249 N256 I270 I271 F284 Q285 T286 A287	F247-F254 AromaticContact CD2-CD1 3.58Å; F247-F254 HydrophobicContact CD2-CD1 3.58Å; F247-F254 HydrophobicContact CD2-CE1 4.15Å; F247-F254 AromaticContact CE2-CD1 3.57Å; F247-F254 HydrophobicContact CE2-CD1 3.57Å; F247-F254 AromaticContact CE2-CE1 3.63Å; F247-F254 HydrophobicContact CE2-CE1 3.63Å; F247-F254 HydrophobicContact CG-CD1 4.13Å; F247-F254 HydrophobicContact CZ-CD1 4.08Å; F247-F254 AromaticContact CZ-CE1 3.93Å; F247-F254 HydrophobicContact CZ-CE1 3.93Å; F248-F254 CarbonylContact O-C 3.57Å; F248-F254 WeakPolarHBondContact O-CA 3.06Å; Y249-F254 AromaticContact CD2-CD1 3.63Å; Y249-F254 HydrophobicContact CD2-CD1 3.63Å; Y249-F254 HydrophobicContact CD2-CD2 4.02Å; Y249-F254 AromaticContact CD2-CE1 3.46Å; Y249-F254 HydrophobicContact CD2-CE1 3.46Å; Y249-F254 VanDerWaalsContact CD2-CE1 3.46Å; Y249-F254 AromaticContact CD2-CE2 3.86Å; Y249-F254 HydrophobicContact CD2-CE2 3.86Å; Y249-F254 AromaticContact CD2-CG 3.91Å; Y249-F254 HydrophobicContact CD2-CG 3.91Å; Y249-F254 AromaticContact CD2-CZ 3.57Å; Y249-F254 HydrophobicContact CD2-CZ 3.57Å; Y249-F254 HydrophobicContact CE2-CD2 4.36Å; Y249-F254 HydrophobicContact CE2-CE1 4.23Å; Y249-F254 AromaticContact CE2-CE2 3.95Å; Y249-F254 HydrophobicContact CE2-CE2 3.95Å; Y249-F254 AromaticContact CE2-CZ 3.87Å; Y249-F254 HydrophobicContact CE2-CZ 3.87Å; Y249-F254 HydrophobicContact CG-CD1 4.16Å; Y249-F254 AromaticContact CG-CE1 3.89Å; Y249-F254 HydrophobicContact CG-CE1 3.89Å; Y249-F254 HydrophobicContact CG-CZ 4.32Å; F254-N256 PolarHBondContact O-N 3.36Å; F254-N256 PolarHBondContact O-ND2 2.94Å; F254-I270 HydrophobicContact CE1-CD1 4.07Å; F254-I270 HydrophobicContact CE2-CG2 4.47Å; F254-I270 HydrophobicContact CZ-CB 4.25Å; F254-I270 HydrophobicContact CZ-CD1 4.26Å; F254-I270 HydrophobicContact CZ-CG2 3.83Å; F254-I271 HydrophobicContact CD2-CD1 4.12Å; F254-I271 HydrophobicContact CD2-CG1 4.14Å; F254-I271 HydrophobicContact CE2-CG1 4.05Å; F254-F284 HydrophobicContact CD2-CB 4.1Å; F254-F284 HydrophobicContact CD2-CG 4.46Å; F254-F284 HydrophobicContact CE2-CB 3.8Å; F254-F284 HydrophobicContact CE2-CD1 4.08Å; F254-F284 HydrophobicContact CE2-CD2 4.01Å; F254-F284 AromaticContact CE2-CG 3.7Å; F254-F284 HydrophobicContact CE2-CG 3.7Å; F254-Q285 PolarHBondContact N-O 3.33Å; F254-T286 HydrophobicContact CB-CG2 4.37Å; F254-T286 CarbonylContact O-C 3.59Å; F254-T286 WeakPolarHBondContact O-CA 3.2Å; F254-A287 PolarHBondContact O-N 2.93Å
255	Y	98.3	Very high	95.5	Very high	13 Å²	13	44.8 Å²	44.8	5%	0.051	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	90.4	173.9	-58.2	-91.8	0	0	0	108.6	L208 F247 F248 F250 T253 A287 M289 F292 L297	L208-Y255 HydrophobicContact CD1-CD1 3.74Å; L208-Y255 HydrophobicContact CD1-CD2 4.33Å; L208-Y255 HydrophobicContact CD1-CE1 4.36Å; L208-Y255 HydrophobicContact CD1-CG 3.72Å; F247-Y255 WeakPolarHBondContact CA-O 3.39Å; F247-Y255 WeakPolarHBondContact CB-O 3.34Å; F248-Y255 PolarHBondContact N-O 3.15Å; F248-Y255 PolarHBondContact O-N 3.49Å; F250-Y255 HydrophobicContact CB-CE2 3.94Å; F250-Y255 HydrophobicContact CD2-CD2 4.1Å; F250-Y255 HydrophobicContact CD2-CE2 4.13Å; T253-Y255 HydrophobicContact CG2-CD1 4.48Å; T253-Y255 HydrophobicContact CG2-CD2 4.25Å; T253-Y255 HydrophobicContact CG2-CE1 4.04Å; T253-Y255 HydrophobicContact CG2-CE2 3.76Å; T253-Y255 WeakPolarHBondContact O-CD2 3.17Å; T253-Y255 WeakPolarHBondContact O-CE2 3.38Å; Y255-A287 HydrophobicContact CD1-CB 3.8Å; Y255-A287 HydrophobicContact CE1-CB 4.06Å; Y255-M289 WeakPolarHBondContact O-CE 3.46Å; Y255-F292 HydrophobicContact CD1-CB 4.23Å; Y255-F292 HydrophobicContact CD1-CD1 4.33Å; Y255-F292 HydrophobicContact CD1-CD2 4.12Å; Y255-F292 AromaticContact CD1-CG 3.96Å; Y255-F292 HydrophobicContact CD1-CG 3.96Å; Y255-F292 HydrophobicContact CE1-CB 4.26Å; Y255-F292 AromaticContact CE1-CD1 3.64Å; Y255-F292 HydrophobicContact CE1-CD1 3.64Å; Y255-F292 HydrophobicContact CE1-CD2 4.15Å; Y255-F292 AromaticContact CE1-CE1 3.96Å; Y255-F292 HydrophobicContact CE1-CE1 3.96Å; Y255-F292 HydrophobicContact CE1-CE2 4.45Å; Y255-F292 AromaticContact CE1-CG 3.74Å; Y255-F292 HydrophobicContact CE1-CG 3.74Å; Y255-F292 HydrophobicContact CE1-CZ 4.35Å; Y255-L297 HydrophobicContact CE1-CD2 4.02Å; Y255-L297 HydrophobicContact CE2-CD2 4Å
256	N	97.8	Very high	95.4	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	134.7	-177.1	-71.2	-86.3	0	0	0	110.3	F254 K258 D265 S267 A287 M289	F254-N256 PolarHBondContact O-N 3.36Å; F254-N256 PolarHBondContact O-ND2 2.94Å; N256-K258 HydrophobicContact CB-CG 4.33Å; N256-K258 PolarHBondContact O-N 3.46Å; N256-D265 PolarHBondContact OD1-OD1 3.13Å; N256-S267 PolarHBondContact ND2-OG 3.04Å; N256-S267 PolarHBondContact OD1-OG 2.83Å; N256-A287 PolarHBondContact N-O 3.23Å; N256-M289 WeakPolarHBondContact O-CB 3.49Å; N256-M289 PolarHBondContact O-N 3.28Å
257	D	96.6	Very high	95.3	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.011	22%	0.216	C	C	.	.			trans	-71	115.2	172.3	-166	-46.1	0	0	0	109.4	R212 A246 R259 C263 M289	R212-D257 WeakPolarHBondContact CD-OD2 3.21Å; R212-D257 IonicContact CZ-OD2 3.66Å; R212-D257 IonicContact NE-OD2 2.88Å; R212-D257 IonicContact NH1-OD1 3.22Å; R212-D257 IonicContact NH1-OD2 2.68Å; R212-D257 PolarHBondContact NH1-OD2 2.83Å; A246-D257 PolarHBondContact O-N 3.49Å; D257-R259 WeakPolarHBondContact OD1-CB 3.4Å; D257-R259 WeakPolarHBondContact OD1-CG 3.47Å; D257-R259 PolarHBondContact OD1-N 3.22Å; D257-R259 IonicContact OD1-NE 3.18Å; D257-R259 PolarHBondContact OD1-NE 2.83Å; D257-R259 IonicContact OD2-CZ 3.37Å; D257-R259 VanDerWaalsContact OD2-CZ 3.28Å; D257-R259 IonicContact OD2-NE 2.66Å; D257-R259 PolarHBondContact OD2-NE 3.26Å; D257-R259 IonicContact OD2-NH2 3.52Å; D257-R259 PolarHBondContact OD2-NH2 3.47Å; D257-C263 WeakPolarHBondContact O-CB 3.49Å; D257-M289 HydrophobicContact CB-CB 4.48Å; D257-M289 HydrophobicContact CB-CE 3.91Å; D257-M289 HydrophobicContact CB-SD 4.09Å
258	K	95.3	Very high	95.1	Very high	75 Å²	75	52.5 Å²	52.5	33%	0.326	24%	0.241	S	C	.	.			trans	-120.9	21.1	-179.5	-65.2	-172.5	175.7	178.8	0	111.8	N256 Y260 D265 R288 E290	N256-K258 HydrophobicContact CB-CG 4.33Å; N256-K258 PolarHBondContact O-N 3.46Å; K258-Y260 VanDerWaalsContact C-N 3.29Å; K258-Y260 PolarHBondContact O-N 2.94Å; K258-D265 IonicContact NZ-OD2 3.51Å; K258-D265 PolarHBondContact NZ-OD2 3.19Å; K258-R288 HydrophobicContact CB-CG 4.46Å; K258-R288 HydrophobicContact CD-CG 4.08Å; K258-E290 PolarHBondContact N-OE2 2.8Å; K258-E290 VanDerWaalsContact N-OE2 3.12Å
259	R	95.1	Very high	94.8	Very high	73 Å²	73	57.4 Å²	57.4	28%	0.275	27%	0.272	S	S	.	.	S	Bend	trans	-66.5	-30	-179.4	-67.2	-176.2	-73.6	169.7	-3.1	113	T209 R212 D213 D257 E290	T209-R259 HydrophobicContact CG2-CG 4.39Å; R212-R259 VanDerWaalsContact NH1-NH2 3.11Å; D213-R259 IonicContact OD1-CZ 2.64Å; D213-R259 IonicContact OD1-NH1 3.94Å; D213-R259 IonicContact OD1-NH2 3.98Å; D213-R259 PolarHBondContact OD1-NH2 3.26Å; D213-R259 IonicContact OD2-CZ 2.68Å; D213-R259 IonicContact OD2-NH1 3.06Å; D213-R259 PolarHBondContact OD2-NH1 3.32Å; D213-R259 IonicContact OD2-NH2 3.58Å; D213-R259 PolarHBondContact OD2-NH2 2.61Å; D257-R259 WeakPolarHBondContact OD1-CB 3.4Å; D257-R259 WeakPolarHBondContact OD1-CG 3.47Å; D257-R259 PolarHBondContact OD1-N 3.22Å; D257-R259 IonicContact OD1-NE 3.18Å; D257-R259 PolarHBondContact OD1-NE 2.83Å; D257-R259 IonicContact OD2-CZ 3.37Å; D257-R259 VanDerWaalsContact OD2-CZ 3.28Å; D257-R259 IonicContact OD2-NE 2.66Å; D257-R259 PolarHBondContact OD2-NE 3.26Å; D257-R259 IonicContact OD2-NH2 3.52Å; D257-R259 PolarHBondContact OD2-NH2 3.47Å; R259-E290 HydrophobicContact CG-CB 3.76Å; R259-E290 HydrophobicContact CG-CG 4.16Å; R259-E290 PolarHBondContact N-OE1 3.03Å
260	Y	93.4	Very high	94.6	Very high	98 Å²	98	57.2 Å²	57.2	38%	0.384	27%	0.274	S	S	.	.	S	Bend	trans	-116.7	141	-175.5	-55.9	-79.4	0	0	0	111.3	K244 K258 E262 C263	K244-Y260 HydrophobicContact CB-CD2 4.41Å; K244-Y260 HydrophobicContact CD-CD1 4.29Å; K244-Y260 HydrophobicContact CD-CD2 3.9Å; K244-Y260 HydrophobicContact CD-CE2 4.41Å; K244-Y260 HydrophobicContact CD-CG 3.83Å; K258-Y260 VanDerWaalsContact C-N 3.29Å; K258-Y260 PolarHBondContact O-N 2.94Å; Y260-E262 WeakPolarHBondContact CB-OE2 3.21Å; Y260-E262 PolarHBondContact O-N 2.9Å; Y260-C263 VanDerWaalsContact O-CB 3.28Å; Y260-C263 WeakPolarHBondContact O-CB 3.16Å; Y260-C263 PolarHBondContact O-N 2.83Å
261	P	92.3	Very high	94.4	Very high	125 Å²	125	58.3 Å²	58.3	81%	0.812	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-26.3	176.9	-24.4	34.4	0	0	0	114.2	C263	P261-C263 VanDerWaalsContact C-N 3.28Å
262	E	91.5	Very high	94.4	Very high	119 Å²	119	60.8 Å²	60.8	56%	0.556	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-16.2	178.5	-55.2	79.8	-174.4	0	0	112.8	Y260 R264	Y260-E262 WeakPolarHBondContact CB-OE2 3.21Å; Y260-E262 PolarHBondContact O-N 2.9Å; E262-R264 PolarHBondContact O-N 2.82Å
263	C	92.9	Very high	94.4	Very high	20 Å²	20	65.9 Å²	65.9	14%	0.135	31%	0.305	C	S	.	.			trans	-65.7	118.9	178.5	-71.1	0	0	0	0	110.6	K244 D257 Y260 P261	K244-C263 PolarHBondContact O-SG 3.45Å; K244-C263 VanDerWaalsContact O-SG 3.4Å; D257-C263 WeakPolarHBondContact O-CB 3.49Å; Y260-C263 VanDerWaalsContact O-CB 3.28Å; Y260-C263 WeakPolarHBondContact O-CB 3.16Å; Y260-C263 PolarHBondContact O-N 2.83Å; P261-C263 VanDerWaalsContact C-N 3.28Å
264	R	92.4	Very high	94.1	Very high	196 Å²	196	65.7 Å²	65.7	74%	0.74	30%	0.304	S	S	*	.			trans	-90.1	147.4	172.6	-62.8	-177.1	176.8	-178.9	-0.3	109.6	S245 E262 L266	S245-R264 PolarHBondContact OG-N 3.22Å; E262-R264 PolarHBondContact O-N 2.82Å; R264-L266 PolarHBondContact O-N 3.28Å
265	D	94.1	Very high	93.7	Very high	38 Å²	38	70.8 Å²	70.8	20%	0.203	33%	0.328	C	S	.	.			trans	-76.4	92.4	173.4	-162.2	-42.1	0	0	0	109.5	N256 K258 S267 R268	N256-D265 PolarHBondContact OD1-OD1 3.13Å; K258-D265 IonicContact NZ-OD2 3.51Å; K258-D265 PolarHBondContact NZ-OD2 3.19Å; D265-S267 PolarHBondContact O-N 3.45Å; D265-S267 PolarHBondContact OD1-N 2.85Å; D265-S267 PolarHBondContact OD1-OG 3.09Å; D265-R268 WeakPolarHBondContact O-CB 3.41Å; D265-R268 PolarHBondContact O-N 2.78Å; D265-R268 PolarHBondContact OD1-N 3.43Å
266	L	93.3	Very high	93.4	Very high	36 Å²	36	73.3 Å²	73.3	19%	0.188	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-26.3	-179.2	-57.8	180	0	0	0	111.7	F247 R264 R268	F247-L266 HydrophobicContact CD1-CB 3.8Å; F247-L266 HydrophobicContact CD1-CD1 4.43Å; F247-L266 HydrophobicContact CE1-CB 3.94Å; R264-L266 PolarHBondContact O-N 3.28Å; L266-R268 VanDerWaalsContact C-N 3.25Å; L266-R268 PolarHBondContact O-N 3.33Å
267	S	94.9	Very high	92.9	Very high	0 Å²	0	79.3 Å²	79.3	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-69.9	-22.9	-179.2	73	0	0	0	0	113.5	N256 D265 T269 I270 I271	N256-S267 PolarHBondContact ND2-OG 3.04Å; N256-S267 PolarHBondContact OD1-OG 2.83Å; D265-S267 PolarHBondContact O-N 3.45Å; D265-S267 PolarHBondContact OD1-N 2.85Å; D265-S267 PolarHBondContact OD1-OG 3.09Å; S267-T269 VanDerWaalsContact C-N 3.34Å; S267-T269 PolarHBondContact O-N 3.45Å; S267-I270 WeakPolarHBondContact O-CB 3.44Å; S267-I270 PolarHBondContact O-N 3.11Å; S267-I271 WeakPolarHBondContact O-CG1 3.47Å; S267-I271 PolarHBondContact O-N 2.82Å
268	R	94.4	Very high	92.4	Very high	144 Å²	144	86.8 Å²	86.8	54%	0.543	42%	0.415	S	S	.	.	H	α-helix	trans	-49.9	-50.4	-176.8	-176.7	-175.3	-55.1	-151.5	-0.5	113.1	D265 L266 I270 I271 E272	D265-R268 WeakPolarHBondContact O-CB 3.41Å; D265-R268 PolarHBondContact O-N 2.78Å; D265-R268 PolarHBondContact OD1-N 3.43Å; L266-R268 VanDerWaalsContact C-N 3.25Å; L266-R268 PolarHBondContact O-N 3.33Å; R268-I270 VanDerWaalsContact C-N 3.25Å; R268-I270 PolarHBondContact O-N 2.77Å; R268-I271 PolarHBondContact O-N 3.26Å; R268-E272 WeakPolarHBondContact CD-OE1 3.23Å; R268-E272 HydrophobicContact CG-CG 4.25Å; R268-E272 WeakPolarHBondContact CG-OE1 3.43Å; R268-E272 WeakPolarHBondContact O-CB 3.41Å; R268-E272 WeakPolarHBondContact O-CG 3.45Å; R268-E272 PolarHBondContact O-N 3.08Å
269	T	92.4	Very high	92	Very high	104 Å²	104	88.1 Å²	88.1	64%	0.638	42%	0.419	S	S	*	.	H	α-helix	trans	-60.5	-38.5	-177.8	-53.9	0	0	0	0	111.6	S267 W273	S267-T269 VanDerWaalsContact C-N 3.34Å; S267-T269 PolarHBondContact O-N 3.45Å; T269-W273 WeakPolarHBondContact O-CB 3.15Å; T269-W273 PolarHBondContact O-N 2.77Å
270	I	92.9	Very high	91.3	Very high	54 Å²	54	87.9 Å²	87.9	28%	0.277	44%	0.439	S	S	.	.	H	α-helix	trans	-69.2	-43.2	179.6	-56.9	171.2	0	0	0	110	F247 F254 S267 R268 W273 S274 F284	F247-I270 HydrophobicContact CE1-CD1 4.32Å; F247-I270 HydrophobicContact CZ-CD1 3.91Å; F254-I270 HydrophobicContact CE1-CD1 4.07Å; F254-I270 HydrophobicContact CE2-CG2 4.47Å; F254-I270 HydrophobicContact CZ-CB 4.25Å; F254-I270 HydrophobicContact CZ-CD1 4.26Å; F254-I270 HydrophobicContact CZ-CG2 3.83Å; S267-I270 WeakPolarHBondContact O-CB 3.44Å; S267-I270 PolarHBondContact O-N 3.11Å; R268-I270 VanDerWaalsContact C-N 3.25Å; R268-I270 PolarHBondContact O-N 2.77Å; I270-W273 PolarHBondContact O-N 3.44Å; I270-S274 WeakPolarHBondContact O-CB 3.32Å; I270-S274 PolarHBondContact O-N 2.95Å; I270-S274 PolarHBondContact O-OG 3.04Å; I270-F284 HydrophobicContact CG2-CE2 4.49Å
271	I	93.5	Very high	90.7	Very high	25 Å²	25	89.9 Å²	89.9	13%	0.128	45%	0.447	C	S	.	.	H	α-helix	trans	-63.1	-53	178.7	-63.8	167.5	0	0	0	110.2	F254 S267 R268 W273 S274 E275 F284 T286	F254-I271 HydrophobicContact CD2-CD1 4.12Å; F254-I271 HydrophobicContact CD2-CG1 4.14Å; F254-I271 HydrophobicContact CE2-CG1 4.05Å; S267-I271 WeakPolarHBondContact O-CG1 3.47Å; S267-I271 PolarHBondContact O-N 2.82Å; R268-I271 PolarHBondContact O-N 3.26Å; I271-W273 VanDerWaalsContact C-N 3.31Å; I271-W273 PolarHBondContact O-N 3.46Å; I271-S274 PolarHBondContact O-N 2.63Å; I271-S274 PolarHBondContact O-OG 3.43Å; I271-E275 HydrophobicContact CG2-CG 4.45Å; I271-E275 WeakPolarHBondContact O-CG 3.5Å; I271-E275 PolarHBondContact O-N 3.37Å; I271-F284 HydrophobicContact CG1-CB 4.06Å; I271-F284 HydrophobicContact CG1-CD2 4.49Å; I271-T286 HydrophobicContact CD1-CG2 3.27Å
