A0A3Q0KV75_SCHMA Loading...

Putative ribosomal pseudouridine synthase

AlphaFold DB , UniProt , Accession A0A3Q0KV75, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 259 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.7	Very low	35.5	Very low	252 Å²	252	154.9 Å²	154.9	100%	1.241	85%	0.85	S	S	*	*				0	118.3	0	-81.4	163.5	146	0	0	106.6
2	G	37.5	Very low	35.9	Very low	74 Å²	74	157.2 Å²	157.2	76%	0.763	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-72.3	133.6	-148.1	0	0	0	0	0	115.7
3	S	36.5	Very low	36.3	Very low	108 Å²	108	151.4 Å²	151.4	76%	0.755	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-82.6	127.5	167.9	-178.8	0	0	0	0	109.2
4	W	35	Very low	36.6	Very low	242 Å²	242	155.3 Å²	155.3	92%	0.917	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-99.9	118.8	169.4	-73.3	60.9	0	0	0	107.7
5	S	33.7	Very low	36.7	Very low	109 Å²	109	157.2 Å²	157.2	76%	0.762	85%	0.845	S	S	*	*			trans	-111.9	108.6	171.7	-56.8	0	0	0	0	107.4	L7	S5-L7 PolarHBondContact O-N 3.09Å
6	T	40.6	Very low	36.4	Very low	135 Å²	135	157.9 Å²	157.9	83%	0.828	85%	0.848	S	S	*	*			trans	-78.1	120.3	176	-52.8	0	0	0	0	109.2
7	L	32.3	Very low	36.2	Very low	138 Å²	138	157.5 Å²	157.5	72%	0.723	84%	0.844	S	S	*	*			trans	-85.6	115.5	-179.4	-166.9	101.9	0	0	0	109.3	S5 R9	S5-L7 PolarHBondContact O-N 3.09Å; L7-R9 HydrophobicContact CD2-CG 3.9Å
8	V	34	Very low	36	Very low	142 Å²	142	155.1 Å²	155.1	86%	0.861	84%	0.836	S	S	*	*			trans	-77.9	117.7	167.9	179	0	0	0	0	108.1
9	R	34	Very low	36.1	Very low	216 Å²	216	153.3 Å²	153.3	82%	0.815	83%	0.83	S	S	*	*			trans	-105.6	111.7	169.6	-98.8	-178.8	176.7	-153.1	-0	109.6	L7	L7-R9 HydrophobicContact CD2-CG 3.9Å
10	G	33.4	Very low	36.1	Very low	71 Å²	71	151.9 Å²	151.9	73%	0.732	83%	0.827	S	S	*	*			trans	-72.9	136.5	164.4	0	0	0	0	0	110.9
11	F	36.3	Very low	36.3	Very low	217 Å²	217	149.5 Å²	149.5	95%	0.952	82%	0.821	S	S	*	*			trans	-83.4	125.3	169.3	-105	-99.2	0	0	0	109.5
12	H	39.8	Very low	36.1	Very low	182 Å²	182	144.5 Å²	144.5	84%	0.843	80%	0.8	S	S	*	*			trans	-130.4	133.6	175.2	-146.1	-64.3	0	0	0	108.5
13	A	41.3	Very low	36.4	Very low	82 Å²	82	144.8 Å²	144.8	68%	0.678	79%	0.79	S	S	*	*			trans	62.1	116.4	160.2	0	0	0	0	0	119.2	Q15	A13-Q15 PolarHBondContact O-N 3.33Å
14	H	40.2	Very low	36.6	Very low	206 Å²	206	147.1 Å²	147.1	95%	0.954	79%	0.794	S	S	*	*			trans	-45.6	116.8	156.7	-76.4	-97.3	0	0	0	111.4
15	Q	38.9	Very low	37	Very low	184 Å²	184	138.4 Å²	138.4	86%	0.86	77%	0.77	S	S	*	*			trans	-118.5	115.8	166	-149.3	168.2	25.5	0	0	107.9	A13 L17	A13-Q15 PolarHBondContact O-N 3.33Å; Q15-L17 PolarHBondContact O-N 3.4Å
16	L	31.7	Very low	37.8	Very low	169 Å²	169	140.2 Å²	140.2	89%	0.885	78%	0.777	S	S	*	*			trans	-58.4	115.5	171.3	-104.7	121.8	0	0	0	109