272	E	93.4	Very high	90	Very high	115 Å²	115	86.8 Å²	86.8	54%	0.537	44%	0.437	S	S	.	.	H	α-helix	trans	-58.6	-42.6	178.6	-70.9	174.1	-176.8	0	0	111.7	R268 S274 E275 S276	R268-E272 WeakPolarHBondContact CD-OE1 3.23Å; R268-E272 HydrophobicContact CG-CG 4.25Å; R268-E272 WeakPolarHBondContact CG-OE1 3.43Å; R268-E272 WeakPolarHBondContact O-CB 3.41Å; R268-E272 WeakPolarHBondContact O-CG 3.45Å; R268-E272 PolarHBondContact O-N 3.08Å; E272-S274 VanDerWaalsContact C-N 3.33Å; E272-S274 PolarHBondContact O-N 2.93Å; E272-E275 PolarHBondContact O-N 2.74Å; E272-S276 WeakPolarHBondContact O-CB 3.46Å; E272-S276 PolarHBondContact O-N 2.87Å
273	W	92.2	Very high	89.8	Confident	124 Å²	124	89.5 Å²	89.5	47%	0.47	45%	0.447	S	S	.	.	H	α-helix	trans	-61.2	-41.8	175	171.4	84.7	0	0	0	112.3	T269 I270 I271 S276 R279 Y281	T269-W273 WeakPolarHBondContact O-CB 3.15Å; T269-W273 PolarHBondContact O-N 2.77Å; I270-W273 PolarHBondContact O-N 3.44Å; I271-W273 VanDerWaalsContact C-N 3.31Å; I271-W273 PolarHBondContact O-N 3.46Å; W273-S276 PolarHBondContact O-OG 3.35Å; W273-R279 PolarHBondContact O-NE 3.33Å; W273-Y281 HydrophobicContact CH2-CE2 4.18Å; W273-Y281 HydrophobicContact CZ3-CE2 4.16Å
274	S	91.3	Very high	89.9	Confident	12 Å²	12	90.4 Å²	90.4	8%	0.084	45%	0.449	C	S	.	.	H	α-helix	trans	-68.1	-35.6	179.5	76.6	0	0	0	0	112.8	I270 I271 E272 H277 F284	I270-S274 WeakPolarHBondContact O-CB 3.32Å; I270-S274 PolarHBondContact O-N 2.95Å; I270-S274 PolarHBondContact O-OG 3.04Å; I271-S274 PolarHBondContact O-N 2.63Å; I271-S274 PolarHBondContact O-OG 3.43Å; E272-S274 VanDerWaalsContact C-N 3.33Å; E272-S274 PolarHBondContact O-N 2.93Å; S274-H277 VanDerWaalsContact O-O 3.07Å; S274-F284 WeakPolarHBondContact OG-CD2 3.4Å
275	E	90.6	Very high	90	Very high	112 Å²	112	87.1 Å²	87.1	52%	0.523	44%	0.442	S	S	.	.	H	α-helix	trans	-83.8	-18	-179.2	-67.2	-173.7	151.3	0	0	113.2	I271 E272 H277	I271-E275 HydrophobicContact CG2-CG 4.45Å; I271-E275 WeakPolarHBondContact O-CG 3.5Å; I271-E275 PolarHBondContact O-N 3.37Å; E272-E275 PolarHBondContact O-N 2.74Å; E275-H277 PolarHBondContact O-N 3.16Å
276	S	90.2	Very high	90.2	Very high	67 Å²	67	88.8 Å²	88.8	47%	0.469	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-27.5	-178.7	69.4	0	0	0	0	114.1	E272 W273	E272-S276 WeakPolarHBondContact O-CB 3.46Å; E272-S276 PolarHBondContact O-N 2.87Å; W273-S276 PolarHBondContact O-OG 3.35Å
277	H	87.3	Confident	90.4	Very high	126 Å²	126	87.8 Å²	87.8	58%	0.583	45%	0.451	S	S	*	.	S	Bend	trans	-145.9	149.5	-179.1	-65.7	78.4	0	0	0	109.2	S274 E275 R279	S274-H277 VanDerWaalsContact O-O 3.07Å; E275-H277 PolarHBondContact O-N 3.16Å; H277-R279 HydrophobicContact CB-CG 4.33Å; H277-R279 PolarHBondContact O-N 3.1Å
278	D	87	Confident	90.5	Very high	159 Å²	159	92.9 Å²	92.9	85%	0.85	47%	0.47	S	S	*	.			trans	-68.6	105.1	169.4	-174.8	7.8	0	0	0	109.6	G280	D278-G280 PolarHBondContact OD1-N 3.31Å; D278-G280 VanDerWaalsContact OD1-N 3.13Å
279	R	85.9	Confident	90.7	Very high	104 Å²	104	86 Å²	86	39%	0.392	44%	0.444	S	S	.	.			trans	-108.2	3.3	-179.9	-64.6	174.7	-174.2	-77.7	-2.4	112.1	W273 H277 Y281	W273-R279 PolarHBondContact O-NE 3.33Å; H277-R279 HydrophobicContact CB-CG 4.33Å; H277-R279 PolarHBondContact O-N 3.1Å; R279-Y281 HydrophobicContact CB-CD2 3.47Å; R279-Y281 VanDerWaalsContact CB-CD2 3.47Å; R279-Y281 HydrophobicContact CB-CE2 3.55Å; R279-Y281 HydrophobicContact CB-CG 4.41Å; R279-Y281 HydrophobicContact CG-CD2 4.43Å; R279-Y281 HydrophobicContact CG-CE2 4.32Å; R279-Y281 PolarHBondContact O-N 3.23Å
280	G	81.8	Confident	90.9	Very high	68 Å²	68	81.8 Å²	81.8	70%	0.701	42%	0.417	S	S	*	.	S	Bend	trans	73.8	8.8	-174.1	0	0	0	0	0	114.9	D278	D278-G280 PolarHBondContact OD1-N 3.31Å; D278-G280 VanDerWaalsContact OD1-N 3.13Å
281	Y	79.5	Confident	91.2	Very high	140 Å²	140	83.8 Å²	83.8	55%	0.549	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-80.8	142.4	170.5	-56.4	-55.8	0	0	0	110.3	W273 R279	W273-Y281 HydrophobicContact CH2-CE2 4.18Å; W273-Y281 HydrophobicContact CZ3-CE2 4.16Å; R279-Y281 HydrophobicContact CB-CD2 3.47Å; R279-Y281 VanDerWaalsContact CB-CD2 3.47Å; R279-Y281 HydrophobicContact CB-CE2 3.55Å; R279-Y281 HydrophobicContact CB-CG 4.41Å; R279-Y281 HydrophobicContact CG-CD2 4.43Å; R279-Y281 HydrophobicContact CG-CE2 4.32Å; R279-Y281 PolarHBondContact O-N 3.23Å
282	G	78.9	Confident	91.4	Very high	59 Å²	59	85.6 Å²	85.6	61%	0.608	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-65.1	162.4	166.3	0	0	0	0	0	111.1	F284	G282-F284 PolarHBondContact O-N 3.31Å
283	K	87.3	Confident	91.6	Very high	177 Å²	177	81.5 Å²	81.5	77%	0.77	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-66.1	122.3	174.9	-72.2	-168.5	175.2	-167.8	0	110.4
284	F	94.3	Very high	91.9	Very high	39 Å²	39	75.7 Å²	75.7	17%	0.171	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-68.8	147.3	172.4	-64.4	-52.3	0	0	0	111.3	Y249 G252 F254 I270 I271 S274 G282	Y249-F284 AromaticContact CE2-CD1 3.91Å; Y249-F284 HydrophobicContact CE2-CD1 3.91Å; Y249-F284 HydrophobicContact CE2-CE1 4Å; Y249-F284 AromaticContact CZ-CE1 3.98Å; Y249-F284 VanDerWaalsContact OH-CE1 3.29Å; Y249-F284 WeakPolarHBondContact OH-CE1 3.45Å; G252-F284 WeakPolarHBondContact O-CA 3.37Å; F254-F284 HydrophobicContact CD2-CB 4.1Å; F254-F284 HydrophobicContact CD2-CG 4.46Å; F254-F284 HydrophobicContact CE2-CB 3.8Å; F254-F284 HydrophobicContact CE2-CD1 4.08Å; F254-F284 HydrophobicContact CE2-CD2 4.01Å; F254-F284 AromaticContact CE2-CG 3.7Å; F254-F284 HydrophobicContact CE2-CG 3.7Å; I270-F284 HydrophobicContact CG2-CE2 4.49Å; I271-F284 HydrophobicContact CG1-CB 4.06Å; I271-F284 HydrophobicContact CG1-CD2 4.49Å; S274-F284 WeakPolarHBondContact OG-CD2 3.4Å; G282-F284 PolarHBondContact O-N 3.31Å
285	Q	95.8	Very high	92.3	Very high	126 Å²	126	76.7 Å²	76.7	59%	0.589	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.2	158.9	176.5	-59.3	-177	10.4	0	0	110.2	G252 T253 F254	G252-Q285 PolarHBondContact O-N 3.17Å; T253-Q285 WeakPolarHBondContact CA-O 3.26Å; T253-Q285 HydrophobicContact CG2-CB 4.11Å; F254-Q285 PolarHBondContact N-O 3.33Å
286	T	97	Very high	92.6	Very high	73 Å²	73	74.5 Å²	74.5	45%	0.448	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	142.9	172.6	60.6	0	0	0	0	110.2	F254 I271	F254-T286 HydrophobicContact CB-CG2 4.37Å; F254-T286 CarbonylContact O-C 3.59Å; F254-T286 WeakPolarHBondContact O-CA 3.2Å; I271-T286 HydrophobicContact CD1-CG2 3.27Å
287	A	97.5	Very high	93	Very high	16 Å²	16	71.3 Å²	71.3	13%	0.132	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	161.4	177.3	0	0	0	0	0	110.3	T253 F254 Y255 N256 F292	T253-A287 HydrophobicContact CG2-CB 4.03Å; F254-A287 PolarHBondContact O-N 2.93Å; Y255-A287 HydrophobicContact CD1-CB 3.8Å; Y255-A287 HydrophobicContact CE1-CB 4.06Å; N256-A287 PolarHBondContact N-O 3.23Å; A287-F292 HydrophobicContact CB-CD2 4.22Å; A287-F292 HydrophobicContact CB-CE2 3.65Å; A287-F292 HydrophobicContact CB-CZ 4.07Å
288	R	97.8	Very high	93.4	Very high	107 Å²	107	68.9 Å²	68.9	40%	0.404	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	120.4	173	-71.3	166.7	55	69.6	7.1	108.3	K258 E290 D291 F292	K258-R288 HydrophobicContact CB-CG 4.46Å; K258-R288 HydrophobicContact CD-CG 4.08Å; R288-E290 HydrophobicContact CB-CG 4.46Å; R288-E290 IonicContact CZ-OE1 2.74Å; R288-E290 IonicContact NE-OE1 3.38Å; R288-E290 IonicContact NH1-OE1 3.16Å; R288-E290 PolarHBondContact NH1-OE1 2.84Å; R288-E290 IonicContact NH2-OE1 3.1Å; R288-E290 PolarHBondContact NH2-OE1 3.34Å; R288-E290 PolarHBondContact O-N 2.86Å; R288-D291 HydrophobicContact CB-CB 4.31Å; R288-D291 WeakPolarHBondContact CB-OD2 3.4Å; R288-D291 VanDerWaalsContact CD-OD2 3.23Å; R288-D291 WeakPolarHBondContact CD-OD2 3.38Å; R288-D291 IonicContact CZ-OD2 2.84Å; R288-D291 IonicContact NE-OD2 3.17Å; R288-D291 PolarHBondContact NE-OD2 2.78Å; R288-D291 PolarHBondContact O-N 3.12Å; R288-F292 WeakPolarHBondContact O-CD2 3.31Å
289	M	97.9	Very high	93.8	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-59.3	-36.6	-175	-172	-170.8	-67.2	0	0	112.3	L208 T209 R212 F248 Y255 N256 D257 D291 F292	L208-M289 HydrophobicContact CB-CG 3.62Å; L208-M289 HydrophobicContact CB-SD 4.46Å; L208-M289 HydrophobicContact CD1-CG 4.46Å; T209-M289 HydrophobicContact CG2-CB 4.08Å; T209-M289 HydrophobicContact CG2-CG 3.73Å; T209-M289 HydrophobicContact CG2-SD 3.79Å; R212-M289 HydrophobicContact CB-SD 4.02Å; R212-M289 HydrophobicContact CG-SD 4.37Å; F248-M289 HydrophobicContact CD2-CE 3.7Å; F248-M289 HydrophobicContact CD2-CG 4.48Å; F248-M289 HydrophobicContact CD2-SD 4.01Å; F248-M289 HydrophobicContact CE2-CE 4.17Å; F248-M289 HydrophobicContact CE2-SD 4.1Å; Y255-M289 WeakPolarHBondContact O-CE 3.46Å; N256-M289 WeakPolarHBondContact O-CB 3.49Å; N256-M289 PolarHBondContact O-N 3.28Å; D257-M289 HydrophobicContact CB-CB 4.48Å; D257-M289 HydrophobicContact CB-CE 3.91Å; D257-M289 HydrophobicContact CB-SD 4.09Å; M289-D291 PolarHBondContact O-N 3.12Å; M289-F292 PolarHBondContact O-N 2.81Å
290	E	97.3	Very high	94.1	Very high	15 Å²	15	58.2 Å²	58.2	7%	0.07	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-69.8	-10.7	-178.1	59.8	-96.6	-136.5	0	0	115.2	K207 T209 K258 R259 R288	K207-E290 WeakPolarHBondContact CD-O 3.43Å; K207-E290 WeakPolarHBondContact CE-O 3.49Å; K207-E290 PolarHBondContact NZ-O 2.9Å; T209-E290 HydrophobicContact CG2-CB 4.01Å; K258-E290 PolarHBondContact N-OE2 2.8Å; K258-E290 VanDerWaalsContact N-OE2 3.12Å; R259-E290 HydrophobicContact CG-CB 3.76Å; R259-E290 HydrophobicContact CG-CG 4.16Å; R259-E290 PolarHBondContact N-OE1 3.03Å; R288-E290 HydrophobicContact CB-CG 4.46Å; R288-E290 IonicContact CZ-OE1 2.74Å; R288-E290 IonicContact NE-OE1 3.38Å; R288-E290 IonicContact NH1-OE1 3.16Å; R288-E290 PolarHBondContact NH1-OE1 2.84Å; R288-E290 IonicContact NH2-OE1 3.1Å; R288-E290 PolarHBondContact NH2-OE1 3.34Å; R288-E290 PolarHBondContact O-N 2.86Å
291	D	98.1	Very high	94.6	Very high	96 Å²	96	57.8 Å²	57.8	51%	0.513	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-99	-1.6	-177.5	-61.9	-22.7	0	0	0	112.4	R288 M289	R288-D291 HydrophobicContact CB-CB 4.31Å; R288-D291 WeakPolarHBondContact CB-OD2 3.4Å; R288-D291 VanDerWaalsContact CD-OD2 3.23Å; R288-D291 WeakPolarHBondContact CD-OD2 3.38Å; R288-D291 IonicContact CZ-OD2 2.84Å; R288-D291 IonicContact NE-OD2 3.17Å; R288-D291 PolarHBondContact NE-OD2 2.78Å; R288-D291 PolarHBondContact O-N 3.12Å; M289-D291 PolarHBondContact O-N 3.12Å
292	F	98.4	Very high	95.1	Very high	63 Å²	63	52.4 Å²	52.4	28%	0.276	28%	0.278	S	S	.	.			trans	-124.3	142.9	-174.5	-74.9	-103	0	0	0	112.6	K207 L208 Y255 A287 R288 M289 D296	K207-F292 WeakPolarHBondContact CA-O 3.38Å; L208-F292 HydrophobicContact CD1-CB 4.03Å; L208-F292 HydrophobicContact CG-CB 4.33Å; L208-F292 PolarHBondContact N-O 2.83Å; L208-F292 VanDerWaalsContact N-O 3.14Å; Y255-F292 HydrophobicContact CD1-CB 4.23Å; Y255-F292 HydrophobicContact CD1-CD1 4.33Å; Y255-F292 HydrophobicContact CD1-CD2 4.12Å; Y255-F292 AromaticContact CD1-CG 3.96Å; Y255-F292 HydrophobicContact CD1-CG 3.96Å; Y255-F292 HydrophobicContact CE1-CB 4.26Å; Y255-F292 AromaticContact CE1-CD1 3.64Å; Y255-F292 HydrophobicContact CE1-CD1 3.64Å; Y255-F292 HydrophobicContact CE1-CD2 4.15Å; Y255-F292 AromaticContact CE1-CE1 3.96Å; Y255-F292 HydrophobicContact CE1-CE1 3.96Å; Y255-F292 HydrophobicContact CE1-CE2 4.45Å; Y255-F292 AromaticContact CE1-CG 3.74Å; Y255-F292 HydrophobicContact CE1-CG 3.74Å; Y255-F292 HydrophobicContact CE1-CZ 4.35Å; A287-F292 HydrophobicContact CB-CD2 4.22Å; A287-F292 HydrophobicContact CB-CE2 3.65Å; A287-F292 HydrophobicContact CB-CZ 4.07Å; R288-F292 WeakPolarHBondContact O-CD2 3.31Å; M289-F292 PolarHBondContact O-N 2.81Å; F292-D296 HydrophobicContact CD1-CB 3.72Å; F292-D296 HydrophobicContact CE1-CB 4.42Å
293	T	98.6	Very high	95.6	Very high	29 Å²	29	53 Å²	53	18%	0.178	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-105.4	170.9	170.3	68.4	0	0	0	0	111.2	S205 Q206 K207 N295 D296	S205-T293 VanDerWaalsContact O-CG2 3.31Å; S205-T293 WeakPolarHBondContact O-CG2 3.35Å; Q206-T293 CarbonylContact O-C 3.56Å; Q206-T293 WeakPolarHBondContact O-CA 3.34Å; Q206-T293 WeakPolarHBondContact O-CB 3.33Å; K207-T293 HydrophobicContact CG-CG2 4.41Å; T293-N295 PolarHBondContact O-N 3.17Å; T293-N295 PolarHBondContact OG1-N 2.99Å; T293-D296 WeakPolarHBondContact CB-OD2 3.48Å; T293-D296 PolarHBondContact N-OD2 3.47Å; T293-D296 PolarHBondContact O-N 2.98Å; T293-D296 PolarHBondContact OG1-OD2 3.16Å