17	L	32	Very low	38.4	Very low	150 Å²	150	140 Å²	140	79%	0.785	77%	0.767	S	S	*	*			trans	-94	109.2	174.6	-162	137.8	0	0	0	108.6	Q15 V19	Q15-L17 PolarHBondContact O-N 3.4Å; L17-V19 HydrophobicContact CD2-CG2 3.5Å
18	V	33.9	Very low	39.4	Very low	115 Å²	115	142.9 Å²	142.9	70%	0.697	77%	0.773	S	S	*	*			trans	-94.7	112.8	172.2	-179.6	0	0	0	0	107.9	V20	V18-V20 HydrophobicContact CG1-CG2 4.34Å
19	V	38.2	Very low	40	Very low	120 Å²	120	146.5 Å²	146.5	73%	0.727	77%	0.771	S	S	*	*			trans	-85.1	115.4	172.7	-177.1	0	0	0	0	108.8	L17	L17-V19 HydrophobicContact CD2-CG2 3.5Å
20	V	34.3	Very low	41.1	Very low	125 Å²	125	140.3 Å²	140.3	76%	0.758	76%	0.759	S	S	*	*			trans	-99.5	117	168.7	-179.6	0	0	0	0	108	V18	V18-V20 HydrophobicContact CG1-CG2 4.34Å
21	S	40.9	Very low	41.9	Very low	102 Å²	102	139.8 Å²	139.8	71%	0.713	74%	0.74	S	S	*	*			trans	-86.2	121.4	171	66.8	0	0	0	0	110	S23	S21-S23 PolarHBondContact O-N 3.09Å
22	N	34.4	Very low	43	Very low	147 Å²	147	134.8 Å²	134.8	79%	0.786	73%	0.727	S	S	*	*			trans	-89.6	89	167	-171.3	22.7	0	0	0	107.8
23	S	43.5	Very low	44	Very low	80 Å²	80	135.2 Å²	135.2	56%	0.559	73%	0.726	S	S	*	*			trans	-96.6	119.3	166.1	69.5	0	0	0	0	108.4	S21 S25	S21-S23 PolarHBondContact O-N 3.09Å; S23-S25 PolarHBondContact O-N 3.49Å
24	N	40	Very low	44.6	Very low	158 Å²	158	137.2 Å²	137.2	85%	0.845	73%	0.725	S	S	*	*			trans	-67.9	40	165.3	-81.1	-21.9	0	0	0	111.3
25	S	43.8	Very low	45.3	Very low	58 Å²	58	129.3 Å²	129.3	41%	0.406	70%	0.699	S	S	.	*			trans	-84.1	125.9	176.8	178.2	0	0	0	0	108.5	S23 Q27	S23-S25 PolarHBondContact O-N 3.49Å; S25-Q27 PolarHBondContact O-N 3.06Å; S25-Q27 PolarHBondContact OG-OE1 2.85Å
26	T	50.9	Low	45.9	Very low	148 Å²	148	127 Å²	127	91%	0.908	70%	0.701	S	S	*	*			trans	-63.5	19	173.3	45.1	0	0	0	0	114.1	K28	T26-K28 PolarHBondContact O-N 3.01Å
27	Q	51.9	Low	47.1	Very low	131 Å²	131	126.7 Å²	126.7	61%	0.612	70%	0.698	S	S	*	*			trans	-76.2	113.4	175	-92.1	175.1	-33.7	0	0	110.1	S25 W29	S25-Q27 PolarHBondContact O-N 3.06Å; S25-Q27 PolarHBondContact OG-OE1 2.85Å; Q27-W29 PolarHBondContact O-N 3.25Å
28	K	54.8	Low	48.2	Very low	197 Å²	197	122.7 Å²	122.7	86%	0.857	68%	0.677	S	S	*	*			trans	-55.5	104.7	165.9	-77.7	-179.2	173.8	-179.2	0	108.8	T26	T26-K28 PolarHBondContact O-N 3.01Å
29	W	46.6	Very low	49.1	Very low	218 Å²	218	123 Å²	123	83%	0.826	68%	0.68	S	S	*	*	S	Bend	trans	-66.4	147.5	159.7	-97.5	81	0	0	0	109.4	Q27	Q27-W29 PolarHBondContact O-N 3.25Å
30	P	57	Low	49.9	Very low	87 Å²	87	122.8 Å²	122.8	57%	0.565	67%	0.673	S	S	*	*	S	Bend	cis	-77.1	145.4	-6.1	6.6	10.7	0	0	0	110.7	T32	P30-T32 PolarHBondContact O-N 2.98Å; P30-T32 VanDerWaalsContact O-N 3.09Å
31	N	50.3	Low	51.1	Low	60 Å²	60	120.4 Å²	120.4	32%	0.321	66%	0.656	S	S	.	*			trans	-71.5	104.2	174.7	-174.8	-6.5	0	0	0	109.1	K33 L34	N31-K33 PolarHBondContact O-N 2.84Å; N31-K33 WeakPolarHBondContact OD1-CB 3.23Å; N31-K33 PolarHBondContact OD1-N 3.48Å; N31-L34 HydrophobicContact CB-CD1 3.81Å; N31-L34 HydrophobicContact CB-CG 3.97Å; N31-L34 PolarHBondContact O-N 2.85Å
32	T	58	Low	52.1	Low	112 Å²	112	120.8 Å²	120.8	69%	0.687	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.8	-11.7	175.4	32	0	0	0	0	115.2	P30 D38	P30-T32 PolarHBondContact O-N 2.98Å; P30-T32 VanDerWaalsContact O-N 3.09Å; T32-D38 WeakPolarHBondContact CA-OD2 3.33Å; T32-D38 WeakPolarHBondContact CG2-OD2 3.41Å
33	K	61.1	Low	53.9	Low	190 Å²	190	121.7 Å²	121.7	83%	0.826	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-7.5	175.6	-72.6	-176	171.6	-177.2	0	114.5	N31 G35	N31-K33 PolarHBondContact O-N 2.84Å; N31-K33 WeakPolarHBondContact OD1-CB 3.23Å; N31-K33 PolarHBondContact OD1-N 3.48Å; K33-G35 VanDerWaalsContact C-N 3.31Å; K33-G35 PolarHBondContact O-N 3.14Å
34	L	55.2	Low	55	Low	124 Å²	124	126.1 Å²	126.1	65%	0.649	66%	0.659	S	S	*	*	S	Bend	trans	-87.9	18.4	-171.2	-71.4	178.4	0	0	0	115.7	N31	N31-L34 HydrophobicContact CB-CD1 3.81Å; N31-L34 HydrophobicContact CB-CG 3.97Å; N31-L34 PolarHBondContact O-N 2.85Å
35	G	52.9	Low	56.4	Low	40 Å²	40	122 Å²	122	41%	0.412	64%	0.641	S	S	.	*			trans	79.1	-170.9	178.1	0	0	0	0	0	112.6	K33 I37	K33-G35 VanDerWaalsContact C-N 3.31Å; K33-G35 PolarHBondContact O-N 3.14Å; G35-I37 PolarHBondContact O-N 3.15Å
36	P	53.3	Low	57.2	Low	137 Å²	137	125.6 Å²	125.6	89%	0.89	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	17.4	-139	28.4	-36.2	0	0	0	117	D38	P36-D38 PolarHBondContact O-N 3.12Å
37	I	56.5	Low	57.9	Low	161 Å²	161	125 Å²	125	83%	0.826	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-14.5	169.8	-57.4	179.2	0	0	0	110.6	G35 T39	G35-I37 PolarHBondContact O-N 3.15Å; I37-T39 PolarHBondContact O-N 3.11Å; I37-T39 VanDerWaalsContact O-N 3.11Å
38	D	53.5	Low	58.6	Low	66 Å²	66	122.4 Å²	122.4	35%	0.353	66%	0.662	S	S	.	*			trans	-85.5	85.4	178.1	-123.8	-40.6	0	0	0	113	T32 P36	T32-D38 WeakPolarHBondContact CA-OD2 3.33Å; T32-D38 WeakPolarHBondContact CG2-OD2 3.41Å; P36-D38 PolarHBondContact O-N 3.12Å
39	T	53.9	Low	59	Low	123 Å²	123	119 Å²	119	76%	0.755	65%	0.648	S	S	*	*			trans	-176.1	105.4	130.2	29.3	0	0	0	0	105	I37 N41	I37-T39 PolarHBondContact O-N 3.11Å; I37-T39 VanDerWaalsContact O-N 3.11Å; T39-N41 VanDerWaalsContact C-N 3.31Å; T39-N41 PolarHBondContact O-N 3.27Å
40	I	55.7	Low	59.6	Low	114 Å²	114	115.8 Å²	115.8	59%	0.585	65%	0.651	S	S	*	*			trans	-58.6	105.3	166.2	-62.4	170.1	0	0	0	105	P42	I40-P42 VanDerWaalsContact O-CD 3.23Å; I40-P42 WeakPolarHBondContact O-CD 3.36Å; I40-P42 VanDerWaalsContact O-N 3.13Å
41	N	58.2	Low	59.4	Low	76 Å²	76	113.5 Å²	113.5	41%	0.406	64%	0.644	S	S	.	*			trans	-63.2	117.7	175.4	-174.3	-22.1	0	0	0	106.3	T39 K43 Y44	T39-N41 VanDerWaalsContact C-N 3.31Å; T39-N41 PolarHBondContact O-N 3.27Å; N41-K43 PolarHBondContact O-N 2.95Å; N41-K43 WeakPolarHBondContact OD1-CB 3.2Å; N41-K43 PolarHBondContact OD1-N 3.09Å; N41-Y44 HydrophobicContact CB-CD2 4.35Å; N41-Y44 CarbonylContact O-C 3.36Å; N41-Y44 PolarHBondContact O-N 3.34Å