294	F	98.3	Very high	95.9	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.009	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-63.1	-30.9	172.8	-78.2	-85.1	0	0	0	112.7	V40 L178 V202 G204 Q206 L208 L211 D296 L297	V40-F294 VanDerWaalsContact CB-O 3.25Å; V40-F294 WeakPolarHBondContact CB-O 3.15Å; V40-F294 WeakPolarHBondContact CG1-O 3.41Å; L178-F294 HydrophobicContact CD1-CB 4.01Å; L178-F294 HydrophobicContact CD2-CB 4.25Å; L178-F294 HydrophobicContact CD2-CD1 4.11Å; V202-F294 HydrophobicContact CB-CD2 4.16Å; V202-F294 HydrophobicContact CB-CE2 3.93Å; V202-F294 HydrophobicContact CB-CZ 4.32Å; V202-F294 HydrophobicContact CG1-CE2 4.17Å; V202-F294 HydrophobicContact CG1-CZ 4.29Å; V202-F294 HydrophobicContact CG2-CD1 4Å; V202-F294 HydrophobicContact CG2-CD2 3.83Å; V202-F294 HydrophobicContact CG2-CE1 3.94Å; V202-F294 HydrophobicContact CG2-CE2 3.77Å; V202-F294 HydrophobicContact CG2-CG 3.96Å; V202-F294 HydrophobicContact CG2-CZ 3.84Å; G204-F294 CarbonylContact O-C 3.58Å; G204-F294 PolarHBondContact O-N 3.42Å; Q206-F294 WeakPolarHBondContact O-CD2 3.34Å; Q206-F294 PolarHBondContact O-N 3.32Å; Q206-F294 VanDerWaalsContact O-N 3.07Å; L208-F294 HydrophobicContact CD2-CD1 4.14Å; L208-F294 HydrophobicContact CD2-CD2 4.13Å; L208-F294 HydrophobicContact CD2-CE1 3.98Å; L208-F294 HydrophobicContact CD2-CE2 3.96Å; L208-F294 HydrophobicContact CD2-CG 4.2Å; L208-F294 HydrophobicContact CD2-CZ 3.86Å; L211-F294 HydrophobicContact CB-CE2 4.12Å; L211-F294 HydrophobicContact CB-CZ 3.91Å; L211-F294 HydrophobicContact CD2-CE1 4.31Å; L211-F294 HydrophobicContact CD2-CZ 3.6Å; L211-F294 HydrophobicContact CG-CZ 4.36Å; F294-D296 PolarHBondContact O-N 2.9Å; F294-L297 HydrophobicContact CD1-CD1 3.9Å; F294-L297 HydrophobicContact CE1-CD1 4.31Å; F294-L297 WeakPolarHBondContact O-CB 3.47Å; F294-L297 PolarHBondContact O-N 2.65Å
295	N	98.3	Very high	95.9	Very high	32 Å²	32	46.6 Å²	46.6	17%	0.171	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-62.3	-26.9	175.6	-77.6	-27.1	0	0	0	113.1	H39 G41 G204 S205 T293 L297	H39-N295 PolarHBondContact CE1-O 3.02Å; H39-N295 PolarHBondContact NE2-O 3.02Å; G41-N295 WeakPolarHBondContact CA-O 3.46Å; G41-N295 PolarHBondContact N-O 3.32Å; G204-N295 VanDerWaalsContact CA-OD1 3.32Å; G204-N295 WeakPolarHBondContact CA-OD1 3.35Å; G204-N295 VanDerWaalsContact O-CG 3.23Å; G204-N295 PolarHBondContact O-N 3.41Å; G204-N295 PolarHBondContact O-ND2 3.38Å; S205-N295 PolarHBondContact N-ND2 2.95Å; T293-N295 PolarHBondContact O-N 3.17Å; T293-N295 PolarHBondContact OG1-N 2.99Å; N295-L297 VanDerWaalsContact C-N 3.29Å
296	D	98.3	Very high	95.9	Very high	67 Å²	67	42.4 Å²	42.4	36%	0.358	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-82.8	-8	-178.6	-56	-53.9	0	0	0	112.9	F292 T293 F294	F292-D296 HydrophobicContact CD1-CB 3.72Å; F292-D296 HydrophobicContact CE1-CB 4.42Å; T293-D296 WeakPolarHBondContact CB-OD2 3.48Å; T293-D296 PolarHBondContact N-OD2 3.47Å; T293-D296 PolarHBondContact O-N 2.98Å; T293-D296 PolarHBondContact OG1-OD2 3.16Å; F294-D296 PolarHBondContact O-N 2.9Å
297	L	97.6	Very high	95.9	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.204	C	C	.	.			trans	-81.5	144.9	-174.6	-62.1	-174.7	0	0	0	112.3	H39 V40 L208 F250 Y255 F294 N295 I299	H39-L297 WeakPolarHBondContact CA-O 3.45Å; V40-L297 HydrophobicContact CG2-CB 4.39Å; V40-L297 PolarHBondContact N-O 3.5Å; L208-L297 HydrophobicContact CD1-CD2 4.12Å; L208-L297 HydrophobicContact CD2-CD1 3.78Å; L208-L297 HydrophobicContact CD2-CD2 4.35Å; L208-L297 HydrophobicContact CD2-CG 4.25Å; F250-L297 HydrophobicContact CD2-CD1 4.02Å; F250-L297 HydrophobicContact CD2-CD2 4.35Å; F250-L297 HydrophobicContact CE2-CD1 4.03Å; F250-L297 HydrophobicContact CG-CD1 4.29Å; F250-L297 HydrophobicContact CZ-CD1 4.36Å; Y255-L297 HydrophobicContact CE1-CD2 4.02Å; Y255-L297 HydrophobicContact CE2-CD2 4Å; F294-L297 HydrophobicContact CD1-CD1 3.9Å; F294-L297 HydrophobicContact CE1-CD1 4.31Å; F294-L297 WeakPolarHBondContact O-CB 3.47Å; F294-L297 PolarHBondContact O-N 2.65Å; N295-L297 VanDerWaalsContact C-N 3.29Å; L297-I299 HydrophobicContact CB-CG2 3.83Å; L297-I299 HydrophobicContact CD1-CG2 4.35Å
298	N	95.9	Very high	95.9	Very high	75 Å²	75	38.4 Å²	38.4	40%	0.401	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	127.8	157.7	-68.6	-76	0	0	0	108.4	F38 H39 E251	F38-N298 CarbonylContact O-C 3.57Å; F38-N298 VanDerWaalsContact O-CA 3.31Å; F38-N298 WeakPolarHBondContact O-CA 3.38Å; H39-N298 WeakPolarHBondContact CA-OD1 3.37Å; H39-N298 WeakPolarHBondContact CB-OD1 3.34Å; H39-N298 PolarHBondContact N-OD1 3.04Å; E251-N298 HydrophobicContact CB-CB 4.47Å; E251-N298 HydrophobicContact CG-CB 4.32Å; E251-N298 WeakPolarHBondContact CG-O 3.42Å
299	I	94.8	Very high	95.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	165.5	-177.9	72.1	161.8	0	0	0	112.5	A37 F38 V40 F250 L297 L301 Y305 I319 I322	A37-I299 CarbonylContact C-O 3.56Å; A37-I299 WeakPolarHBondContact CA-O 3.43Å; F38-I299 WeakPolarHBondContact CD1-O 3.45Å; F38-I299 HydrophobicContact CE1-CG1 4.48Å; F38-I299 HydrophobicContact CE2-CG1 4.4Å; F38-I299 HydrophobicContact CZ-CD1 4.44Å; F38-I299 HydrophobicContact CZ-CG1 4.16Å; F38-I299 PolarHBondContact N-O 2.98Å; F38-I299 PolarHBondContact O-N 2.93Å; V40-I299 HydrophobicContact CG2-CD1 3.99Å; V40-I299 HydrophobicContact CG2-CG1 3.8Å; V40-I299 HydrophobicContact CG2-CG2 4.36Å; F250-I299 HydrophobicContact CD1-CG2 4.32Å; L297-I299 HydrophobicContact CB-CG2 3.83Å; L297-I299 HydrophobicContact CD1-CG2 4.35Å; I299-L301 HydrophobicContact CD1-CD2 4.38Å; I299-Y305 WeakPolarHBondContact CA-OH 3.32Å; I299-Y305 HydrophobicContact CB-CE2 4.17Å; I299-Y305 HydrophobicContact CG2-CE2 4.49Å; I299-I319 HydrophobicContact CB-CD1 4.48Å; I299-I319 HydrophobicContact CD1-CB 3.97Å; I299-I319 HydrophobicContact CD1-CD1 3.56Å; I299-I319 HydrophobicContact CD1-CG1 4.36Å; I299-I319 HydrophobicContact CD1-CG2 3.73Å; I299-I319 HydrophobicContact CG2-CD1 3.98Å; I299-I322 HydrophobicContact CD1-CD1 3.58Å; I299-I322 HydrophobicContact CG1-CD1 4.5Å
300	K	93.2	Very high	95.4	Very high	39 Å²	39	35.3 Å²	35.3	17%	0.17	19%	0.189	C	C	.	.			trans	-117.1	123.9	167.6	-66.2	159.5	-174.1	173.3	0	107	H34 T35 A37 E251 G302 F303 Y305	H34-K300 VanDerWaalsContact O-CD 3.32Å; H34-K300 WeakPolarHBondContact O-CD 3.49Å; T35-K300 WeakPolarHBondContact O-CE 3.43Å; A37-K300 HydrophobicContact CB-CG 4.09Å; E251-K300 VanDerWaalsContact OE1-CD 3.31Å; E251-K300 WeakPolarHBondContact OE1-CD 3.42Å; E251-K300 WeakPolarHBondContact OE1-CE 3.45Å; E251-K300 IonicContact OE1-NZ 3.77Å; E251-K300 WeakPolarHBondContact OE2-CE 3.46Å; E251-K300 IonicContact OE2-NZ 3.91Å; E251-K300 PolarHBondContact OE2-NZ 3.26Å; K300-G302 PolarHBondContact O-N 2.95Å; K300-F303 HydrophobicContact CB-CB 3.5Å; K300-F303 HydrophobicContact CB-CG 4.11Å; K300-F303 HydrophobicContact CD-CB 4.33Å; K300-F303 HydrophobicContact CD-CD2 3.91Å; K300-F303 HydrophobicContact CD-CE2 4.4Å; K300-F303 HydrophobicContact CD-CG 4.01Å; K300-F303 WeakPolarHBondContact O-CB 3.24Å; K300-F303 PolarHBondContact O-N 3.03Å; K300-Y305 PolarHBondContact N-OH 2.94Å
301	L	91.4	Very high	95	Very high	59 Å²	59	36.6 Å²	36.6	31%	0.309	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	139.2	174	-69.7	173.7	0	0	0	109.7	H34 F38 I299 F303 I319 I322	H34-L301 PolarHBondContact CE1-O 3.35Å; H34-L301 PolarHBondContact ND1-O 3.26Å; F38-L301 HydrophobicContact CE1-CD1 4.26Å; F38-L301 HydrophobicContact CE1-CG 3.9Å; F38-L301 HydrophobicContact CZ-CD1 4.16Å; F38-L301 HydrophobicContact CZ-CD2 4.31Å; F38-L301 HydrophobicContact CZ-CG 3.87Å; I299-L301 HydrophobicContact CD1-CD2 4.38Å; L301-F303 PolarHBondContact O-N 3.48Å; L301-I319 WeakPolarHBondContact CA-O 3.16Å; L301-I319 HydrophobicContact CD2-CG2 4.07Å; L301-I322 HydrophobicContact CD2-CD1 4.02Å; L301-I322 HydrophobicContact CD2-CG1 3.81Å
302	G	90.1	Very high	94.5	Very high	26 Å²	26	37.7 Å²	37.7	27%	0.268	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.2	1	-179.3	0	0	0	0	0	115.4	K300 I319	K300-G302 PolarHBondContact O-N 2.95Å; G302-I319 PolarHBondContact N-O 2.89Å
303	F	90.7	Very high	94.2	Very high	72 Å²	72	34.8 Å²	34.8	32%	0.316	20%	0.2	S	C	.	.			trans	-82.7	139.9	179.7	-169.8	-91.4	0	0	0	111.8	K300 L301 Y305	K300-F303 HydrophobicContact CB-CB 3.5Å; K300-F303 HydrophobicContact CB-CG 4.11Å; K300-F303 HydrophobicContact CD-CB 4.33Å; K300-F303 HydrophobicContact CD-CD2 3.91Å; K300-F303 HydrophobicContact CD-CE2 4.4Å; K300-F303 HydrophobicContact CD-CG 4.01Å; K300-F303 WeakPolarHBondContact O-CB 3.24Å; K300-F303 PolarHBondContact O-N 3.03Å; L301-F303 PolarHBondContact O-N 3.48Å; F303-Y305 HydrophobicContact CB-CE2 4.12Å; F303-Y305 HydrophobicContact CD1-CD1 4.01Å; F303-Y305 HydrophobicContact CD1-CD2 4.49Å; F303-Y305 AromaticContact CD1-CE1 3.59Å; F303-Y305 HydrophobicContact CD1-CE1 3.59Å; F303-Y305 HydrophobicContact CD1-CE2 4.13Å; F303-Y305 HydrophobicContact CD1-CG 4.44Å; F303-Y305 AromaticContact CD1-CZ 3.65Å; F303-Y305 HydrophobicContact CE1-CD1 4.4Å; F303-Y305 HydrophobicContact CE1-CE1 4.08Å; F303-Y305 WeakPolarHBondContact O-CD2 3.48Å; F303-Y305 PolarHBondContact O-N 3.4Å
304	P	92.1	Very high	94	Very high	75 Å²	75	37 Å²	37	49%	0.487	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	112.7	177.8	30.7	-34.1	0	0	0	111.7	V316	P304-V316 HydrophobicContact CB-CG1 3.58Å
305	Y	95.6	Very high	93.7	Very high	6 Å²	6	37 Å²	37	2%	0.024	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	173	169.2	-64	-67.5	0	0	0	111.3	Y249 F250 E251 I299 K300 F303 V316 V317	Y249-Y305 WeakPolarHBondContact O-CB 3.18Å; F250-Y305 HydrophobicContact CB-CD1 4.26Å; F250-Y305 HydrophobicContact CB-CE1 4.4Å; F250-Y305 AromaticContact CD1-CD1 3.51Å; F250-Y305 HydrophobicContact CD1-CD1 3.51Å; F250-Y305 AromaticContact CD1-CD2 3.48Å; F250-Y305 HydrophobicContact CD1-CD2 3.48Å; F250-Y305 VanDerWaalsContact CD1-CD2 3.48Å; F250-Y305 AromaticContact CD1-CE1 3.98Å; F250-Y305 HydrophobicContact CD1-CE1 3.98Å; F250-Y305 AromaticContact CD1-CE2 3.94Å; F250-Y305 HydrophobicContact CD1-CE2 3.94Å; F250-Y305 AromaticContact CD1-CG 3.23Å; F250-Y305 HydrophobicContact CD1-CG 3.23Å; F250-Y305 HydrophobicContact CE1-CD1 4.24Å; F250-Y305 AromaticContact CE1-CD2 3.53Å; F250-Y305 HydrophobicContact CE1-CD2 3.53Å; F250-Y305 HydrophobicContact CE1-CE2 4.28Å; F250-Y305 AromaticContact CE1-CG 3.49Å; F250-Y305 HydrophobicContact CE1-CG 3.49Å; F250-Y305 VanDerWaalsContact CE1-CG 3.49Å; F250-Y305 HydrophobicContact CG-CD1 4.22Å; F250-Y305 HydrophobicContact CG-CG 4.27Å; E251-Y305 HydrophobicContact CG-CE1 4.21Å; E251-Y305 WeakPolarHBondContact OE1-CE1 3.41Å; E251-Y305 PolarHBondContact OE1-OH 2.93Å; I299-Y305 WeakPolarHBondContact CA-OH 3.32Å; I299-Y305 HydrophobicContact CB-CE2 4.17Å; I299-Y305 HydrophobicContact CG2-CE2 4.49Å; K300-Y305 PolarHBondContact N-OH 2.94Å; F303-Y305 HydrophobicContact CB-CE2 4.12Å; F303-Y305 HydrophobicContact CD1-CD1 4.01Å; F303-Y305 HydrophobicContact CD1-CD2 4.49Å; F303-Y305 AromaticContact CD1-CE1 3.59Å; F303-Y305 HydrophobicContact CD1-CE1 3.59Å; F303-Y305 HydrophobicContact CD1-CE2 4.13Å; F303-Y305 HydrophobicContact CD1-CG 4.44Å; F303-Y305 AromaticContact CD1-CZ 3.65Å; F303-Y305 HydrophobicContact CE1-CD1 4.4Å; F303-Y305 HydrophobicContact CE1-CE1 4.08Å; F303-Y305 WeakPolarHBondContact O-CD2 3.48Å; F303-Y305 PolarHBondContact O-N 3.4Å; Y305-V316 CarbonylContact O-C 3.58Å; Y305-V316 WeakPolarHBondContact O-CA 3.27Å; Y305-V317 WeakPolarHBondContact CA-O 3.37Å; Y305-V317 WeakPolarHBondContact CB-O 3.47Å; Y305-V317 PolarHBondContact N-O 3.03Å; Y305-V317 PolarHBondContact O-N 3.32Å
306	L	95.6	Very high	93.5	Very high	38 Å²	38	37.2 Å²	37.2	20%	0.199	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	130.8	-175.4	172.3	67.1	0	0	0	110.9	F247 F248 Y249 E314	F247-L306 HydrophobicContact CE2-CD2 3.8Å; F247-L306 HydrophobicContact CE2-CG 4.08Å; F247-L306 HydrophobicContact CZ-CD2 4.03Å; F248-L306 CarbonylContact C-O 3.55Å; F248-L306 WeakPolarHBondContact CA-O 3.42Å; Y249-L306 HydrophobicContact CD1-CB 4.48Å; Y249-L306 PolarHBondContact N-O 3.4Å; Y249-L306 PolarHBondContact O-N 3.02Å; L306-E314 HydrophobicContact CD1-CB 3.81Å; L306-E314 HydrophobicContact CD1-CG 4.12Å
307	Y	97.3	Very high	93.4	Very high	2 Å²	2	34 Å²	34	1%	0.008	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	128.2	160.5	171.2	-113.4	0	0	0	108.4	R212 I215 A246 F247 F248 H309 E314 H315	R212-Y307 HydrophobicContact CG-CE2 3.98Å; R212-Y307 WeakPolarHBondContact CG-OH 3.39Å; I215-Y307 HydrophobicContact CB-CE1 4.44Å; I215-Y307 HydrophobicContact CD1-CD1 3.62Å; I215-Y307 HydrophobicContact CD1-CD2 4.29Å; I215-Y307 HydrophobicContact CD1-CE1 3.57Å; I215-Y307 HydrophobicContact CD1-CE2 4.25Å; I215-Y307 HydrophobicContact CD1-CG 3.99Å; I215-Y307 HydrophobicContact CG2-CE1 3.99Å; A246-Y307 HydrophobicContact CB-CE2 3.99Å; F247-Y307 WeakPolarHBondContact O-CA 3.5Å; F247-Y307 WeakPolarHBondContact O-CD2 3.18Å; F248-Y307 AromaticContact CD1-CD2 3.63Å; F248-Y307 HydrophobicContact CD1-CD2 3.63Å; F248-Y307 HydrophobicContact CD1-CG 4.06Å; F248-Y307 HydrophobicContact CD2-CD2 4.26Å; F248-Y307 AromaticContact CE1-CD2 3.34Å; F248-Y307 HydrophobicContact CE1-CD2 3.34Å; F248-Y307 HydrophobicContact CE1-CE2 4.19Å; F248-Y307 AromaticContact CE1-CG 3.68Å; F248-Y307 HydrophobicContact CE1-CG 3.68Å; F248-Y307 HydrophobicContact CE2-CD2 4.02Å; F248-Y307 HydrophobicContact CE2-CE2 4.2Å; F248-Y307 HydrophobicContact CG-CD2 4.07Å; F248-Y307 AromaticContact CZ-CD2 3.55Å; F248-Y307 HydrophobicContact CZ-CD2 3.55Å; F248-Y307 AromaticContact CZ-CE2 3.93Å; F248-Y307 HydrophobicContact CZ-CE2 3.93Å; F248-Y307 HydrophobicContact CZ-CG 4.22Å; Y307-H309 HydrophobicContact CE1-CB 4.07Å; Y307-H309 AromaticContact CE1-CD2 3.61Å; Y307-H309 AromaticContact CE1-CG 3.89Å; Y307-E314 CarbonylContact O-C 3.55Å; Y307-H315 HydrophobicContact CD1-CB 4.17Å; Y307-H315 AromaticContact CD1-CD2 3.85Å; Y307-H315 PolarHBondContact N-O 3.47Å; Y307-H315 PolarHBondContact O-N 2.83Å
308	C	96	Very high	93.2	Very high	3 Å²	3	35 Å²	35	2%	0.02	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	133.4	175.3	179.1	0	0	0	0	109.5	A246 F247 C313 E314	A246-C308 CarbonylContact C-O 3.56Å; A246-C308 WeakPolarHBondContact CA-O 3.1Å; A246-C308 WeakPolarHBondContact CB-O 3.14Å; F247-C308 HydrophobicContact CD1-CB 4.06Å; F247-C308 HydrophobicContact CD2-CB 4.38Å; F247-C308 HydrophobicContact CE1-CB 3.53Å; F247-C308 HydrophobicContact CE2-CB 3.86Å; F247-C308 HydrophobicContact CG-CB 4.49Å; F247-C308 HydrophobicContact CZ-CB 3.41Å; F247-C308 VanDerWaalsContact CZ-CB 3.41Å; F247-C308 PolarHBondContact N-O 2.85Å; F247-C308 PolarHBondContact O-N 3.43Å; C308-C313 WeakPolarHBondContact CA-O 3.35Å; C308-E314 HydrophobicContact CB-CG 4.46Å