42	P	62.9	Low	59.7	Low	109 Å²	109	118.6 Å²	118.6	71%	0.708	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	-19.4	-178.2	21.6	-30.9	0	0	0	112.3	I40	I40-P42 VanDerWaalsContact O-CD 3.23Å; I40-P42 WeakPolarHBondContact O-CD 3.36Å; I40-P42 VanDerWaalsContact O-N 3.13Å
43	K	71.2	Confident	59.7	Low	166 Å²	166	117.7 Å²	117.7	72%	0.722	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-19.2	172.1	-80.2	-179.1	170.5	175.8	0	115	N41	N41-K43 PolarHBondContact O-N 2.95Å; N41-K43 WeakPolarHBondContact OD1-CB 3.2Å; N41-K43 PolarHBondContact OD1-N 3.09Å
44	Y	67.9	Low	59.4	Low	173 Å²	173	116.4 Å²	116.4	68%	0.678	67%	0.667	S	S	*	*	S	Bend	trans	-137.1	68.3	-175.3	-57	-78	0	0	0	110.3	N41 L46	N41-Y44 HydrophobicContact CB-CD2 4.35Å; N41-Y44 CarbonylContact O-C 3.36Å; N41-Y44 PolarHBondContact O-N 3.34Å; Y44-L46 PolarHBondContact O-N 3.38Å
45	P	69	Low	59.3	Low	72 Å²	72	119.1 Å²	119.1	47%	0.468	68%	0.676	S	S	.	*	P	Polyproline II helix	trans	-59.9	139.1	172.4	26	-32.5	0	0	0	109.6	F49	P45-F49 HydrophobicContact CB-CB 4.08Å
46	L	59.6	Low	59.3	Low	134 Å²	134	123.8 Å²	123.8	70%	0.702	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-61.3	141.9	173.8	-68.9	172.1	0	0	0	109.7	Y44 G48 F49	Y44-L46 PolarHBondContact O-N 3.38Å; L46-G48 PolarHBondContact O-N 2.75Å; L46-G48 VanDerWaalsContact O-N 3.15Å; L46-F49 PolarHBondContact O-N 2.91Å; L46-F49 VanDerWaalsContact O-N 3.14Å
47	P	66.9	Low	59	Low	135 Å²	135	125.2 Å²	125.2	88%	0.877	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.6	123.4	173.4	-22.5	31.4	0	0	0	110
48	G	66.7	Low	58.7	Low	77 Å²	77	125.8 Å²	125.8	79%	0.794	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	110.9	-5.8	-176	0	0	0	0	0	115.3	L46 V50	L46-G48 PolarHBondContact O-N 2.75Å; L46-G48 VanDerWaalsContact O-N 3.15Å; G48-V50 PolarHBondContact O-N 3.44Å
49	F	61.5	Low	58.5	Low	126 Å²	126	131.7 Å²	131.7	55%	0.553	71%	0.713	S	S	*	*			trans	-76.2	107.5	172.1	-161.2	-96.6	0	0	0	111.1	P45 L46	P45-F49 HydrophobicContact CB-CB 4.08Å; L46-F49 PolarHBondContact O-N 2.91Å; L46-F49 VanDerWaalsContact O-N 3.14Å
50	V	59.5	Low	58.1	Low	149 Å²	149	131.9 Å²	131.9	90%	0.903	72%	0.717	S	S	*	*			trans	-105.9	91.1	171	-173.3	0	0	0	0	107.5	G48	G48-V50 PolarHBondContact O-N 3.44Å
51	G	52.7	Low	57.8	Low	40 Å²	40	135.8 Å²	135.8	41%	0.412	73%	0.73	S	S	.	*			trans	-166.4	131.6	178.5	0	0	0	0	0	110.6	P53	G51-P53 WeakPolarHBondContact O-CD 2.94Å
52	I	57.8	Low	57.4	Low	167 Å²	167	141.4 Å²	141.4	86%	0.856	75%	0.754	S	S	*	*			trans	-69.4	117.2	177.4	-49	168.5	0	0	0	107.1	L54	I52-L54 PolarHBondContact O-N 3.2Å
53	P	57.5	Low	57.1	Low	93 Å²	93	144.2 Å²	144.2	60%	0.604	76%	0.755	S	S	*	*			trans	-71.1	125.4	172.8	-6.2	22.9	0	0	0	108.1	G51 E55	G51-P53 WeakPolarHBondContact O-CD 2.94Å; P53-E55 PolarHBondContact O-N 2.89Å
54	L	54.3	Low	56.1	Low	162 Å²	162	146 Å²	146	85%	0.848	76%	0.763	S	S	*	*			trans	-75.2	109.8	165.1	-75.8	162.3	0	0	0	107.2	I52 N56	I52-L54 PolarHBondContact O-N 3.2Å; L54-N56 PolarHBondContact O-N 2.82Å; L54-N56 VanDerWaalsContact O-N 3.09Å
55	E	54.4	Low	55.5	Low	181 Å²	181	148.1 Å²	148.1	85%	0.846	77%	0.771	S	S	*	*			trans	-68.4	102	169.6	-71.5	-176.9	156.4	0	0	108.4	P53	P53-E55 PolarHBondContact O-N 2.89Å
56	N	51.8	Low	54.8	Low	139 Å²	139	150.6 Å²	150.6	74%	0.743	79%	0.785	S	S	*	*			trans	-82.4	111.1	160.4	-80.1	-12.5	0	0	0	107.4	L54 E58	L54-N56 PolarHBondContact O-N 2.82Å; L54-N56 VanDerWaalsContact O-N 3.09Å; N56-E58 PolarHBondContact O-N 2.97Å
57	D	47.6	Very low	54.3	Low	166 Å²	166	148.9 Å²	148.9	89%	0.888	78%	0.782	S	S	*	*			trans	-63.7	79.5	170	-87.9	-38.9	0	0	0	110.6
58	E	50.5	Low	53.6	Low	174 Å²	174	146.1 Å²	146.1	81%	0.813	77%	0.771	S	S	*	*			trans	-96.4	110.9	163.8	-71.1	-165.9	165.5	0	0	109.5	N56	N56-E58 PolarHBondContact O-N 2.97Å
59	K	48.1	Very low	53	Low	189 Å²	189	147.4 Å²	147.4	82%	0.822	76%	0.763	S	S	*	*			trans	-51.5	131.6	176.2	-79.9	178.6	175	174.8	0	110.5	F61	K59-F61 PolarHBondContact O-N 2.8Å; K59-F61 VanDerWaalsContact O-N 3.09Å
60	P	46.6	Very low	52.5	Low	128 Å²	128	149.8 Å²	149.8	83%	0.831	78%	0.775	S	S	*	*			trans	-63.4	116	174.5	-13.7	26.3	0	0	0	109.7	E62	P60-E62 PolarHBondContact O-N 3.29Å
61	F	49.9	Very low	52.4	Low	196 Å²	196	148.8 Å²	148.8	86%	0.86	77%	0.769	S	S	*	*			trans	-72.5	120.7	161.9	-101.6	-95	0	0	0	108.2	K59 K63	K59-F61 PolarHBondContact O-N 2.8Å; K59-F61 VanDerWaalsContact O-N 3.09Å; F61-K63 PolarHBondContact O-N 3.31Å
62	E	49.3	Very low	52.3	Low	194 Å²	194	153 Å²	153	91%	0.907	78%	0.782	S	S	*	*			trans	-57.7	105.1	168.2	-81.4	-175.1	154.9	0	0	109.6	P60	P60-E62 PolarHBondContact O-N 3.29Å
63	K	55.5	Low	52.3	Low	167 Å²	167	150 Å²	150	73%	0.726	77%	0.773	S	S	*	*			trans	-83.2	116.3	166.3	-75	179.8	179.4	174.8	0	107.9	F61 Y65	F61-K63 PolarHBondContact O-N 3.31Å; K63-Y65 WeakPolarHBondContact O-CD2 3.15Å; K63-Y65 WeakPolarHBondContact O-CE2 3.44Å; K63-Y65 PolarHBondContact O-N 3.48Å; K63-Y65 VanDerWaalsContact O-N 3.12Å
64	K	51.9	Low	52.4	Low	205 Å²	205	149.6 Å²	149.6	89%	0.891	77%	0.771	S	S	*	*			trans	-60.8	113	168.1	-71.9	-177.6	178.1	-179.7	0	108.5
65	Y	55	Low	52.8	Low	216 Å²	216	147.5 Å²	147.5	85%	0.847	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-80	116.5	172.4	-63.3	-85.6	0	0	0	108.8	K63	K63-Y65 WeakPolarHBondContact O-CD2 3.15Å; K63-Y65 WeakPolarHBondContact O-CE2 3.44Å; K63-Y65 PolarHBondContact O-N 3.48Å; K63-Y65 VanDerWaalsContact O-N 3.12Å
66	T	54.5	Low	53.5	Low	124 Å²	124	147 Å²	147	76%	0.761	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-82.7	136.5	161.1	47.2	0	0	0	0	108.4	A68	T66-A68 PolarHBondContact O-N 3.4Å