309	H	94.8	Very high	93.2	Very high	3 Å²	3	31.5 Å²	31.5	1%	0.014	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	161.9	174	71.7	123.5	0	0	0	110.8	C217 D220 A246 Y307 G311 C313 H315	C217-H309 VanDerWaalsContact CB-CE1 3.45Å; C217-H309 WeakPolarHBondContact CB-CE1 3.4Å; C217-H309 WeakPolarHBondContact CB-NE2 3.43Å; C217-H309 PolarHBondContact SG-NE2 3.31Å; D220-H309 VanDerWaalsContact CG-CE1 3.4Å; D220-H309 IonicContact OD1-CE1 3.5Å; D220-H309 PolarHBondContact OD1-CE1 3.19Å; D220-H309 IonicContact OD1-ND1 2.82Å; D220-H309 PolarHBondContact OD1-ND1 3.37Å; D220-H309 IonicContact OD2-CE1 3.68Å; D220-H309 IonicContact OD2-ND1 3.62Å; A246-H309 HydrophobicContact CB-CB 3.81Å; Y307-H309 HydrophobicContact CE1-CB 4.07Å; Y307-H309 AromaticContact CE1-CD2 3.61Å; Y307-H309 AromaticContact CE1-CG 3.89Å; H309-G311 PolarHBondContact O-N 3.09Å; H309-C313 PolarHBondContact CD2-O 2.87Å; H309-C313 VanDerWaalsContact CD2-O 3.26Å; H309-C313 PolarHBondContact N-O 3.44Å; H309-C313 VanDerWaalsContact N-O 3.08Å; H309-C313 WeakPolarHBondContact NE2-CB 3.41Å; H309-C313 PolarHBondContact NE2-SG 3.06Å; H309-C313 VanDerWaalsContact O-CB 3.32Å; H309-C313 WeakPolarHBondContact O-CB 3.4Å; H309-C313 PolarHBondContact O-N 3.36Å; H309-C313 VanDerWaalsContact O-N 3.08Å; H309-H315 AromaticContact CD2-CD2 3.87Å; H309-H315 AromaticContact CD2-NE2 3.85Å; H309-H315 AromaticContact NE2-CD2 3.84Å; H309-H315 AromaticContact NE2-NE2 3.31Å; H309-H315 PolarHBondContact NE2-NE2 3Å
310	Q	91	Very high	93.2	Very high	39 Å²	39	34.7 Å²	34.7	18%	0.182	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	-1.3	-177.1	-48.8	-174.4	10	0	0	116	S219 D220 S245	S219-Q310 PolarHBondContact O-NE2 3.37Å; S219-Q310 PolarHBondContact O-OE1 3.41Å; D220-Q310 PolarHBondContact OD1-NE2 2.87Å; S245-Q310 PolarHBondContact O-N 2.99Å; S245-Q310 VanDerWaalsContact O-N 3.13Å
311	G	88.1	Confident	93.3	Very high	42 Å²	42	36 Å²	36	43%	0.433	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	110	-31	175.2	0	0	0	0	0	114	H309	H309-G311 PolarHBondContact O-N 3.09Å
312	D	88.4	Confident	93.4	Very high	119 Å²	119	33.7 Å²	33.7	64%	0.636	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-142.1	-2.5	-174.9	65.2	-14.7	0	0	0	114.2	E314	D312-E314 PolarHBondContact O-N 3.09Å; D312-E314 VanDerWaalsContact O-N 3.14Å
313	C	91.9	Very high	93.7	Very high	2 Å²	2	36 Å²	36	1%	0.014	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	91.5	176.4	-166.4	0	0	0	0	110.1	S219 C308 H309	S219-C313 PolarHBondContact OG-SG 3.28Å; C308-C313 WeakPolarHBondContact CA-O 3.35Å; H309-C313 PolarHBondContact CD2-O 2.87Å; H309-C313 VanDerWaalsContact CD2-O 3.26Å; H309-C313 PolarHBondContact N-O 3.44Å; H309-C313 VanDerWaalsContact N-O 3.08Å; H309-C313 WeakPolarHBondContact NE2-CB 3.41Å; H309-C313 PolarHBondContact NE2-SG 3.06Å; H309-C313 VanDerWaalsContact O-CB 3.32Å; H309-C313 WeakPolarHBondContact O-CB 3.4Å; H309-C313 PolarHBondContact O-N 3.36Å; H309-C313 VanDerWaalsContact O-N 3.08Å
314	E	93.8	Very high	93.9	Very high	76 Å²	76	34.2 Å²	34.2	36%	0.355	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	129.2	-176.6	-64.4	177.9	168.8	0	0	112	P185 V186 L306 Y307 C308 D312	P185-E314 CarbonylContact C-O 3.5Å; P185-E314 WeakPolarHBondContact CA-O 3.22Å; V186-E314 HydrophobicContact CB-CB 4.18Å; V186-E314 HydrophobicContact CG2-CB 3.89Å; V186-E314 WeakPolarHBondContact CG2-O 3.43Å; V186-E314 PolarHBondContact N-O 3.46Å; L306-E314 HydrophobicContact CD1-CB 3.81Å; L306-E314 HydrophobicContact CD1-CG 4.12Å; Y307-E314 CarbonylContact O-C 3.55Å; C308-E314 HydrophobicContact CB-CG 4.46Å; D312-E314 PolarHBondContact O-N 3.09Å; D312-E314 VanDerWaalsContact O-N 3.14Å
315	H	93.7	Very high	94	Very high	1 Å²	1	31 Å²	31	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	135.4	175.2	-65.8	-102	0	0	0	110.4	I182 L183 P185 C217 Y307 H309	I182-H315 HydrophobicContact CG2-CB 4.19Å; L183-H315 PolarHBondContact O-ND1 3.44Å; P185-H315 VanDerWaalsContact CD-CE1 3.46Å; P185-H315 WeakPolarHBondContact CD-CE1 3.47Å; P185-H315 WeakPolarHBondContact CG-CE1 3.24Å; C217-H315 VanDerWaalsContact SG-CE1 3.53Å; C217-H315 PolarHBondContact SG-NE2 3.2Å; Y307-H315 HydrophobicContact CD1-CB 4.17Å; Y307-H315 AromaticContact CD1-CD2 3.85Å; Y307-H315 PolarHBondContact N-O 3.47Å; Y307-H315 PolarHBondContact O-N 2.83Å; H309-H315 AromaticContact CD2-CD2 3.87Å; H309-H315 AromaticContact CD2-NE2 3.85Å; H309-H315 AromaticContact NE2-CD2 3.84Å; H309-H315 AromaticContact NE2-NE2 3.31Å; H309-H315 PolarHBondContact NE2-NE2 3Å
316	V	93.9	Very high	93.8	Very high	37 Å²	37	35 Å²	35	22%	0.224	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	128.9	166.1	179.6	0	0	0	0	108.6	L183 P304 Y305 V318	L183-V316 HydrophobicContact CB-CB 4.19Å; L183-V316 HydrophobicContact CD2-CB 4.29Å; L183-V316 HydrophobicContact CD2-CG1 4.46Å; L183-V316 PolarHBondContact N-O 2.82Å; P304-V316 HydrophobicContact CB-CG1 3.58Å; Y305-V316 CarbonylContact O-C 3.58Å; Y305-V316 WeakPolarHBondContact O-CA 3.27Å; V316-V318 HydrophobicContact CG1-CG2 3.9Å
317	V	95.5	Very high	93.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	126.9	176	-178.5	0	0	0	0	108.3	V180 N181 I182 F248 Y305	V180-V317 HydrophobicContact CG1-CG1 3.49Å; V180-V317 VanDerWaalsContact CG1-CG1 3.49Å; N181-V317 CarbonylContact O-C 3.54Å; N181-V317 WeakPolarHBondContact O-CA 3.5Å; I182-V317 HydrophobicContact CG1-CG2 4.35Å; F248-V317 HydrophobicContact CE1-CG2 4.32Å; Y305-V317 WeakPolarHBondContact CA-O 3.37Å; Y305-V317 WeakPolarHBondContact CB-O 3.47Å; Y305-V317 PolarHBondContact N-O 3.03Å; Y305-V317 PolarHBondContact O-N 3.32Å
318	V	94.3	Very high	93.2	Very high	22 Å²	22	39 Å²	39	13%	0.133	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	122.8	-179.1	-172.2	0	0	0	0	108.8	N181 L183 V316 T320	N181-V318 HydrophobicContact CB-CB 4.34Å; N181-V318 PolarHBondContact N-O 3.26Å; N181-V318 PolarHBondContact O-N 3.25Å; L183-V318 HydrophobicContact CD1-CG2 4.16Å; V316-V318 HydrophobicContact CG1-CG2 3.9Å; V318-T320 HydrophobicContact CB-CG2 4.5Å; V318-T320 HydrophobicContact CG1-CG2 3.87Å
319	I	95.9	Very high	93	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	108.6	170.5	-60.6	169.3	0	0	0	106.9	L178 S179 V180 F250 I299 L301 G302 I322	L178-I319 HydrophobicContact CB-CG2 4.35Å; L178-I319 HydrophobicContact CD2-CD1 4.36Å; L178-I319 HydrophobicContact CD2-CG2 4.21Å; S179-I319 WeakPolarHBondContact O-CA 3.46Å; V180-I319 HydrophobicContact CG2-CG1 4.35Å; F250-I319 HydrophobicContact CE1-CD1 4.19Å; I299-I319 HydrophobicContact CB-CD1 4.48Å; I299-I319 HydrophobicContact CD1-CB 3.97Å; I299-I319 HydrophobicContact CD1-CD1 3.56Å; I299-I319 HydrophobicContact CD1-CG1 4.36Å; I299-I319 HydrophobicContact CD1-CG2 3.73Å; I299-I319 HydrophobicContact CG2-CD1 3.98Å; L301-I319 WeakPolarHBondContact CA-O 3.16Å; L301-I319 HydrophobicContact CD2-CG2 4.07Å; G302-I319 PolarHBondContact N-O 2.89Å; I319-I322 HydrophobicContact CG2-CD1 4.34Å; I319-I322 HydrophobicContact CG2-CG1 4.05Å
320	T	93.7	Very high	93	Very high	66 Å²	66	39.8 Å²	39.8	41%	0.405	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-25.1	-173.3	49.9	0	0	0	0	113.7	S179 N181 V318	S179-T320 PolarHBondContact O-N 3.29Å; S179-T320 PolarHBondContact O-OG1 3.38Å; N181-T320 WeakPolarHBondContact ND2-CG2 3.49Å; V318-T320 HydrophobicContact CB-CG2 4.5Å; V318-T320 HydrophobicContact CG1-CG2 3.87Å
321	D	94.8	Very high	93.2	Very high	66 Å²	66	38.1 Å²	38.1	35%	0.353	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	148	-175.9	-176	56.7	0	0	0	111	L178 S179	L178-D321 WeakPolarHBondContact CA-O 3.42Å; S179-D321 PolarHBondContact N-O 3.02Å
322	I	95.1	Very high	93.5	Very high	11 Å²	11	37.2 Å²	37.2	6%	0.056	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	127.2	170.4	-60.3	-178.7	0	0	0	107.8	F38 V40 F43 L176 I177 L178 I299 L301 I319	F38-I322 HydrophobicContact CE2-CD1 4.08Å; F38-I322 HydrophobicContact CZ-CD1 4.03Å; V40-I322 HydrophobicContact CG1-CD1 4.35Å; V40-I322 HydrophobicContact CG2-CD1 4.14Å; F43-I322 HydrophobicContact CD1-CG2 3.98Å; F43-I322 HydrophobicContact CE1-CB 4.23Å; F43-I322 HydrophobicContact CE1-CG2 3.65Å; L176-I322 HydrophobicContact CD1-CG2 4.35Å; L176-I322 HydrophobicContact CD2-CG2 4.05Å; I177-I322 WeakPolarHBondContact O-CA 3.43Å; L178-I322 HydrophobicContact CB-CG1 4.31Å; L178-I322 HydrophobicContact CD2-CD1 3.71Å; L178-I322 HydrophobicContact CD2-CG1 3.91Å; L178-I322 HydrophobicContact CG-CD1 4.11Å; L178-I322 HydrophobicContact CG-CG1 3.81Å; L178-I322 HydrophobicContact CG-CG2 4.36Å; I299-I322 HydrophobicContact CD1-CD1 3.58Å; I299-I322 HydrophobicContact CG1-CD1 4.5Å; L301-I322 HydrophobicContact CD2-CD1 4.02Å; L301-I322 HydrophobicContact CD2-CG1 3.81Å; I319-I322 HydrophobicContact CG2-CD1 4.34Å; I319-I322 HydrophobicContact CG2-CG1 4.05Å
323	R	94.8	Very high	93.8	Very high	76 Å²	76	36.9 Å²	36.9	29%	0.287	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	169.1	177.6	63.6	177.9	-175.3	80.4	-2.5	111.6	L176 I177 D329	L176-R323 CarbonylContact C-O 3.44Å; L176-R323 WeakPolarHBondContact CA-O 3.45Å; I177-R323 HydrophobicContact CB-CG 4.48Å; I177-R323 PolarHBondContact N-O 2.98Å; I177-R323 PolarHBondContact O-N 3.42Å; R323-D329 IonicContact CZ-OD1 3.58Å; R323-D329 IonicContact CZ-OD2 3.62Å; R323-D329 IonicContact NH1-OD1 3.73Å; R323-D329 IonicContact NH1-OD2 3.46Å; R323-D329 PolarHBondContact NH1-OD2 2.81Å; R323-D329 IonicContact NH2-OD1 3.63Å; R323-D329 PolarHBondContact NH2-OD1 3.24Å; R323-D329 IonicContact NH2-OD2 2.82Å; R323-D329 PolarHBondContact NH2-OD2 3.43Å
324	L	95.1	Very high	93.9	Very high	33 Å²	33	40.9 Å²	40.9	17%	0.173	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	150.5	168.1	-65.3	163.8	0	0	0	109.9	W47 R48 L51 L56 G174 E175 L176	W47-L324 HydrophobicContact CB-CD1 4.16Å; R48-L324 HydrophobicContact CG-CD2 4.33Å; L51-L324 HydrophobicContact CD1-CD1 3.36Å; L56-L324 HydrophobicContact CD2-CD1 3.76Å; G174-L324 VanDerWaalsContact O-CD2 3.32Å; G174-L324 WeakPolarHBondContact O-CD2 3.48Å; E175-L324 WeakPolarHBondContact O-CA 3.4Å; L176-L324 HydrophobicContact CD2-CD2 3.83Å; L176-L324 HydrophobicContact CD2-CG 4.4Å
325	V	95.2	Very high	93.9	Very high	9 Å²	9	40.2 Å²	40.2	6%	0.055	20%	0.204	C	C	.	.			trans	-59.6	141.8	170.5	60.2	0	0	0	0	110.8	L58 I171 E175 I177 D329 L331	L58-V325 HydrophobicContact CD1-CG1 4.2Å; L58-V325 HydrophobicContact CD2-CB 4.48Å; L58-V325 HydrophobicContact CD2-CG1 4.01Å; L58-V325 HydrophobicContact CD2-CG2 3.97Å; I171-V325 HydrophobicContact CG2-CB 4.28Å; I171-V325 HydrophobicContact CG2-CG1 4.12Å; I171-V325 HydrophobicContact CG2-CG2 4.02Å; E175-V325 HydrophobicContact CB-CB 4.5Å; E175-V325 HydrophobicContact CB-CG1 3.93Å; E175-V325 PolarHBondContact O-N 3.39Å; I177-V325 HydrophobicContact CD1-CB 3.98Å; I177-V325 HydrophobicContact CD1-CG2 4.01Å; I177-V325 HydrophobicContact CG1-CB 4.31Å; V325-D329 HydrophobicContact CG2-CB 4.17Å; V325-L331 HydrophobicContact CG2-CD2 3.73Å
326	H	91.9	Very high	94	Very high	90 Å²	90	40.8 Å²	40.8	42%	0.417	21%	0.207	S	C	.	.			trans	-119.9	157.5	178.5	-173.6	-106.4	0	0	0	109.9	D328 D329	H326-D328 IonicContact CE1-OD2 3.75Å; H326-D328 PolarHBondContact CE1-OD2 2.68Å; H326-D328 PolarHBondContact ND1-N 3.45Å; H326-D328 IonicContact ND1-OD2 3.04Å; H326-D328 PolarHBondContact ND1-OD2 3.08Å; H326-D328 PolarHBondContact O-N 3.03Å; H326-D328 VanDerWaalsContact O-N 3.13Å; H326-D329 PolarHBondContact N-OD2 3.21Å; H326-D329 VanDerWaalsContact O-CB 3.27Å; H326-D329 WeakPolarHBondContact O-CB 3.49Å; H326-D329 PolarHBondContact O-N 2.88Å
327	H	89.7	Confident	94.1	Very high	33 Å²	33	39.9 Å²	39.9	15%	0.153	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-21.6	-178	65.3	28.8	0	0	0	114.4	L58 P61 D329	L58-H327 WeakPolarHBondContact O-CB 3.34Å; P61-H327 WeakPolarHBondContact CD-CD2 3.18Å; P61-H327 WeakPolarHBondContact CD-NE2 3.44Å; H327-D329 VanDerWaalsContact C-N 3.29Å
328	D	89.4	Confident	94.1	Very high	90 Å²	90	41 Å²	41	48%	0.481	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-9	179	-67	-27	0	0	0	112.4	G161 H326	G161-D328 PolarHBondContact N-O 3.18Å; H326-D328 IonicContact CE1-OD2 3.75Å; H326-D328 PolarHBondContact CE1-OD2 2.68Å; H326-D328 PolarHBondContact ND1-N 3.45Å; H326-D328 IonicContact ND1-OD2 3.04Å; H326-D328 PolarHBondContact ND1-OD2 3.08Å; H326-D328 PolarHBondContact O-N 3.03Å; H326-D328 VanDerWaalsContact O-N 3.13Å
329	D	92.3	Very high	94	Very high	19 Å²	19	42.4 Å²	42.4	10%	0.102	21%	0.214	C	C	.	.	S	Bend	trans	-71.1	168	176.1	-67.9	-41.5	0	0	0	111.8	G161 I177 R323 V325 H326 H327 L331	G161-D329 WeakPolarHBondContact CA-O 3.38Å; G161-D329 PolarHBondContact N-O 3.22Å; I177-D329 HydrophobicContact CD1-CB 4.23Å; I177-D329 WeakPolarHBondContact CD1-OD2 3.44Å; R323-D329 IonicContact CZ-OD1 3.58Å; R323-D329 IonicContact CZ-OD2 3.62Å; R323-D329 IonicContact NH1-OD1 3.73Å; R323-D329 IonicContact NH1-OD2 3.46Å; R323-D329 PolarHBondContact NH1-OD2 2.81Å; R323-D329 IonicContact NH2-OD1 3.63Å; R323-D329 PolarHBondContact NH2-OD1 3.24Å; R323-D329 IonicContact NH2-OD2 2.82Å; R323-D329 PolarHBondContact NH2-OD2 3.43Å; V325-D329 HydrophobicContact CG2-CB 4.17Å; H326-D329 PolarHBondContact N-OD2 3.21Å; H326-D329 VanDerWaalsContact O-CB 3.27Å; H326-D329 WeakPolarHBondContact O-CB 3.49Å; H326-D329 PolarHBondContact O-N 2.88Å; H327-D329 VanDerWaalsContact C-N 3.29Å; D329-L331 HydrophobicContact CB-CD2 4.41Å; D329-L331 PolarHBondContact O-N 3.4Å; D329-L331 VanDerWaalsContact O-N 3.12Å