67	P	47.8	Very low	54.3	Low	99 Å²	99	148 Å²	148	64%	0.643	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-60.9	128.3	178.2	24.9	-31.2	0	0	0	109.5	V69	P67-V69 HydrophobicContact CB-CG2 4.36Å; P67-V69 PolarHBondContact O-N 3.37Å
68	A	52.9	Low	55	Low	77 Å²	77	145.6 Å²	145.6	64%	0.636	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-67.6	9.4	-178.9	0	0	0	0	0	114.2	T66 H70 T71	T66-A68 PolarHBondContact O-N 3.4Å; A68-H70 VanDerWaalsContact C-N 3.26Å; A68-H70 PolarHBondContact O-N 3.19Å; A68-T71 PolarHBondContact O-N 3.37Å
69	V	53.6	Low	55.5	Low	104 Å²	104	140.6 Å²	140.6	63%	0.63	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-74.1	-14.8	-170.2	-179.8	0	0	0	0	112.7	P67	P67-V69 HydrophobicContact CB-CG2 4.36Å; P67-V69 PolarHBondContact O-N 3.37Å
70	H	52.4	Low	56.7	Low	176 Å²	176	139.4 Å²	139.4	82%	0.815	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-98.7	13.5	178.1	-70.9	-59.8	0	0	0	115	A68	A68-H70 VanDerWaalsContact C-N 3.26Å; A68-H70 PolarHBondContact O-N 3.19Å
71	T	55.5	Low	58	Low	127 Å²	127	136 Å²	136	78%	0.779	70%	0.696	S	S	*	*	S	Bend	trans	-142.4	28	177.2	-25.5	0	0	0	0	112.5	A68	A68-T71 PolarHBondContact O-N 3.37Å
72	L	51.3	Low	59.2	Low	130 Å²	130	129 Å²	129	68%	0.681	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-81.4	127.6	169.5	-71.1	167.5	0	0	0	108.5
73	P	58.5	Low	60.5	Low	103 Å²	103	122.2 Å²	122.2	67%	0.669	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-57.1	148.4	165.6	25.3	-31.2	0	0	0	108.8	I75	P73-I75 PolarHBondContact O-N 3.46Å
74	P	59.6	Low	61.6	Low	84 Å²	84	120.2 Å²	120.2	55%	0.545	65%	0.648	S	S	.	*	P	Polyproline II helix	trans	-51	137.1	-178.4	19.6	-30.9	0	0	0	110.5	E78	P74-E78 WeakPolarHBondContact CA-OE2 3.4Å; P74-E78 HydrophobicContact CB-CB 3.94Å; P74-E78 WeakPolarHBondContact CB-OE2 3.3Å
75	I	63.1	Low	62.8	Low	118 Å²	118	115.5 Å²	115.5	61%	0.605	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-58	145.8	178.8	-62.9	164.6	0	0	0	107.3	P73 E77 E78 S79	P73-I75 PolarHBondContact O-N 3.46Å; I75-E77 PolarHBondContact O-N 3.21Å; I75-E78 PolarHBondContact N-OE2 2.85Å; I75-E78 WeakPolarHBondContact O-CA 3.37Å; I75-E78 WeakPolarHBondContact O-CB 3.38Å; I75-E78 PolarHBondContact O-N 3.22Å; I75-S79 PolarHBondContact O-N 3.37Å
76	K	67.3	Low	63.8	Low	172 Å²	172	109.7 Å²	109.7	75%	0.748	62%	0.616	S	S	*	*	H	α-helix	trans	-46.3	-39.3	-173.7	-68.9	-174.9	179.2	-177.8	0	112.8	S79 Y80	K76-S79 WeakPolarHBondContact O-CB 3.44Å; K76-S79 PolarHBondContact O-N 2.81Å; K76-Y80 HydrophobicContact CB-CE2 4.41Å; K76-Y80 WeakPolarHBondContact O-CD2 3.42Å; K76-Y80 PolarHBondContact O-N 2.97Å; K76-Y80 VanDerWaalsContact O-N 3.08Å