330	C	93.6	Very high	93.6	Very high	4 Å²	4	44.2 Å²	44.2	3%	0.027	22%	0.223	C	C	.	.			trans	-63.5	110.7	161	-174.5	0	0	0	0	108.4	A159 I171 D332 L335 Y336 L338	A159-C330 HydrophobicContact CB-CB 4.09Å; A159-C330 VanDerWaalsContact O-CA 3.28Å; A159-C330 WeakPolarHBondContact O-CA 3.46Å; A159-C330 WeakPolarHBondContact O-CB 3.34Å; A159-C330 PolarHBondContact O-N 2.93Å; I171-C330 VanDerWaalsContact CD1-O 3.3Å; I171-C330 WeakPolarHBondContact CD1-O 3.39Å; C330-D332 VanDerWaalsContact C-N 3.34Å; C330-L335 VanDerWaalsContact SG-CD1 3.57Å; C330-Y336 HydrophobicContact CB-CE2 3.86Å; C330-Y336 VanDerWaalsContact O-CE2 3.27Å; C330-Y336 WeakPolarHBondContact O-CE2 3.29Å; C330-Y336 PolarHBondContact O-OH 3Å; C330-Y336 VanDerWaalsContact O-OH 3.06Å; C330-L338 HydrophobicContact CB-CD2 4.03Å
331	L	95.3	Very high	93.3	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.021	22%	0.223	C	C	.	.			trans	-90.5	-1.5	177	-55.8	-174.1	0	0	0	112.6	L58 K162 K163 L170 I171 V325 D329	L58-L331 HydrophobicContact CB-CD1 4.3Å; L58-L331 HydrophobicContact CD1-CD2 4.17Å; L58-L331 HydrophobicContact CD2-CD2 4.04Å; K162-L331 PolarHBondContact O-N 2.79Å; K163-L331 HydrophobicContact CG-CB 4.48Å; K163-L331 HydrophobicContact CG-CD1 4.34Å; L170-L331 WeakPolarHBondContact CA-O 3.48Å; L170-L331 HydrophobicContact CD1-CB 3.81Å; L170-L331 HydrophobicContact CD1-CD1 4.47Å; I171-L331 PolarHBondContact N-O 2.72Å; V325-L331 HydrophobicContact CG2-CD2 3.73Å; D329-L331 HydrophobicContact CB-CD2 4.41Å; D329-L331 PolarHBondContact O-N 3.4Å; D329-L331 VanDerWaalsContact O-N 3.12Å
332	D	95.2	Very high	92.9	Very high	23 Å²	23	43.5 Å²	43.5	12%	0.123	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-85	108.6	172.8	-172.4	-20.5	0	0	0	110.5	K162 P164 C330 T334 L335 Y336	K162-D332 PolarHBondContact O-N 2.84Å; P164-D332 HydrophobicContact CB-CB 3.93Å; P164-D332 HydrophobicContact CG-CB 4.47Å; C330-D332 VanDerWaalsContact C-N 3.34Å; D332-T334 PolarHBondContact O-N 3.36Å; D332-T334 WeakPolarHBondContact OD1-CB 3.32Å; D332-T334 PolarHBondContact OD1-N 2.89Å; D332-T334 PolarHBondContact OD1-OG1 3.3Å; D332-T334 PolarHBondContact OD2-OG1 2.79Å; D332-L335 HydrophobicContact CB-CD1 4.11Å; D332-L335 HydrophobicContact CB-CG 4.21Å; D332-L335 PolarHBondContact O-N 2.86Å; D332-Y336 WeakPolarHBondContact O-CD2 3.49Å
333	R	95	Very high	92.2	Very high	112 Å²	112	44.7 Å²	44.7	42%	0.423	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-61.6	-28.3	179.4	-173.3	176.8	66.5	90.3	10.2	112.8	D169 I171 L203 L335 Y336	D169-R333 WeakPolarHBondContact O-CB 3.31Å; D169-R333 PolarHBondContact O-N 3Å; D169-R333 IonicContact OD1-NH2 3.1Å; D169-R333 PolarHBondContact OD1-NH2 3.31Å; D169-R333 VanDerWaalsContact OD1-NH2 3.1Å; I171-R333 HydrophobicContact CG1-CB 4.01Å; L203-R333 HydrophobicContact CD1-CG 3.82Å; R333-L335 PolarHBondContact O-N 3.45Å; R333-Y336 PolarHBondContact O-N 3.32Å
334	T	94.1	Very high	91.4	Very high	85 Å²	85	44 Å²	44	52%	0.521	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-71	-17.7	-176.5	69.8	0	0	0	0	113.4	D169 D332 Y336	D169-T334 HydrophobicContact CB-CG2 3.87Å; D332-T334 PolarHBondContact O-N 3.36Å; D332-T334 WeakPolarHBondContact OD1-CB 3.32Å; D332-T334 PolarHBondContact OD1-N 2.89Å; D332-T334 PolarHBondContact OD1-OG1 3.3Å; D332-T334 PolarHBondContact OD2-OG1 2.79Å; T334-Y336 VanDerWaalsContact C-N 3.34Å
335	L	93.9	Very high	90.6	Very high	63 Å²	63	43.9 Å²	43.9	33%	0.33	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-84.8	-9.8	177.1	-62.1	-178.4	0	0	0	113	K162 C330 D332 R333 P337 L338	K162-L335 HydrophobicContact CB-CD1 4.48Å; K162-L335 HydrophobicContact CD-CD1 3.65Å; C330-L335 VanDerWaalsContact SG-CD1 3.57Å; D332-L335 HydrophobicContact CB-CD1 4.11Å; D332-L335 HydrophobicContact CB-CG 4.21Å; D332-L335 PolarHBondContact O-N 2.86Å; R333-L335 PolarHBondContact O-N 3.45Å; L335-P337 CarbonylContact O-C 3.46Å; L335-L338 HydrophobicContact CB-CD1 4.44Å; L335-L338 WeakPolarHBondContact O-CA 3.47Å
336	Y	95.4	Very high	89.8	Confident	13 Å²	13	53.6 Å²	53.6	5%	0.051	25%	0.249	C	C	.	.			trans	-88.5	146.2	175.6	-72.3	-101.9	0	0	0	111.1	I171 L201 L203 Q206 C330 D332 R333 T334 L338	I171-Y336 HydrophobicContact CD1-CD2 3.97Å; I171-Y336 HydrophobicContact CD1-CE2 3.48Å; I171-Y336 VanDerWaalsContact CD1-CE2 3.48Å; L201-Y336 HydrophobicContact CB-CD1 4.39Å; L201-Y336 HydrophobicContact CB-CE1 3.9Å; L201-Y336 WeakPolarHBondContact O-CD1 3.28Å; L203-Y336 HydrophobicContact CD1-CD2 4.32Å; L203-Y336 HydrophobicContact CD1-CG 4.11Å; L203-Y336 HydrophobicContact CD2-CD1 3.56Å; L203-Y336 HydrophobicContact CD2-CD2 4.24Å; L203-Y336 HydrophobicContact CD2-CE1 3.53Å; L203-Y336 HydrophobicContact CD2-CE2 4.23Å; L203-Y336 HydrophobicContact CD2-CG 3.92Å; L203-Y336 HydrophobicContact CG-CD1 3.72Å; L203-Y336 HydrophobicContact CG-CD2 4.35Å; L203-Y336 HydrophobicContact CG-CE1 4.24Å; L203-Y336 HydrophobicContact CG-CG 3.79Å; Q206-Y336 PolarHBondContact NE2-O 2.73Å; C330-Y336 HydrophobicContact CB-CE2 3.86Å; C330-Y336 VanDerWaalsContact O-CE2 3.27Å; C330-Y336 WeakPolarHBondContact O-CE2 3.29Å; C330-Y336 PolarHBondContact O-OH 3Å; C330-Y336 VanDerWaalsContact O-OH 3.06Å; D332-Y336 WeakPolarHBondContact O-CD2 3.49Å; R333-Y336 PolarHBondContact O-N 3.32Å; T334-Y336 VanDerWaalsContact C-N 3.34Å; Y336-L338 HydrophobicContact CD1-CB 4.06Å; Y336-L338 HydrophobicContact CE1-CB 4.17Å; Y336-L338 HydrophobicContact CG-CB 4.33Å
337	P	96.7	Very high	89.6	Confident	18 Å²	18	52 Å²	52	12%	0.117	25%	0.246	C	C	.	.	S	Bend	cis	-60.1	125.8	-6.2	-28.3	39	0	0	0	113.3	L201 V202 E210 S214 L335	L201-P337 CarbonylContact O-C 3.52Å; L201-P337 WeakPolarHBondContact O-CA 3.19Å; V202-P337 HydrophobicContact CG1-CB 3.96Å; V202-P337 HydrophobicContact CG1-CG 4.2Å; E210-P337 HydrophobicContact CB-CG 4.29Å; S214-P337 WeakPolarHBondContact OG-CD 3.4Å; S214-P337 WeakPolarHBondContact OG-CG 3.33Å; L335-P337 CarbonylContact O-C 3.46Å
338	L	93.9	Very high	89.6	Confident	22 Å²	22	55.7 Å²	55.7	12%	0.115	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	113.3	-171.4	178.5	67.6	0	0	0	109.5	A159 M200 L201 C330 L335 Y336 I340	A159-L338 HydrophobicContact CB-CD1 3.57Å; A159-L338 HydrophobicContact CB-CD2 3.48Å; A159-L338 VanDerWaalsContact CB-CD2 3.48Å; A159-L338 HydrophobicContact CB-CG 4.09Å; M200-L338 CarbonylContact C-O 3.55Å; M200-L338 VanDerWaalsContact CA-O 3.24Å; M200-L338 WeakPolarHBondContact CA-O 3.35Å; L201-L338 HydrophobicContact CB-CB 4.27Å; L201-L338 HydrophobicContact CD1-CD2 4.32Å; L201-L338 PolarHBondContact N-O 3.25Å; L201-L338 PolarHBondContact O-N 3.47Å; C330-L338 HydrophobicContact CB-CD2 4.03Å; L335-L338 HydrophobicContact CB-CD1 4.44Å; L335-L338 WeakPolarHBondContact O-CA 3.47Å; Y336-L338 HydrophobicContact CD1-CB 4.06Å; Y336-L338 HydrophobicContact CE1-CB 4.17Å; Y336-L338 HydrophobicContact CG-CB 4.33Å; L338-I340 HydrophobicContact CD2-CG2 4.11Å; L338-I340 HydrophobicContact CG-CG2 4.06Å; L338-I340 PolarHBondContact O-N 2.82Å
339	L	92	Very high	89.8	Confident	53 Å²	53	56.9 Å²	56.9	28%	0.277	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	109.6	175.2	-179.1	67.9	0	0	0	110	M155 Q198 M200 K341 K342	M155-L339 WeakPolarHBondContact CG-O 3.49Å; M155-L339 HydrophobicContact SD-CD2 4.17Å; M155-L339 HydrophobicContact SD-CG 3.95Å; Q198-L339 HydrophobicContact CB-CD1 3.88Å; M200-L339 HydrophobicContact CE-CB 4.27Å; M200-L339 HydrophobicContact CE-CD1 3.83Å; M200-L339 HydrophobicContact CG-CD1 4.03Å; L339-K341 VanDerWaalsContact CD1-O 3.28Å; L339-K341 WeakPolarHBondContact CD1-O 3.35Å; L339-K342 HydrophobicContact CD1-CB 4.33Å; L339-K342 HydrophobicContact CD2-CB 4.26Å; L339-K342 HydrophobicContact CD2-CD 4.17Å
340	I	88.8	Confident	90	Very high	38 Å²	38	56 Å²	56	20%	0.195	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	-20.2	179.3	59.9	164	0	0	0	112.8	M155 E156 T199 L201 L338	M155-I340 WeakPolarHBondContact CE-O 3.48Å; E156-I340 WeakPolarHBondContact CG-O 3.31Å; T199-I340 HydrophobicContact CG2-CD1 3.76Å; T199-I340 HydrophobicContact CG2-CG1 3.81Å; T199-I340 WeakPolarHBondContact O-CG1 3.33Å; T199-I340 PolarHBondContact O-N 3.35Å; L201-I340 HydrophobicContact CD1-CD1 4.43Å; L201-I340 HydrophobicContact CD1-CG2 3.87Å; L201-I340 HydrophobicContact CD2-CD1 3.82Å; L201-I340 HydrophobicContact CG-CD1 3.94Å; L201-I340 HydrophobicContact CG-CG1 4.32Å; L201-I340 HydrophobicContact CG-CG2 3.86Å; L338-I340 HydrophobicContact CD2-CG2 4.11Å; L338-I340 HydrophobicContact CG-CG2 4.06Å; L338-I340 PolarHBondContact O-N 2.82Å
341	K	87.3	Confident	90	Very high	95 Å²	95	58.6 Å²	58.6	41%	0.413	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	136.8	176.8	-164.2	173.8	-176.5	164.9	0	110.5	Q198 T199 L339	Q198-K341 CarbonylContact C-O 3.47Å; Q198-K341 WeakPolarHBondContact CA-O 3.35Å; T199-K341 PolarHBondContact N-O 2.9Å; T199-K341 PolarHBondContact O-N 3.33Å; T199-K341 VanDerWaalsContact O-N 3.15Å; L339-K341 VanDerWaalsContact CD1-O 3.28Å; L339-K341 WeakPolarHBondContact CD1-O 3.35Å
342	K	85.5	Confident	90	Very high	23 Å²	23	62.4 Å²	62.4	10%	0.1	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	139.2	169.5	-169.8	173.4	-176.6	172.4	0	109.5	Y197 C216 L339 W344 F406	Y197-K342 CarbonylContact O-C 3.57Å; Y197-K342 WeakPolarHBondContact O-CA 3.42Å; Y197-K342 WeakPolarHBondContact OH-CE 3.41Å; C216-K342 PolarHBondContact SG-NZ 2.92Å; L339-K342 HydrophobicContact CD1-CB 4.33Å; L339-K342 HydrophobicContact CD2-CB 4.26Å; L339-K342 HydrophobicContact CD2-CD 4.17Å; K342-W344 PolarHBondContact O-N 3.36Å; K342-F406 WeakPolarHBondContact CE-O 3.2Å; K342-F406 PolarHBondContact NZ-O 3.27Å
343	H	80.6	Confident	90	Very high	36 Å²	36	63.4 Å²	63.4	17%	0.167	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-72.4	124.3	175.6	-174.4	-112	0	0	0	110.9	Y184 K195 Y197 L345	Y184-H343 HydrophobicContact CE2-CB 4.46Å; Y184-H343 AromaticContact CZ-ND1 3.86Å; Y184-H343 WeakPolarHBondContact OH-CB 3.47Å; Y184-H343 VanDerWaalsContact OH-CG 3.23Å; Y184-H343 PolarHBondContact OH-ND1 2.79Å; K195-H343 WeakPolarHBondContact CE-CD2 3.29Å; K195-H343 PolarHBondContact NZ-CD2 2.88Å; K195-H343 PolarHBondContact NZ-NE2 2.89Å; Y197-H343 HydrophobicContact CD2-CB 4.17Å; Y197-H343 PolarHBondContact O-N 2.96Å; H343-L345 PolarHBondContact O-N 2.94Å
344	W	78.3	Confident	89.9	Confident	60 Å²	60	63.5 Å²	63.5	23%	0.227	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-67.4	119.9	174.5	-168.8	-77.7	0	0	0	111.5	Q148 F151 K342 N407	Q148-W344 HydrophobicContact CG-CB 3.98Å; Q148-W344 HydrophobicContact CG-CG 4.1Å; F151-W344 HydrophobicContact CB-CZ3 4.35Å; F151-W344 HydrophobicContact CD1-CZ3 4.42Å; F151-W344 AromaticContact CD2-CE3 3.89Å; F151-W344 HydrophobicContact CD2-CE3 3.89Å; F151-W344 AromaticContact CD2-CH2 3.72Å; F151-W344 HydrophobicContact CD2-CH2 3.72Å; F151-W344 AromaticContact CD2-CZ3 3.27Å; F151-W344 HydrophobicContact CD2-CZ3 3.27Å; F151-W344 HydrophobicContact CE2-CE3 4.36Å; F151-W344 AromaticContact CE2-CH2 3.34Å; F151-W344 HydrophobicContact CE2-CH2 3.34Å; F151-W344 HydrophobicContact CE2-CZ2 4.2Å; F151-W344 AromaticContact CE2-CZ3 3.44Å; F151-W344 HydrophobicContact CE2-CZ3 3.44Å; F151-W344 VanDerWaalsContact CE2-CZ3 3.44Å; F151-W344 HydrophobicContact CG-CE3 4.46Å; F151-W344 AromaticContact CG-CZ3 3.81Å; F151-W344 HydrophobicContact CG-CZ3 3.81Å; F151-W344 AromaticContact CZ-CH2 3.91Å; F151-W344 HydrophobicContact CZ-CH2 3.91Å; F151-W344 HydrophobicContact CZ-CZ3 4.13Å; K342-W344 PolarHBondContact O-N 3.36Å; W344-N407 WeakPolarHBondContact CA-OD1 3.4Å; W344-N407 HydrophobicContact CD2-CB 4.05Å; W344-N407 HydrophobicContact CE3-CB 3.8Å; W344-N407 HydrophobicContact CH2-CB 3.87Å; W344-N407 HydrophobicContact CZ2-CB 4.11Å; W344-N407 HydrophobicContact CZ3-CB 3.7Å; W344-N407 PolarHBondContact NE1-ND2 3.16Å
345	L	78.3	Confident	89.9	Confident	31 Å²	31	64.9 Å²	64.9	16%	0.162	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-99	135.3	175.3	-65.9	177	0	0	0	110.3	Y184 Y197 V218 H343 T347 P403 N407	Y184-L345 WeakPolarHBondContact OH-CD2 3.41Å; Y197-L345 HydrophobicContact CE2-CD1 3.94Å; Y197-L345 HydrophobicContact CE2-CG 4.5Å; V218-L345 HydrophobicContact CG2-CD1 4.12Å; H343-L345 PolarHBondContact O-N 2.94Å; L345-T347 PolarHBondContact O-N 3.18Å; L345-P403 HydrophobicContact CB-CB 4.19Å; L345-P403 HydrophobicContact CD1-CB 3.32Å; L345-P403 HydrophobicContact CG-CB 4.36Å; L345-N407 PolarHBondContact N-OD1 3.32Å; L345-N407 PolarHBondContact O-ND2 3.25Å
346	W	79.1	Confident	89.9	Confident	213 Å²	213	68.3 Å²	68.3	81%	0.807	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-72.6	124.8	178.5	-72.6	80.6	0	0	0	110.3	R348	W346-R348 PolarHBondContact O-N 2.99Å
347	T	86.9	Confident	89.8	Confident	58 Å²	58	70.5 Å²	70.5	36%	0.356	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-61.2	125.2	176.2	-59	0	0	0	0	111.4	L345 K349 T357 D402	L345-T347 PolarHBondContact O-N 3.18Å; T347-K349 PolarHBondContact O-N 3.38Å; T347-T357 HydrophobicContact CG2-CG2 3.66Å; T347-T357 WeakPolarHBondContact CG2-OG1 3.39Å; T347-D402 WeakPolarHBondContact CA-OD1 3.42Å; T347-D402 WeakPolarHBondContact CA-OD2 3.3Å; T347-D402 WeakPolarHBondContact CG2-OD2 3.36Å; T347-D402 PolarHBondContact OG1-OD2 2.65Å
348	R	90.1	Very high	89.7	Confident	109 Å²	109	69.7 Å²	69.7	41%	0.411	32%	0.322	S	S	.	.			trans	-78.6	108.4	173.4	-166.7	69.9	170.8	175.1	2.6	109.3	W346 A358 F374 Y400 D402	W346-R348 PolarHBondContact O-N 2.99Å; R348-A358 HydrophobicContact CG-CB 4.48Å; R348-A358 WeakPolarHBondContact O-CB 3.29Å; R348-A358 PolarHBondContact O-N 2.68Å; R348-F374 HydrophobicContact CG-CB 4.16Å; R348-F374 HydrophobicContact CG-CD1 3.88Å; R348-F374 HydrophobicContact CG-CD2 4.25Å; R348-F374 HydrophobicContact CG-CE1 4.35Å; R348-F374 HydrophobicContact CG-CG 3.82Å; R348-F374 VanDerWaalsContact NE-CD2 3.27Å; R348-Y400 HydrophobicContact CB-CE1 3.88Å; R348-Y400 HydrophobicContact CG-CE1 4.25Å; R348-D402 WeakPolarHBondContact CB-OD1 3.45Å; R348-D402 PolarHBondContact N-OD1 2.82Å
349	K	93.7	Very high	89.7	Confident	116 Å²	116	76.4 Å²	76.4	50%	0.504	35%	0.346	S	S	.	.	B	Isolated β-bridge	trans	-83.7	153.1	175.2	-60.9	-168.1	-179.1	-174.7	0	111.5	T347 F351 K354 Y356	T347-K349 PolarHBondContact O-N 3.38Å; K349-F351 PolarHBondContact O-N 3.47Å; K349-K354 WeakPolarHBondContact CD-O 3.16Å; K349-Y356 WeakPolarHBondContact CA-O 3.3Å
350	C	95.9	Very high	89.9	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	34%	0.335	C	S	.	.			trans	-52	134.4	171.5	172.3	0	0	0	0	111.3	V352 C353 K354 Y356 F374 C376	C350-V352 VanDerWaalsContact C-N 3.33Å; C350-V352 PolarHBondContact O-N 3.34Å; C350-V352 PolarHBondContact SG-N 3.47Å; C350-V352 VanDerWaalsContact SG-N 3.38Å; C350-C353 VanDerWaalsContact CB-SG 3.54Å; C350-K354 WeakPolarHBondContact O-CA 3.44Å; C350-K354 PolarHBondContact O-N 3.46Å; C350-Y356 WeakPolarHBondContact CB-O 3.25Å; C350-Y356 PolarHBondContact N-O 2.95Å; C350-F374 CarbonylContact C-O 3.59Å; C350-F374 WeakPolarHBondContact CA-O 3.33Å; C350-C376 HydrophobicContact CB-CB 3.78Å; C350-C376 VanDerWaalsContact CB-N 3.27Å; C350-C376 PolarHBondContact SG-N 3.48Å
351	F	95.1	Very high	90.2	Very high	59 Å²	59	73.6 Å²	73.6	26%	0.259	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-36.1	-179.5	-168.3	-80.9	0	0	0	112.7	K349 K354 P369 E370 C373 F374	K349-F351 PolarHBondContact O-N 3.47Å; F351-K354 WeakPolarHBondContact O-CD 3.18Å; F351-K354 WeakPolarHBondContact O-CE 3.3Å; F351-K354 PolarHBondContact O-NZ 2.99Å; F351-P369 HydrophobicContact CD1-CG 3.47Å; F351-P369 VanDerWaalsContact CD1-CG 3.47Å; F351-P369 HydrophobicContact CE1-CB 4.09Å; F351-P369 HydrophobicContact CE1-CG 3.1Å; F351-P369 HydrophobicContact CE2-CG 4.35Å; F351-P369 HydrophobicContact CG-CG 4.28Å; F351-P369 HydrophobicContact CZ-CB 4.29Å; F351-P369 HydrophobicContact CZ-CG 3.59Å; F351-E370 HydrophobicContact CE2-CG 4.22Å; F351-E370 WeakPolarHBondContact CE2-OE1 3.44Å; F351-C373 VanDerWaalsContact CB-SG 3.57Å; F351-F374 WeakPolarHBondContact CB-O 3.36Å; F351-F374 PolarHBondContact N-O 3Å
352	V	94.6	Very high	90.6	Very high	83 Å²	83	69 Å²	69	50%	0.503	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-61.2	-176	179.5	0	0	0	0	111.3	C350 F375 C379	C350-V352 VanDerWaalsContact C-N 3.33Å; C350-V352 PolarHBondContact O-N 3.34Å; C350-V352 PolarHBondContact SG-N 3.47Å; C350-V352 VanDerWaalsContact SG-N 3.38Å; V352-F375 HydrophobicContact CG2-CD1 3.7Å; V352-F375 HydrophobicContact CG2-CE1 3.52Å; V352-C379 HydrophobicContact CB-CB 3.96Å; V352-C379 HydrophobicContact CG1-CB 4.33Å; V352-C379 HydrophobicContact CG2-CB 4.28Å
353	C	95.1	Very high	91.2	Very high	45 Å²	45	70.4 Å²	70.4	30%	0.304	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-18.3	-174.6	68.5	0	0	0	0	114	C350 M355	C350-C353 VanDerWaalsContact CB-SG 3.54Å; C353-M355 HydrophobicContact CB-CB 4.43Å; C353-M355 PolarHBondContact O-N 2.91Å
354	K	93.8	Very high	91.9	Very high	113 Å²	113	73.7 Å²	73.7	49%	0.491	34%	0.339	S	S	.	.	S	Bend	trans	52.6	14.3	-173.4	-52.5	-60.3	-168	-161.2	0	114.9	K349 C350 F351	K349-K354 WeakPolarHBondContact CD-O 3.16Å; C350-K354 WeakPolarHBondContact O-CA 3.44Å; C350-K354 PolarHBondContact O-N 3.46Å; F351-K354 WeakPolarHBondContact O-CD 3.18Å; F351-K354 WeakPolarHBondContact O-CE 3.3Å; F351-K354 PolarHBondContact O-NZ 2.99Å
355	M	92.9	Very high	92.7	Very high	115 Å²	115	71.4 Å²	71.4	57%	0.567	33%	0.331	S	S	*	.	S	Bend	trans	-112.2	-56.7	-171.5	-165.8	170.9	75.2	0	0	111.6	C353	C353-M355 HydrophobicContact CB-CB 4.43Å; C353-M355 PolarHBondContact O-N 2.91Å
356	Y	94.1	Very high	93.3	Very high	134 Å²	134	75.1 Å²	75.1	53%	0.525	36%	0.355	S	S	.	.	S	Bend	trans	-84.6	149.4	-178.8	-61.7	-69.2	0	0	0	112.3	K349 C350	K349-Y356 WeakPolarHBondContact CA-O 3.3Å; C350-Y356 WeakPolarHBondContact CB-O 3.25Å; C350-Y356 PolarHBondContact N-O 2.95Å
357	T	93.9	Very high	93.9	Very high	59 Å²	59	68.9 Å²	68.9	36%	0.362	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-59.8	140.6	170.9	-53.5	0	0	0	0	110.4	T347 D402	T347-T357 HydrophobicContact CG2-CG2 3.66Å; T347-T357 WeakPolarHBondContact CG2-OG1 3.39Å; T357-D402 HydrophobicContact CG2-CB 3.45Å; T357-D402 VanDerWaalsContact CG2-CB 3.45Å
358	A	94.8	Very high	94.2	Very high	2 Å²	2	67 Å²	67	2%	0.017	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-66.2	141.5	175.7	0	0	0	0	0	110.6	R348 F374 F375 Y400	R348-A358 HydrophobicContact CG-CB 4.48Å; R348-A358 WeakPolarHBondContact O-CB 3.29Å; R348-A358 PolarHBondContact O-N 2.68Å; A358-F374 HydrophobicContact CB-CB 3.76Å; A358-F374 HydrophobicContact CB-CD1 4.32Å; A358-F375 CarbonylContact C-O 3.6Å; A358-F375 WeakPolarHBondContact CA-O 3.38Å; A358-Y400 HydrophobicContact CB-CD1 3.81Å; A358-Y400 HydrophobicContact CB-CE1 4.11Å
359	R	93.6	Very high	94.1	Very high	163 Å²	163	66 Å²	66	62%	0.615	33%	0.331	S	S	*	.			trans	-125.1	-11.5	174.3	-66	-166.3	69.8	173.6	2.4	112.9	F375 Y400	R359-F375 PolarHBondContact N-O 3.1Å; R359-Y400 CarbonylContact C-O 3.59Å; R359-Y400 WeakPolarHBondContact CA-O 3.39Å; R359-Y400 PolarHBondContact O-N 3.06Å
360	W	94.9	Very high	94.1	Very high	11 Å²	11	65 Å²	65	4%	0.042	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	140.5	179.9	-67.9	97.6	0	0	0	109.2	F227 P231 A234 F374 F375 D377 F380 A397 Y398 P399	F227-W360 HydrophobicContact CB-CH2 4.08Å; F227-W360 HydrophobicContact CB-CZ3 3.99Å; P231-W360 HydrophobicContact CB-CH2 3.81Å; P231-W360 HydrophobicContact CB-CZ2 3.93Å; A234-W360 HydrophobicContact CB-CH2 3.82Å; A234-W360 HydrophobicContact CB-CZ2 4.4Å; W360-F374 CarbonylContact O-C 3.59Å; W360-F374 WeakPolarHBondContact O-CA 3.49Å; W360-F375 HydrophobicContact CB-CB 4.5Å; W360-F375 PolarHBondContact N-O 3.13Å; W360-F375 PolarHBondContact O-N 3.4Å; W360-D377 PolarHBondContact NE1-OD1 3.02Å; W360-F380 HydrophobicContact CB-CB 4.28Å; W360-F380 HydrophobicContact CB-CD1 4.25Å; W360-F380 HydrophobicContact CB-CD2 4.12Å; W360-F380 HydrophobicContact CB-CG 3.95Å; W360-F380 AromaticContact CD1-CD1 3.51Å; W360-F380 AromaticContact CD1-CG 3.83Å; W360-F380 AromaticContact CD2-CD1 3.74Å; W360-F380 HydrophobicContact CD2-CD1 3.74Å; W360-F380 AromaticContact CD2-CE1 3.67Å; W360-F380 HydrophobicContact CD2-CE1 3.67Å; W360-F380 HydrophobicContact CD2-CG 4.34Å; W360-F380 HydrophobicContact CD2-CZ 4.25Å; W360-F380 AromaticContact CE2-CD1 3.79Å; W360-F380 AromaticContact CE2-CE1 3.81Å; W360-F380 HydrophobicContact CE3-CD1 4.48Å; W360-F380 AromaticContact CE3-CE1 3.98Å; W360-F380 HydrophobicContact CE3-CE1 3.98Å; W360-F380 HydrophobicContact CE3-CZ 4.2Å; W360-F380 HydrophobicContact CG-CB 4.19Å; W360-F380 AromaticContact CG-CD1 3.58Å; W360-F380 HydrophobicContact CG-CD1 3.58Å; W360-F380 HydrophobicContact CG-CD2 4.33Å; W360-F380 AromaticContact CG-CE1 3.98Å; W360-F380 HydrophobicContact CG-CE1 3.98Å; W360-F380 AromaticContact CG-CG 3.77Å; W360-F380 HydrophobicContact CG-CG 3.77Å; W360-F380 HydrophobicContact CH2-CE1 4.49Å; W360-F380 HydrophobicContact CZ2-CE1 4.24Å; W360-F380 HydrophobicContact CZ3-CE1 4.38Å; W360-F380 AromaticContact NE1-CD1 3.63Å; W360-A397 HydrophobicContact CE3-CB 4.16Å; W360-A397 HydrophobicContact CZ3-CB 4.39Å; W360-Y398 WeakPolarHBondContact CA-O 3.35Å; W360-P399 HydrophobicContact CH2-CG 4.17Å; W360-P399 HydrophobicContact CZ3-CG 3.89Å
361	V	95.6	Very high	94	Very high	20 Å²	20	69.5 Å²	69.5	12%	0.121	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	132.3	164.9	62.8	0	0	0	0	108.3	P372 C373 F374 A397 Y398	V361-P372 HydrophobicContact CG2-CB 3.65Å; V361-C373 CarbonylContact C-O 3.53Å; V361-C373 VanDerWaalsContact CA-O 3.28Å; V361-C373 WeakPolarHBondContact CA-O 3.44Å; V361-F374 HydrophobicContact CB-CD1 4.02Å; V361-F374 HydrophobicContact CB-CE1 3.93Å; V361-F374 HydrophobicContact CG2-CD1 4.08Å; V361-F374 HydrophobicContact CG2-CE1 3.75Å; V361-F374 HydrophobicContact CG2-CE2 4.4Å; V361-F374 HydrophobicContact CG2-CZ 3.94Å; V361-A397 WeakPolarHBondContact O-CA 3.33Å; V361-Y398 PolarHBondContact N-O 2.9Å; V361-Y398 PolarHBondContact O-N 2.92Å
362	T	96.7	Very high	94	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	148.4	175	64.9	0	0	0	0	111	D365 P372 C373 F375 F380 F395 L396 A397	T362-D365 WeakPolarHBondContact CB-OD2 3.47Å; T362-D365 WeakPolarHBondContact OG1-CB 3.35Å; T362-D365 PolarHBondContact OG1-OD2 3.14Å; T362-P372 VanDerWaalsContact O-CA 3.24Å; T362-P372 WeakPolarHBondContact O-CA 3.17Å; T362-P372 WeakPolarHBondContact O-CB 3.46Å; T362-C373 PolarHBondContact N-O 3.21Å; T362-C373 PolarHBondContact O-N 2.81Å; T362-F375 HydrophobicContact CG2-CD2 4.05Å; T362-F375 HydrophobicContact CG2-CE2 4.02Å; T362-F375 WeakPolarHBondContact OG1-CE2 3.26Å; T362-F380 HydrophobicContact CG2-CD2 4.04Å; T362-F380 HydrophobicContact CG2-CE2 3.7Å; T362-F395 HydrophobicContact CG2-CD2 4.29Å; T362-L396 CarbonylContact C-O 3.58Å; T362-L396 WeakPolarHBondContact CA-O 3.47Å; T362-L396 WeakPolarHBondContact CB-O 3.42Å; T362-A397 HydrophobicContact CG2-CB 4.23Å
363	N	96.3	Very high	94	Very high	51 Å²	51	65.5 Å²	65.5	27%	0.273	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	150.4	175.5	-73.4	74.9	0	0	0	110.4	D365 D371 L396 Y398	N363-D365 PolarHBondContact O-N 2.91Å; N363-D371 WeakPolarHBondContact CA-OD1 3.3Å; N363-L396 HydrophobicContact CB-CB 4.36Å; N363-L396 PolarHBondContact N-O 2.58Å; N363-L396 PolarHBondContact O-N 3.29Å; N363-Y398 HydrophobicContact CB-CE2 4.4Å
364	N	95.6	Very high	94.1	Very high	106 Å²	106	64.8 Å²	64.8	57%	0.567	33%	0.326	S	S	*	.	S	Bend	trans	52.2	36.2	-177.6	-55.6	-50	0	0	0	112.3	D371	N364-D371 PolarHBondContact N-OD1 2.85Å; N364-D371 PolarHBondContact N-OD2 3.23Å
365	D	95.5	Very high	94.2	Very high	11 Å²	11	59.4 Å²	59.4	6%	0.059	30%	0.302	C	S	.	.			trans	-94.6	110.3	-170.7	177.7	-4.7	0	0	0	110.7	T362 N363 F367 A368 H384 F395	T362-D365 WeakPolarHBondContact CB-OD2 3.47Å; T362-D365 WeakPolarHBondContact OG1-CB 3.35Å; T362-D365 PolarHBondContact OG1-OD2 3.14Å; N363-D365 PolarHBondContact O-N 2.91Å; D365-F367 PolarHBondContact O-N 2.85Å; D365-F367 WeakPolarHBondContact OD1-CA 3.17Å; D365-F367 WeakPolarHBondContact OD1-CB 3.5Å; D365-F367 PolarHBondContact OD1-N 3.09Å; D365-A368 HydrophobicContact CB-CB 3.8Å; D365-A368 VanDerWaalsContact CG-CB 3.49Å; D365-A368 PolarHBondContact O-N 2.87Å; D365-A368 PolarHBondContact OD1-N 2.56Å; D365-A368 WeakPolarHBondContact OD2-CB 3.43Å; D365-H384 IonicContact OD1-CD2 3.48Å; D365-H384 IonicContact OD1-NE2 3.31Å; D365-H384 IonicContact OD2-CD2 2.81Å; D365-H384 IonicContact OD2-CE1 3.31Å; D365-H384 IonicContact OD2-NE2 2.98Å; D365-H384 PolarHBondContact OD2-NE2 3.32Å; D365-F395 HydrophobicContact CB-CB 3.84Å
366	T	91.8	Very high	94.4	Very high	109 Å²	109	54.2 Å²	54.2	67%	0.669	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-16.2	-178.2	57.4	0	0	0	0	114
367	F	91.3	Very high	94.4	Very high	83 Å²	83	50.7 Å²	50.7	36%	0.364	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-19.9	176.3	-55.5	-55.6	0	0	0	112.1	D365 L383 H384 L392	D365-F367 PolarHBondContact O-N 2.85Å; D365-F367 WeakPolarHBondContact OD1-CA 3.17Å; D365-F367 WeakPolarHBondContact OD1-CB 3.5Å; D365-F367 PolarHBondContact OD1-N 3.09Å; F367-L383 HydrophobicContact CB-CD1 4.27Å; F367-L383 HydrophobicContact CB-CD2 4.16Å; F367-L383 HydrophobicContact CB-CG 4.06Å; F367-H384 AromaticContact CD2-CD2 3.92Å; F367-L392 HydrophobicContact CE2-CB 4.23Å; F367-L392 HydrophobicContact CZ-CB 4.27Å; F367-L392 WeakPolarHBondContact CZ-O 3.13Å
368	A	93.6	Very high	94.5	Very high	18 Å²	18	52 Å²	52	15%	0.149	28%	0.276	C	S	.	.	S	Bend	trans	-78.5	146	178.7	0	0	0	0	0	112.6	D365 E370 C373 F375	D365-A368 HydrophobicContact CB-CB 3.8Å; D365-A368 VanDerWaalsContact CG-CB 3.49Å; D365-A368 PolarHBondContact O-N 2.87Å; D365-A368 PolarHBondContact OD1-N 2.56Å; D365-A368 WeakPolarHBondContact OD2-CB 3.43Å; A368-E370 VanDerWaalsContact C-N 3.34Å; A368-E370 WeakPolarHBondContact CB-O 3.32Å; A368-C373 HydrophobicContact CB-CB 3.52Å; A368-F375 HydrophobicContact CB-CE2 4.46Å; A368-F375 HydrophobicContact CB-CZ 4.08Å
369	P	87.9	Confident	94.6	Very high	87 Å²	87	52.8 Å²	52.8	57%	0.565	28%	0.281	S	S	*	.	S	Bend	trans	-80.6	-14.2	175.4	29.6	-31.2	0	0	0	113.7	F351	F351-P369 HydrophobicContact CD1-CG 3.47Å; F351-P369 VanDerWaalsContact CD1-CG 3.47Å; F351-P369 HydrophobicContact CE1-CB 4.09Å; F351-P369 HydrophobicContact CE1-CG 3.1Å; F351-P369 HydrophobicContact CE2-CG 4.35Å; F351-P369 HydrophobicContact CG-CG 4.28Å; F351-P369 HydrophobicContact CZ-CB 4.29Å; F351-P369 HydrophobicContact CZ-CG 3.59Å
370	E	93.3	Very high	94.8	Very high	97 Å²	97	45 Å²	45	45%	0.453	25%	0.252	S	S	.	.	S	Bend	trans	-137.7	158.5	179.9	-66	-179.5	-172.8	0	0	109.2	F351 A368 C373	F351-E370 HydrophobicContact CE2-CG 4.22Å; F351-E370 WeakPolarHBondContact CE2-OE1 3.44Å; A368-E370 VanDerWaalsContact C-N 3.34Å; A368-E370 WeakPolarHBondContact CB-O 3.32Å; E370-C373 VanDerWaalsContact O-CB 3.3Å; E370-C373 WeakPolarHBondContact O-CB 3.38Å
371	D	93	Very high	94.8	Very high	93 Å²	93	47.2 Å²	47.2	50%	0.497	26%	0.26	S	S	.	.	S	Bend	trans	-135.5	114.9	175.2	-172.2	24.2	0	0	0	109.7	N363 N364	N363-D371 WeakPolarHBondContact CA-OD1 3.3Å; N364-D371 PolarHBondContact N-OD1 2.85Å; N364-D371 PolarHBondContact N-OD2 3.23Å
372	P	95.1	Very high	94.7	Very high	57 Å²	57	53.4 Å²	53.4	37%	0.37	29%	0.289	S	S	.	.	S	Bend	cis	-74.6	152.9	-1.6	31.5	-35.5	0	0	0	113.6	V361 T362	V361-P372 HydrophobicContact CG2-CB 3.65Å; T362-P372 VanDerWaalsContact O-CA 3.24Å; T362-P372 WeakPolarHBondContact O-CA 3.17Å; T362-P372 WeakPolarHBondContact O-CB 3.46Å