77	E	68.5	Low	64.7	Low	160 Å²	160	107 Å²	107	75%	0.748	60%	0.599	S	S	*	*	H	α-helix	trans	-61.6	-40.9	176.3	-68.3	178.5	176	0	0	114.1	I75 S79 Y80 A81	I75-E77 PolarHBondContact O-N 3.21Å; E77-S79 VanDerWaalsContact C-N 3.32Å; E77-S79 PolarHBondContact O-N 2.94Å; E77-Y80 PolarHBondContact O-N 3.11Å; E77-A81 PolarHBondContact O-N 3.28Å
78	E	63.2	Low	65.8	Low	114 Å²	114	109.5 Å²	109.5	53%	0.533	60%	0.597	S	S	.	*	H	α-helix	trans	-67.2	-34.8	175.1	-66	179	156.4	0	0	111.4	P74 I75 Y80 A81 A82	P74-E78 WeakPolarHBondContact CA-OE2 3.4Å; P74-E78 HydrophobicContact CB-CB 3.94Å; P74-E78 WeakPolarHBondContact CB-OE2 3.3Å; I75-E78 PolarHBondContact N-OE2 2.85Å; I75-E78 WeakPolarHBondContact O-CA 3.37Å; I75-E78 WeakPolarHBondContact O-CB 3.38Å; I75-E78 PolarHBondContact O-N 3.22Å; E78-Y80 VanDerWaalsContact C-N 3.35Å; E78-A81 PolarHBondContact O-N 3.5Å; E78-A82 VanDerWaalsContact O-CB 3.3Å; E78-A82 WeakPolarHBondContact O-CB 3.38Å; E78-A82 PolarHBondContact O-N 3.25Å
79	S	62	Low	66.7	Low	69 Å²	69	110 Å²	110	48%	0.483	59%	0.589	S	S	.	*	H	α-helix	trans	-64.6	-39.6	173.9	-171.9	0	0	0	0	111.7	I75 K76 E77 A83	I75-S79 PolarHBondContact O-N 3.37Å; K76-S79 WeakPolarHBondContact O-CB 3.44Å; K76-S79 PolarHBondContact O-N 2.81Å; E77-S79 VanDerWaalsContact C-N 3.32Å; E77-S79 PolarHBondContact O-N 2.94Å; S79-A83 VanDerWaalsContact O-CB 3.3Å; S79-A83 WeakPolarHBondContact O-CB 3.5Å; S79-A83 PolarHBondContact O-N 3.33Å
80	Y	71.8	Confident	67.1	Low	165 Å²	165	112 Å²	112	65%	0.647	59%	0.591	S	S	*	*	H	α-helix	trans	-68	-43.7	174	-74.3	-71.7	0	0	0	111.3	K76 E77 E78 A82 A83 L84	K76-Y80 HydrophobicContact CB-CE2 4.41Å; K76-Y80 WeakPolarHBondContact O-CD2 3.42Å; K76-Y80 PolarHBondContact O-N 2.97Å; K76-Y80 VanDerWaalsContact O-N 3.08Å; E77-Y80 PolarHBondContact O-N 3.11Å; E78-Y80 VanDerWaalsContact C-N 3.35Å; Y80-A82 PolarHBondContact O-N 3.4Å; Y80-A83 PolarHBondContact O-N 2.95Å; Y80-L84 WeakPolarHBondContact O-CB 2.99Å; Y80-L84 VanDerWaalsContact O-CG 3.31Å; Y80-L84 WeakPolarHBondContact O-CG 3.46Å; Y80-L84 PolarHBondContact O-N 3.11Å
81	A	75.3	Confident	67.4	Low	57 Å²	57	106.8 Å²	106.8	47%	0.471	57%	0.566	S	S	.	*	H	α-helix	trans	-61.6	-43.7	177.5	0	0	0	0	0	111.9	E77 E78 L84 L85	E77-A81 PolarHBondContact O-N 3.28Å; E78-A81 PolarHBondContact O-N 3.5Å; A81-L84 PolarHBondContact O-N 3.08Å; A81-L85 WeakPolarHBondContact O-CB 3.36Å; A81-L85 PolarHBondContact O-N 3.23Å
82	A	74.7	Confident	67.4	Low	49 Å²	49	108 Å²	108	41%	0.405	56%	0.563	S	S	.	*	H	α-helix	trans	-65.5	-40.5	175.9	0	0	0	0	0	112	E78 Y80 L85 N86	E78-A82 VanDerWaalsContact O-CB 3.3Å; E78-A82 WeakPolarHBondContact O-CB 3.38Å; E78-A82 PolarHBondContact O-N 3.25Å; Y80-A82 PolarHBondContact O-N 3.4Å; A82-L85 PolarHBondContact O-N 2.83Å; A82-N86 WeakPolarHBondContact O-CB 3.47Å; A82-N86 PolarHBondContact O-N 3.29Å; A82-N86 PolarHBondContact O-ND2 2.99Å