373	C	96.1	Very high	94.6	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.007	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	148.8	176.2	-168.9	0	0	0	0	112.7	F351 V361 T362 A368 E370 F375	F351-C373 VanDerWaalsContact CB-SG 3.57Å; V361-C373 CarbonylContact C-O 3.53Å; V361-C373 VanDerWaalsContact CA-O 3.28Å; V361-C373 WeakPolarHBondContact CA-O 3.44Å; T362-C373 PolarHBondContact N-O 3.21Å; T362-C373 PolarHBondContact O-N 2.81Å; A368-C373 HydrophobicContact CB-CB 3.52Å; E370-C373 VanDerWaalsContact O-CB 3.3Å; E370-C373 WeakPolarHBondContact O-CB 3.38Å; C373-F375 HydrophobicContact CB-CE2 3.61Å; C373-F375 HydrophobicContact CB-CZ 3.98Å; C373-F375 VanDerWaalsContact SG-CE2 3.51Å; C373-F375 WeakPolarHBondContact SG-CZ 3.28Å
374	F	96.2	Very high	94.6	Very high	30 Å²	30	54 Å²	54	13%	0.132	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	129.8	-172.6	-64.8	-93.5	0	0	0	111.5	R348 C350 F351 A358 W360 V361 Y400	R348-F374 HydrophobicContact CG-CB 4.16Å; R348-F374 HydrophobicContact CG-CD1 3.88Å; R348-F374 HydrophobicContact CG-CD2 4.25Å; R348-F374 HydrophobicContact CG-CE1 4.35Å; R348-F374 HydrophobicContact CG-CG 3.82Å; R348-F374 VanDerWaalsContact NE-CD2 3.27Å; C350-F374 CarbonylContact C-O 3.59Å; C350-F374 WeakPolarHBondContact CA-O 3.33Å; F351-F374 WeakPolarHBondContact CB-O 3.36Å; F351-F374 PolarHBondContact N-O 3Å; A358-F374 HydrophobicContact CB-CB 3.76Å; A358-F374 HydrophobicContact CB-CD1 4.32Å; W360-F374 CarbonylContact O-C 3.59Å; W360-F374 WeakPolarHBondContact O-CA 3.49Å; V361-F374 HydrophobicContact CB-CD1 4.02Å; V361-F374 HydrophobicContact CB-CE1 3.93Å; V361-F374 HydrophobicContact CG2-CD1 4.08Å; V361-F374 HydrophobicContact CG2-CE1 3.75Å; V361-F374 HydrophobicContact CG2-CE2 4.4Å; V361-F374 HydrophobicContact CG2-CZ 3.94Å; F374-Y400 HydrophobicContact CD1-CD1 4.04Å; F374-Y400 HydrophobicContact CD1-CD2 4.08Å; F374-Y400 HydrophobicContact CD1-CE1 4.07Å; F374-Y400 HydrophobicContact CD1-CE2 4.12Å; F374-Y400 HydrophobicContact CD1-CG 4.02Å; F374-Y400 HydrophobicContact CE1-CD1 4.39Å; F374-Y400 AromaticContact CE1-CD2 3.65Å; F374-Y400 HydrophobicContact CE1-CD2 3.65Å; F374-Y400 HydrophobicContact CE1-CE1 4.25Å; F374-Y400 AromaticContact CE1-CE2 3.5Å; F374-Y400 HydrophobicContact CE1-CE2 3.5Å; F374-Y400 HydrophobicContact CE1-CG 4.09Å; F374-Y400 AromaticContact CE1-CZ 3.8Å
375	F	96.9	Very high	94.7	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	145.8	-175.9	-60.3	-91.2	0	0	0	111.7	V352 A358 R359 W360 T362 A368 C373 C379 F380 L383 H384	V352-F375 HydrophobicContact CG2-CD1 3.7Å; V352-F375 HydrophobicContact CG2-CE1 3.52Å; A358-F375 CarbonylContact C-O 3.6Å; A358-F375 WeakPolarHBondContact CA-O 3.38Å; R359-F375 PolarHBondContact N-O 3.1Å; W360-F375 HydrophobicContact CB-CB 4.5Å; W360-F375 PolarHBondContact N-O 3.13Å; W360-F375 PolarHBondContact O-N 3.4Å; T362-F375 HydrophobicContact CG2-CD2 4.05Å; T362-F375 HydrophobicContact CG2-CE2 4.02Å; T362-F375 WeakPolarHBondContact OG1-CE2 3.26Å; A368-F375 HydrophobicContact CB-CE2 4.46Å; A368-F375 HydrophobicContact CB-CZ 4.08Å; C373-F375 HydrophobicContact CB-CE2 3.61Å; C373-F375 HydrophobicContact CB-CZ 3.98Å; C373-F375 VanDerWaalsContact SG-CE2 3.51Å; C373-F375 WeakPolarHBondContact SG-CZ 3.28Å; F375-C379 HydrophobicContact CD1-CB 4.49Å; F375-F380 HydrophobicContact CB-CB 3.74Å; F375-F380 HydrophobicContact CG-CB 4.49Å; F375-L383 HydrophobicContact CE1-CD2 3.61Å; F375-L383 HydrophobicContact CZ-CD2 3.99Å; F375-H384 AromaticContact CE2-CE1 3.87Å; F375-H384 AromaticContact CZ-CE1 3.75Å
376	C	96.4	Very high	94.6	Very high	6 Å²	6	51.9 Å²	51.9	4%	0.041	28%	0.279	C	S	.	.			trans	-75.7	163.8	161	68.2	0	0	0	0	108.8	C350 V378 C379 F380	C350-C376 HydrophobicContact CB-CB 3.78Å; C350-C376 VanDerWaalsContact CB-N 3.27Å; C350-C376 PolarHBondContact SG-N 3.48Å; C376-V378 VanDerWaalsContact C-N 3.34Å; C376-V378 PolarHBondContact O-N 2.82Å; C376-C379 PolarHBondContact O-N 2.84Å; C376-F380 VanDerWaalsContact O-CB 3.28Å; C376-F380 WeakPolarHBondContact O-CB 3.28Å; C376-F380 PolarHBondContact O-N 3.34Å
377	D	94.9	Very high	94.6	Very high	61 Å²	61	52.8 Å²	52.8	33%	0.326	29%	0.29	S	S	.	.	H	α-helix	trans	-55.7	-46.5	-175.8	-165.6	62	0	0	0	112.7	W360 F380 R381	W360-D377 PolarHBondContact NE1-OD1 3.02Å; D377-F380 PolarHBondContact O-N 3.33Å; D377-R381 WeakPolarHBondContact O-CG 3.5Å; D377-R381 PolarHBondContact O-N 3.13Å
378	V	95.9	Very high	94.6	Very high	87 Å²	87	56.6 Å²	56.6	53%	0.527	31%	0.309	S	S	.	.	H	α-helix	trans	-61.8	-51.3	179.9	-179.1	0	0	0	0	112.2	C376 F380 R381 M382	C376-V378 VanDerWaalsContact C-N 3.34Å; C376-V378 PolarHBondContact O-N 2.82Å; V378-F380 VanDerWaalsContact C-N 3.31Å; V378-F380 PolarHBondContact O-N 3.2Å; V378-R381 PolarHBondContact O-N 2.77Å; V378-M382 HydrophobicContact CG1-CG 4.43Å; V378-M382 HydrophobicContact CG1-SD 3.88Å; V378-M382 WeakPolarHBondContact O-CG 3.47Å; V378-M382 PolarHBondContact O-N 2.88Å
379	C	96.6	Very high	94.4	Very high	18 Å²	18	57.9 Å²	57.9	12%	0.122	33%	0.325	C	S	.	.	H	α-helix	trans	-67.8	-34	-178.9	-67.6	0	0	0	0	112.1	V352 F375 C376 L383	V352-C379 HydrophobicContact CB-CB 3.96Å; V352-C379 HydrophobicContact CG1-CB 4.33Å; V352-C379 HydrophobicContact CG2-CB 4.28Å; F375-C379 HydrophobicContact CD1-CB 4.49Å; C376-C379 PolarHBondContact O-N 2.84Å; C379-L383 WeakPolarHBondContact O-CB 3.4Å; C379-L383 PolarHBondContact O-N 2.97Å; C379-L383 VanDerWaalsContact O-N 3.13Å
380	F	96.3	Very high	94.5	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-59.6	-50.5	174.1	175.5	-118.3	0	0	0	110.4	P231 W360 T362 F375 C376 D377 V378 H384 Y385 F395 A397	P231-F380 HydrophobicContact CB-CE1 3.95Å; W360-F380 HydrophobicContact CB-CB 4.28Å; W360-F380 HydrophobicContact CB-CD1 4.25Å; W360-F380 HydrophobicContact CB-CD2 4.12Å; W360-F380 HydrophobicContact CB-CG 3.95Å; W360-F380 AromaticContact CD1-CD1 3.51Å; W360-F380 AromaticContact CD1-CG 3.83Å; W360-F380 AromaticContact CD2-CD1 3.74Å; W360-F380 HydrophobicContact CD2-CD1 3.74Å; W360-F380 AromaticContact CD2-CE1 3.67Å; W360-F380 HydrophobicContact CD2-CE1 3.67Å; W360-F380 HydrophobicContact CD2-CG 4.34Å; W360-F380 HydrophobicContact CD2-CZ 4.25Å; W360-F380 AromaticContact CE2-CD1 3.79Å; W360-F380 AromaticContact CE2-CE1 3.81Å; W360-F380 HydrophobicContact CE3-CD1 4.48Å; W360-F380 AromaticContact CE3-CE1 3.98Å; W360-F380 HydrophobicContact CE3-CE1 3.98Å; W360-F380 HydrophobicContact CE3-CZ 4.2Å; W360-F380 HydrophobicContact CG-CB 4.19Å; W360-F380 AromaticContact CG-CD1 3.58Å; W360-F380 HydrophobicContact CG-CD1 3.58Å; W360-F380 HydrophobicContact CG-CD2 4.33Å; W360-F380 AromaticContact CG-CE1 3.98Å; W360-F380 HydrophobicContact CG-CE1 3.98Å; W360-F380 AromaticContact CG-CG 3.77Å; W360-F380 HydrophobicContact CG-CG 3.77Å; W360-F380 HydrophobicContact CH2-CE1 4.49Å; W360-F380 HydrophobicContact CZ2-CE1 4.24Å; W360-F380 HydrophobicContact CZ3-CE1 4.38Å; W360-F380 AromaticContact NE1-CD1 3.63Å; T362-F380 HydrophobicContact CG2-CD2 4.04Å; T362-F380 HydrophobicContact CG2-CE2 3.7Å; F375-F380 HydrophobicContact CB-CB 3.74Å; F375-F380 HydrophobicContact CG-CB 4.49Å; C376-F380 VanDerWaalsContact O-CB 3.28Å; C376-F380 WeakPolarHBondContact O-CB 3.28Å; C376-F380 PolarHBondContact O-N 3.34Å; D377-F380 PolarHBondContact O-N 3.33Å; V378-F380 VanDerWaalsContact C-N 3.31Å; V378-F380 PolarHBondContact O-N 3.2Å; F380-H384 AromaticContact CD2-CE1 3.83Å; F380-H384 AromaticContact CD2-ND1 3.36Å; F380-H384 WeakPolarHBondContact CD2-ND1 3.43Å; F380-H384 HydrophobicContact CE2-CB 4.42Å; F380-H384 AromaticContact CE2-ND1 3.78Å; F380-H384 WeakPolarHBondContact O-CB 3.35Å; F380-H384 PolarHBondContact O-N 3.41Å; F380-H384 PolarHBondContact O-ND1 3.28Å; F380-Y385 HydrophobicContact CD1-CE2 4.27Å; F380-Y385 AromaticContact CE1-CE2 3.66Å; F380-Y385 HydrophobicContact CE1-CE2 3.66Å; F380-Y385 HydrophobicContact CE2-CE2 4.22Å; F380-Y385 AromaticContact CZ-CE2 3.62Å; F380-Y385 HydrophobicContact CZ-CE2 3.62Å; F380-Y385 AromaticContact CZ-CZ 3.99Å; F380-Y385 WeakPolarHBondContact CZ-OH 3.38Å; F380-F395 AromaticContact CE2-CE2 3.9Å; F380-F395 HydrophobicContact CE2-CE2 3.9Å; F380-F395 HydrophobicContact CZ-CE2 4.07Å; F380-A397 HydrophobicContact CE2-CB 3.77Å; F380-A397 HydrophobicContact CZ-CB 3.49Å; F380-A397 VanDerWaalsContact CZ-CB 3.49Å
381	R	95.3	Very high	94.6	Very high	56 Å²	56	56.1 Å²	56.1	21%	0.211	31%	0.31	C	S	.	.	H	α-helix	trans	-62.1	-48.4	179	-63.9	-59	179.5	129.9	6.7	112.6	P231 D232 D377 V378 L383 H384 Y385	P231-R381 VanDerWaalsContact CG-CZ 3.4Å; D232-R381 VanDerWaalsContact CG-NH2 3.35Å; D232-R381 IonicContact OD1-CZ 3.38Å; D232-R381 IonicContact OD1-NH1 2.95Å; D232-R381 PolarHBondContact OD1-NH1 3.43Å; D232-R381 IonicContact OD1-NH2 2.72Å; D232-R381 PolarHBondContact OD1-NH2 3.45Å; D232-R381 IonicContact OD2-CZ 2.76Å; D232-R381 IonicContact OD2-NH1 3.59Å; D232-R381 PolarHBondContact OD2-NH1 2.84Å; D232-R381 IonicContact OD2-NH2 2.74Å; D377-R381 WeakPolarHBondContact O-CG 3.5Å; D377-R381 PolarHBondContact O-N 3.13Å; V378-R381 PolarHBondContact O-N 2.77Å; R381-L383 VanDerWaalsContact C-N 3.31Å; R381-L383 PolarHBondContact O-N 3.48Å; R381-H384 PolarHBondContact O-N 3.13Å; R381-Y385 PolarHBondContact O-N 3.38Å; R381-Y385 VanDerWaalsContact O-N 3.1Å
382	M	94.7	Very high	94.6	Very high	151 Å²	151	56.1 Å²	56.1	74%	0.744	31%	0.31	S	S	*	.	H	α-helix	trans	-63.7	-32.5	-176.7	-72.5	-178.5	68.5	0	0	114.2	V378	V378-M382 HydrophobicContact CG1-CG 4.43Å; V378-M382 HydrophobicContact CG1-SD 3.88Å; V378-M382 WeakPolarHBondContact O-CG 3.47Å; V378-M382 PolarHBondContact O-N 2.88Å
383	L	94.8	Very high	94.4	Very high	62 Å²	62	54.2 Å²	54.2	33%	0.325	30%	0.301	S	S	.	.	H	α-helix	trans	-85.3	-33.4	-177.2	-175.6	61.6	0	0	0	112.4	F367 F375 C379 R381	F367-L383 HydrophobicContact CB-CD1 4.27Å; F367-L383 HydrophobicContact CB-CD2 4.16Å; F367-L383 HydrophobicContact CB-CG 4.06Å; F375-L383 HydrophobicContact CE1-CD2 3.61Å; F375-L383 HydrophobicContact CZ-CD2 3.99Å; C379-L383 WeakPolarHBondContact O-CB 3.4Å; C379-L383 PolarHBondContact O-N 2.97Å; C379-L383 VanDerWaalsContact O-N 3.13Å; R381-L383 VanDerWaalsContact C-N 3.31Å; R381-L383 PolarHBondContact O-N 3.48Å
384	H	96.3	Very high	94.2	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-109.3	-13.3	-165.3	-61.3	96.3	0	0	0	115.1	D365 F367 F375 F380 R381 L392 F395	D365-H384 IonicContact OD1-CD2 3.48Å; D365-H384 IonicContact OD1-NE2 3.31Å; D365-H384 IonicContact OD2-CD2 2.81Å; D365-H384 IonicContact OD2-CE1 3.31Å; D365-H384 IonicContact OD2-NE2 2.98Å; D365-H384 PolarHBondContact OD2-NE2 3.32Å; F367-H384 AromaticContact CD2-CD2 3.92Å; F375-H384 AromaticContact CE2-CE1 3.87Å; F375-H384 AromaticContact CZ-CE1 3.75Å; F380-H384 AromaticContact CD2-CE1 3.83Å; F380-H384 AromaticContact CD2-ND1 3.36Å; F380-H384 WeakPolarHBondContact CD2-ND1 3.43Å; F380-H384 HydrophobicContact CE2-CB 4.42Å; F380-H384 AromaticContact CE2-ND1 3.78Å; F380-H384 WeakPolarHBondContact O-CB 3.35Å; F380-H384 PolarHBondContact O-N 3.41Å; F380-H384 PolarHBondContact O-ND1 3.28Å; R381-H384 PolarHBondContact O-N 3.13Å; H384-L392 WeakPolarHBondContact O-CB 2.94Å; H384-L392 PolarHBondContact O-N 2.71Å; H384-F395 HydrophobicContact CB-CE1 3.68Å; H384-F395 HydrophobicContact CB-CE2 4.22Å; H384-F395 HydrophobicContact CB-CZ 3.46Å; H384-F395 VanDerWaalsContact CB-CZ 3.46Å; H384-F395 AromaticContact CD2-CD1 3.83Å; H384-F395 AromaticContact CD2-CE1 3.71Å; H384-F395 AromaticContact CD2-CZ 3.93Å; H384-F395 AromaticContact CG-CZ 3.89Å
385	Y	95.9	Very high	94.2	Very high	16 Å²	16	60.3 Å²	60.3	6%	0.063	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-132.4	148.1	-176.3	-55.4	-94	0	0	0	111.5	S228 P231 F380 R381 G389 N390 K391 F395	S228-Y385 VanDerWaalsContact C-OH 3.3Å; S228-Y385 WeakPolarHBondContact CA-OH 3.2Å; S228-Y385 VanDerWaalsContact O-CE1 3.3Å; S228-Y385 WeakPolarHBondContact O-CE1 3.21Å; S228-Y385 PolarHBondContact O-OH 3.41Å; P231-Y385 HydrophobicContact CG-CE1 4.05Å; P231-Y385 HydrophobicContact CG-CE2 4.28Å; F380-Y385 HydrophobicContact CD1-CE2 4.27Å; F380-Y385 AromaticContact CE1-CE2 3.66Å; F380-Y385 HydrophobicContact CE1-CE2 3.66Å; F380-Y385 HydrophobicContact CE2-CE2 4.22Å; F380-Y385 AromaticContact CZ-CE2 3.62Å; F380-Y385 HydrophobicContact CZ-CE2 3.62Å; F380-Y385 AromaticContact CZ-CZ 3.99Å; F380-Y385 WeakPolarHBondContact CZ-OH 3.38Å; R381-Y385 PolarHBondContact O-N 3.38Å; R381-Y385 VanDerWaalsContact O-N 3.1Å; Y385-G389 WeakPolarHBondContact CD1-O 3.44Å; Y385-N390 CarbonylContact C-O 3.5Å; Y385-N390 VanDerWaalsContact CA-O 3.23Å; Y385-N390 WeakPolarHBondContact CA-O 3.41Å; Y385-K391 HydrophobicContact CD1-CB 4.34Å; Y385-K391 HydrophobicContact CE1-CB 4.2Å; Y385-K391 HydrophobicContact CE1-CG 4.29Å; Y385-F395 HydrophobicContact CE1-CZ 4.48Å; Y385-F395 HydrophobicContact CE2-CZ 4.16Å; Y385-F395 AromaticContact CZ-CZ 3.9Å
386	D	94.3	Very high	94.2	Very high	57 Å²	57	63.2 Å²	63.2	31%	0.305	35%	0.345	S	S	.	.			trans	-77.1	179.7	170.7	70.2	17.3	0	0	0	112	E388 G389 N390 L392	D386-E388 PolarHBondContact O-N 2.71Å; D386-E388 VanDerWaalsContact OD1-CA 3.32Å; D386-E388 WeakPolarHBondContact OD1-CA 3.23Å; D386-E388 WeakPolarHBondContact OD1-CB 3.36Å; D386-E388 PolarHBondContact OD1-N 3.01Å; D386-G389 PolarHBondContact O-N 3.3Å; D386-G389 VanDerWaalsContact O-N 3.09Å; D386-G389 PolarHBondContact OD1-N 3.41Å; D386-N390 PolarHBondContact N-O 2.94Å; D386-N390 PolarHBondContact OD1-N 3.46Å; D386-N390 PolarHBondContact OD1-ND2 3.43Å; D386-N390 WeakPolarHBondContact OD2-CB 3.1Å; D386-N390 PolarHBondContact OD2-ND2 2.95Å; D386-L392 HydrophobicContact CB-CD2 3.96Å; D386-L392 HydrophobicContact CB-CG 4.49Å
387	S	92.1	Very high	94.2	Very high	128 Å²	128	63 Å²	63	90%	0.895	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-17.1	178.1	51.8	0	0	0	0	114.6
388	E	90.2	Very high	94.1	Very high	163 Å²	163	63.6 Å²	63.6	76%	0.762	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-5	176.8	-61.9	-175.9	176.7	0	0	111.9	D386 N390	D386-E388 PolarHBondContact O-N 2.71Å; D386-E388 VanDerWaalsContact OD1-CA 3.32Å; D386-E388 WeakPolarHBondContact OD1-CA 3.23Å; D386-E388 WeakPolarHBondContact OD1-CB 3.36Å; D386-E388 PolarHBondContact OD1-N 3.01Å; E388-N390 WeakPolarHBondContact CB-ND2 3.37Å; E388-N390 PolarHBondContact OE2-ND2 3.2Å
389	G	89.3	Confident	94	Very high	46 Å²	46	60.3 Å²	60.3	47%	0.474	32%	0.322	S	S	.	.			trans	86.8	10.5	-178.3	0	0	0	0	0	114	Y385 D386	Y385-G389 WeakPolarHBondContact CD1-O 3.44Å; D386-G389 PolarHBondContact O-N 3.3Å; D386-G389 VanDerWaalsContact O-N 3.09Å; D386-G389 PolarHBondContact OD1-N 3.41Å
390	N	91.8	Very high	93.7	Very high	84 Å²	84	62 Å²	62	45%	0.449	33%	0.326	S	S	.	.			trans	-78.6	139.7	176.2	-50.3	-62.6	0	0	0	110.5	Y385 D386 E388	Y385-N390 CarbonylContact C-O 3.5Å; Y385-N390 VanDerWaalsContact CA-O 3.23Å; Y385-N390 WeakPolarHBondContact CA-O 3.41Å; D386-N390 PolarHBondContact N-O 2.94Å; D386-N390 PolarHBondContact OD1-N 3.46Å; D386-N390 PolarHBondContact OD1-ND2 3.43Å; D386-N390 WeakPolarHBondContact OD2-CB 3.1Å; D386-N390 PolarHBondContact OD2-ND2 2.95Å; E388-N390 WeakPolarHBondContact CB-ND2 3.37Å; E388-N390 PolarHBondContact OE2-ND2 3.2Å
391	K	94.2	Very high	93.3	Very high	62 Å²	62	63.9 Å²	63.9	27%	0.27	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-67.6	129	179	-163.6	-177.1	-179.1	-178.7	0	110.8	S228 Y385 G393 F395	S228-K391 PolarHBondContact OG-NZ 2.83Å; Y385-K391 HydrophobicContact CD1-CB 4.34Å; Y385-K391 HydrophobicContact CE1-CB 4.2Å; Y385-K391 HydrophobicContact CE1-CG 4.29Å; K391-G393 WeakPolarHBondContact CD-O 3.42Å; K391-G393 WeakPolarHBondContact CE-O 3.49Å; K391-G393 WeakPolarHBondContact CG-O 2.89Å; K391-F395 HydrophobicContact CD-CD1 4.49Å; K391-F395 HydrophobicContact CD-CE1 3.88Å; K391-F395 HydrophobicContact CD-CZ 3.97Å; K391-F395 VanDerWaalsContact CE-CD1 3.43Å; K391-F395 WeakPolarHBondContact CE-O 3.4Å; K391-F395 HydrophobicContact CG-CD1 4.33Å; K391-F395 HydrophobicContact CG-CE1 3.38Å; K391-F395 HydrophobicContact CG-CZ 3.57Å; K391-F395 PolarHBondContact NZ-O 2.88Å
392	L	93.2	Very high	92.8	Very high	93 Å²	93	61.3 Å²	61.3	49%	0.487	33%	0.328	S	S	.	.			trans	-87.5	-11.3	-174.7	-70.1	175.5	0	0	0	114.7	F367 H384 D386	F367-L392 HydrophobicContact CE2-CB 4.23Å; F367-L392 HydrophobicContact CZ-CB 4.27Å; F367-L392 WeakPolarHBondContact CZ-O 3.13Å; H384-L392 WeakPolarHBondContact O-CB 2.94Å; H384-L392 PolarHBondContact O-N 2.71Å; D386-L392 HydrophobicContact CB-CD2 3.96Å; D386-L392 HydrophobicContact CB-CG 4.49Å
393	G	90.4	Very high	92	Very high	18 Å²	18	55.3 Å²	55.3	19%	0.186	30%	0.3	C	S	.	.	S	Bend	trans	-167.6	-177.7	-179.3	0	0	0	0	0	113.2	K391 F395	K391-G393 WeakPolarHBondContact CD-O 3.42Å; K391-G393 WeakPolarHBondContact CE-O 3.49Å; K391-G393 WeakPolarHBondContact CG-O 2.89Å; G393-F395 WeakPolarHBondContact O-CD1 3.33Å
394	E	93.4	Very high	91.1	Very high	154 Å²	154	52.7 Å²	52.7	72%	0.72	29%	0.288	S	S	*	.			trans	-90.7	120.4	179.8	-64	-57	143.3	0	0	110.4
395	F	95.4	Very high	89.9	Confident	5 Å²	5	56.9 Å²	56.9	2%	0.022	31%	0.314	C	S	.	.			trans	-162.5	161.4	176.7	60.2	-90	0	0	0	109.2	S228 T362 D365 F380 H384 Y385 K391 G393 A397	S228-F395 VanDerWaalsContact CB-CE2 3.46Å; S228-F395 PolarHBondContact OG-O 2.8Å; T362-F395 HydrophobicContact CG2-CD2 4.29Å; D365-F395 HydrophobicContact CB-CB 3.84Å; F380-F395 AromaticContact CE2-CE2 3.9Å; F380-F395 HydrophobicContact CE2-CE2 3.9Å; F380-F395 HydrophobicContact CZ-CE2 4.07Å; H384-F395 HydrophobicContact CB-CE1 3.68Å; H384-F395 HydrophobicContact CB-CE2 4.22Å; H384-F395 HydrophobicContact CB-CZ 3.46Å; H384-F395 VanDerWaalsContact CB-CZ 3.46Å; H384-F395 AromaticContact CD2-CD1 3.83Å; H384-F395 AromaticContact CD2-CE1 3.71Å; H384-F395 AromaticContact CD2-CZ 3.93Å; H384-F395 AromaticContact CG-CZ 3.89Å; Y385-F395 HydrophobicContact CE1-CZ 4.48Å; Y385-F395 HydrophobicContact CE2-CZ 4.16Å; Y385-F395 AromaticContact CZ-CZ 3.9Å; K391-F395 HydrophobicContact CD-CD1 4.49Å; K391-F395 HydrophobicContact CD-CE1 3.88Å; K391-F395 HydrophobicContact CD-CZ 3.97Å; K391-F395 VanDerWaalsContact CE-CD1 3.43Å; K391-F395 WeakPolarHBondContact CE-O 3.4Å; K391-F395 HydrophobicContact CG-CD1 4.33Å; K391-F395 HydrophobicContact CG-CE1 3.38Å; K391-F395 HydrophobicContact CG-CZ 3.57Å; K391-F395 PolarHBondContact NZ-O 2.88Å; G393-F395 WeakPolarHBondContact O-CD1 3.33Å; F395-A397 HydrophobicContact CD2-CB 4.15Å; F395-A397 HydrophobicContact CE2-CB 4.01Å
396	L	96.5	Very high	88.6	Confident	61 Å²	61	60 Å²	60	32%	0.319	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	142.9	167.5	-55.2	176.4	0	0	0	108.5	E226 T362 N363 Y398	E226-L396 HydrophobicContact CG-CB 4.06Å; E226-L396 HydrophobicContact CG-CD2 4Å; E226-L396 WeakPolarHBondContact OE1-CA 3.47Å; T362-L396 CarbonylContact C-O 3.58Å; T362-L396 WeakPolarHBondContact CA-O 3.47Å; T362-L396 WeakPolarHBondContact CB-O 3.42Å; N363-L396 HydrophobicContact CB-CB 4.36Å; N363-L396 PolarHBondContact N-O 2.58Å; N363-L396 PolarHBondContact O-N 3.29Å; L396-Y398 HydrophobicContact CB-CE2 3.67Å; L396-Y398 WeakPolarHBondContact CD1-OH 3.4Å
397	A	95.9	Very high	87.2	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	131.1	179.4	0	0	0	0	0	111.1	E226 F227 W360 V361 T362 F380 F395	E226-A397 PolarHBondContact OE1-N 2.82Å; F227-A397 PolarHBondContact N-O 2.86Å; W360-A397 HydrophobicContact CE3-CB 4.16Å; W360-A397 HydrophobicContact CZ3-CB 4.39Å; V361-A397 WeakPolarHBondContact O-CA 3.33Å; T362-A397 HydrophobicContact CG2-CB 4.23Å; F380-A397 HydrophobicContact CE2-CB 3.77Å; F380-A397 HydrophobicContact CZ-CB 3.49Å; F380-A397 VanDerWaalsContact CZ-CB 3.49Å; F395-A397 HydrophobicContact CD2-CB 4.15Å; F395-A397 HydrophobicContact CE2-CB 4.01Å
398	Y	94.5	Very high	87	Confident	75 Å²	75	57.3 Å²	57.3	29%	0.294	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	136.1	-179.3	-54.2	-92.4	0	0	0	108.8	G225 E226 W360 V361 N363 L396 Y400	G225-Y398 WeakPolarHBondContact O-CD1 3.27Å; E226-Y398 HydrophobicContact CB-CD1 4.34Å; E226-Y398 HydrophobicContact CB-CE1 3.73Å; E226-Y398 HydrophobicContact CG-CE1 3.9Å; E226-Y398 HydrophobicContact CG-CE2 4.49Å; W360-Y398 WeakPolarHBondContact CA-O 3.35Å; V361-Y398 PolarHBondContact N-O 2.9Å; V361-Y398 PolarHBondContact O-N 2.92Å; N363-Y398 HydrophobicContact CB-CE2 4.4Å; L396-Y398 HydrophobicContact CB-CE2 3.67Å; L396-Y398 WeakPolarHBondContact CD1-OH 3.4Å; Y398-Y400 PolarHBondContact O-N 2.84Å
399	P	92.9	Very high	86.8	Confident	18 Å²	18	51.7 Å²	51.7	12%	0.117	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	136.3	170.2	-20.9	30.8	0	0	0	109.6	I223 F227 A234 W360	I223-P399 HydrophobicContact CB-CB 4.04Å; I223-P399 HydrophobicContact CB-CG 4.36Å; I223-P399 HydrophobicContact CD1-CB 3.98Å; I223-P399 HydrophobicContact CG2-CB 4.25Å; I223-P399 HydrophobicContact CG2-CG 4.06Å; F227-P399 HydrophobicContact CD2-CG 3.84Å; F227-P399 HydrophobicContact CE2-CG 4.18Å; A234-P399 HydrophobicContact CB-CG 3.79Å; W360-P399 HydrophobicContact CH2-CG 4.17Å; W360-P399 HydrophobicContact CZ3-CG 3.89Å
400	Y	90.1	Very high	86.7	Confident	53 Å²	53	52.1 Å²	52.1	21%	0.208	27%	0.268	C	S	.	.			trans	-119.2	125.9	-178.7	177.3	-101.5	0	0	0	109.3	R348 A358 R359 F374 Y398 D402 P403	R348-Y400 HydrophobicContact CB-CE1 3.88Å; R348-Y400 HydrophobicContact CG-CE1 4.25Å; A358-Y400 HydrophobicContact CB-CD1 3.81Å; A358-Y400 HydrophobicContact CB-CE1 4.11Å; R359-Y400 CarbonylContact C-O 3.59Å; R359-Y400 WeakPolarHBondContact CA-O 3.39Å; R359-Y400 PolarHBondContact O-N 3.06Å; F374-Y400 HydrophobicContact CD1-CD1 4.04Å; F374-Y400 HydrophobicContact CD1-CD2 4.08Å; F374-Y400 HydrophobicContact CD1-CE1 4.07Å; F374-Y400 HydrophobicContact CD1-CE2 4.12Å; F374-Y400 HydrophobicContact CD1-CG 4.02Å; F374-Y400 HydrophobicContact CE1-CD1 4.39Å; F374-Y400 AromaticContact CE1-CD2 3.65Å; F374-Y400 HydrophobicContact CE1-CD2 3.65Å; F374-Y400 HydrophobicContact CE1-CE1 4.25Å; F374-Y400 AromaticContact CE1-CE2 3.5Å; F374-Y400 HydrophobicContact CE1-CE2 3.5Å; F374-Y400 HydrophobicContact CE1-CG 4.09Å; F374-Y400 AromaticContact CE1-CZ 3.8Å; Y398-Y400 PolarHBondContact O-N 2.84Å; Y400-D402 HydrophobicContact CE1-CB 3.93Å; Y400-P403 VanDerWaalsContact OH-CD 3.29Å; Y400-P403 WeakPolarHBondContact OH-CD 3.37Å
401	V	87.4	Confident	86.4	Confident	39 Å²	39	50.2 Å²	50.2	24%	0.236	26%	0.258	C	S	.	.			trans	-105.5	115.7	172.4	-178.7	0	0	0	0	107.9	L221 I223 P403 F406	L221-V401 HydrophobicContact CB-CB 4.37Å; L221-V401 HydrophobicContact CB-CG1 3.95Å; L221-V401 WeakPolarHBondContact O-CB 3.33Å; L221-V401 WeakPolarHBondContact O-CG2 3.35Å; I223-V401 HydrophobicContact CD1-CG2 4.1Å; I223-V401 HydrophobicContact CG1-CG2 4.37Å; V401-P403 WeakPolarHBondContact O-CD 3.24Å; V401-F406 HydrophobicContact CG1-CE2 3.75Å; V401-F406 HydrophobicContact CG1-CZ 4.37Å
402	D	85.6	Confident	85.9	Confident	3 Å²	3	49.4 Å²	49.4	2%	0.016	26%	0.257	C	S	.	.			trans	-66.5	122.9	-179.9	176.2	67.3	0	0	0	110.4	T347 R348 T357 Y400 G404 T405	T347-D402 WeakPolarHBondContact CA-OD1 3.42Å; T347-D402 WeakPolarHBondContact CA-OD2 3.3Å; T347-D402 WeakPolarHBondContact CG2-OD2 3.36Å; T347-D402 PolarHBondContact OG1-OD2 2.65Å; R348-D402 WeakPolarHBondContact CB-OD1 3.45Å; R348-D402 PolarHBondContact N-OD1 2.82Å; T357-D402 HydrophobicContact CG2-CB 3.45Å; T357-D402 VanDerWaalsContact CG2-CB 3.45Å; Y400-D402 HydrophobicContact CE1-CB 3.93Å; D402-G404 PolarHBondContact O-N 2.86Å; D402-G404 VanDerWaalsContact O-N 3.16Å; D402-G404 WeakPolarHBondContact OD2-CA 3.36Å; D402-G404 PolarHBondContact OD2-N 3.07Å; D402-T405 WeakPolarHBondContact CB-OG1 3.48Å; D402-T405 WeakPolarHBondContact O-CB 3.44Å; D402-T405 PolarHBondContact O-N 3.18Å; D402-T405 PolarHBondContact O-OG1 3.39Å; D402-T405 PolarHBondContact OD2-N 2.87Å
403	P	77.9	Confident	85.4	Confident	24 Å²	24	46.5 Å²	46.5	16%	0.156	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-60.4	-26.2	179.2	-25.7	35.4	0	0	0	113.9	V218 L345 Y400 V401 T405	V218-P403 HydrophobicContact CG1-CB 4.24Å; V218-P403 HydrophobicContact CG1-CG 3.78Å; V218-P403 HydrophobicContact CG2-CB 3.9Å; V218-P403 HydrophobicContact CG2-CG 4.31Å; L345-P403 HydrophobicContact CB-CB 4.19Å; L345-P403 HydrophobicContact CD1-CB 3.32Å; L345-P403 HydrophobicContact CG-CB 4.36Å; Y400-P403 VanDerWaalsContact OH-CD 3.29Å; Y400-P403 WeakPolarHBondContact OH-CD 3.37Å; V401-P403 WeakPolarHBondContact O-CD 3.24Å; P403-T405 VanDerWaalsContact C-N 3.27Å; P403-T405 PolarHBondContact O-N 3.22Å
404	G	76.2	Confident	85.1	Confident	7 Å²	7	48.6 Å²	48.6	7%	0.072	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-76.6	-7.5	176.2	0	0	0	0	0	114.4	D402 F406 N407	D402-G404 PolarHBondContact O-N 2.86Å; D402-G404 VanDerWaalsContact O-N 3.16Å; D402-G404 WeakPolarHBondContact OD2-CA 3.36Å; D402-G404 PolarHBondContact OD2-N 3.07Å; G404-F406 PolarHBondContact O-N 3.02Å; G404-N407 WeakPolarHBondContact CA-ND2 3.46Å; G404-N407 PolarHBondContact O-N 3.32Å; G404-N407 PolarHBondContact O-ND2 3.33Å; G404-N407 VanDerWaalsContact O-ND2 3.09Å
405	T	71.6	Confident	84.4	Confident	88 Å²	88	40.5 Å²	40.5	54%	0.54	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-61.4	-26.9	174.2	-54.2	0	0	0	0	112	D402 P403	D402-T405 WeakPolarHBondContact CB-OG1 3.48Å; D402-T405 WeakPolarHBondContact O-CB 3.44Å; D402-T405 PolarHBondContact O-N 3.18Å; D402-T405 PolarHBondContact O-OG1 3.39Å; D402-T405 PolarHBondContact OD2-N 2.87Å; P403-T405 VanDerWaalsContact C-N 3.27Å; P403-T405 PolarHBondContact O-N 3.22Å
406	F	67.1	Low	83.5	Confident	83 Å²	83	43.4 Å²	43.4	36%	0.364	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-108.9	20.8	-176.4	-53.7	-87	0	0	0	112.2	L221 K342 V401 G404	L221-F406 HydrophobicContact CB-CE2 4.39Å; L221-F406 HydrophobicContact CD1-CD2 3.22Å; L221-F406 HydrophobicContact CD1-CE2 3.28Å; L221-F406 HydrophobicContact CD1-CG 4.06Å; L221-F406 HydrophobicContact CD1-CZ 4.13Å; L221-F406 HydrophobicContact CD2-CD2 4.14Å; L221-F406 HydrophobicContact CD2-CE1 4.04Å; L221-F406 HydrophobicContact CD2-CE2 3.58Å; L221-F406 HydrophobicContact CD2-CZ 3.51Å; L221-F406 HydrophobicContact CG-CD2 4.26Å; L221-F406 HydrophobicContact CG-CE2 3.91Å; L221-F406 HydrophobicContact CG-CZ 4.35Å; K342-F406 WeakPolarHBondContact CE-O 3.2Å; K342-F406 PolarHBondContact NZ-O 3.27Å; V401-F406 HydrophobicContact CG1-CE2 3.75Å; V401-F406 HydrophobicContact CG1-CZ 4.37Å; G404-F406 PolarHBondContact O-N 3.02Å
407	N	66.5	Low	82.3	Confident	70 Å²	70	41.8 Å²	41.8	37%	0.374	22%	0.216	S	C	.	.			trans	-59	0	173.6	-79.4	-31.7	0	0	0	112.2	W344 L345 G404	W344-N407 WeakPolarHBondContact CA-OD1 3.4Å; W344-N407 HydrophobicContact CD2-CB 4.05Å; W344-N407 HydrophobicContact CE3-CB 3.8Å; W344-N407 HydrophobicContact CH2-CB 3.87Å; W344-N407 HydrophobicContact CZ2-CB 4.11Å; W344-N407 HydrophobicContact CZ3-CB 3.7Å; W344-N407 PolarHBondContact NE1-ND2 3.16Å; L345-N407 PolarHBondContact N-OD1 3.32Å; L345-N407 PolarHBondContact O-ND2 3.25Å; G404-N407 WeakPolarHBondContact CA-ND2 3.46Å; G404-N407 PolarHBondContact O-N 3.32Å; G404-N407 PolarHBondContact O-ND2 3.33Å; G404-N407 VanDerWaalsContact O-ND2 3.09Å

Retrieved 407 of 407 residues in 80.4 ms (Link to these results)

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