83	A	76.3	Confident	67.5	Low	51 Å²	51	111.3 Å²	111.3	42%	0.421	57%	0.572	S	S	.	*	H	α-helix	trans	-61.8	-44.6	174.3	0	0	0	0	0	111.6	S79 Y80 N86 V87	S79-A83 VanDerWaalsContact O-CB 3.3Å; S79-A83 WeakPolarHBondContact O-CB 3.5Å; S79-A83 PolarHBondContact O-N 3.33Å; Y80-A83 PolarHBondContact O-N 2.95Å; A83-N86 PolarHBondContact O-N 3.32Å; A83-V87 VanDerWaalsContact O-CG2 3.25Å; A83-V87 WeakPolarHBondContact O-CG2 3.21Å; A83-V87 PolarHBondContact O-N 3.36Å
84	L	77.4	Confident	67.2	Low	124 Å²	124	109.3 Å²	109.3	65%	0.649	56%	0.561	S	S	*	*	H	α-helix	trans	-63.9	-41.3	176	-70.9	174.6	0	0	0	112.1	Y80 A81 V87 Y88	Y80-L84 WeakPolarHBondContact O-CB 2.99Å; Y80-L84 VanDerWaalsContact O-CG 3.31Å; Y80-L84 WeakPolarHBondContact O-CG 3.46Å; Y80-L84 PolarHBondContact O-N 3.11Å; A81-L84 PolarHBondContact O-N 3.08Å; L84-V87 PolarHBondContact O-N 2.87Å; L84-Y88 WeakPolarHBondContact O-CB 3.39Å; L84-Y88 PolarHBondContact O-N 3.47Å
85	L	78.6	Confident	66.5	Low	107 Å²	107	115.2 Å²	115.2	56%	0.56	58%	0.581	S	S	*	*	H	α-helix	trans	-66.8	-39.6	178	-147	87.7	0	0	0	111.6	A81 A82 Y88 N89	A81-L85 WeakPolarHBondContact O-CB 3.36Å; A81-L85 PolarHBondContact O-N 3.23Å; A82-L85 PolarHBondContact O-N 2.83Å; L85-Y88 PolarHBondContact O-N 3.34Å; L85-N89 WeakPolarHBondContact O-CB 3.31Å; L85-N89 PolarHBondContact O-N 3.34Å; L85-N89 PolarHBondContact O-ND2 2.8Å
86	N	75.7	Confident	65.8	Low	93 Å²	93	113.9 Å²	113.9	50%	0.497	58%	0.582	S	S	.	*	H	α-helix	trans	-64.3	-44.8	174.9	-71.4	-14.9	0	0	0	110.9	A82 A83 Y88 N89 E90	A82-N86 WeakPolarHBondContact O-CB 3.47Å; A82-N86 PolarHBondContact O-N 3.29Å; A82-N86 PolarHBondContact O-ND2 2.99Å; A83-N86 PolarHBondContact O-N 3.32Å; N86-Y88 VanDerWaalsContact C-N 3.26Å; N86-Y88 PolarHBondContact O-N 3.48Å; N86-N89 PolarHBondContact O-N 3.15Å; N86-E90 VanDerWaalsContact O-CB 3.31Å; N86-E90 WeakPolarHBondContact O-CB 3.38Å; N86-E90 VanDerWaalsContact O-CG 3.31Å; N86-E90 WeakPolarHBondContact O-CG 3.31Å; N86-E90 PolarHBondContact O-N 2.84Å
87	V	72.7	Confident	64.8	Low	69 Å²	69	117.2 Å²	117.2	42%	0.418	59%	0.59	S	S	.	*	H	α-helix	trans	-61.4	-35.8	174.3	171.3	0	0	0	0	111.5	A83 L84 K91	A83-V87 VanDerWaalsContact O-CG2 3.25Å; A83-V87 WeakPolarHBondContact O-CG2 3.21Å; A83-V87 PolarHBondContact O-N 3.36Å; L84-V87 PolarHBondContact O-N 2.87Å; V87-K91 WeakPolarHBondContact O-CB 2.89Å; V87-K91 PolarHBondContact O-N 3.35Å
88	Y	70.9	Confident	63.7	Low	151 Å²	151	113.7 Å²	113.7	59%	0.592	58%	0.581	S	S	*	*	H	α-helix	trans	-70.4	-45	176.7	-156.2	-89.5	0	0	0	112	L84 L85 N86 K91 E92	L84-Y88 WeakPolarHBondContact O-CB 3.39Å; L84-Y88 PolarHBondContact O-N 3.47Å; L85-Y88 PolarHBondContact O-N 3.34Å; N86-Y88 VanDerWaalsContact C-N 3.26Å; N86-Y88 PolarHBondContact O-N 3.48Å; Y88-K91 WeakPolarHBondContact O-CB 3.24Å; Y88-K91 PolarHBondContact O-N 3Å; Y88-E92 PolarHBondContact O-N 3.44Å
89	N	71.6	Confident	62.6	Low	88 Å²	88	112.4 Å²	112.4	47%	0.471	58%	0.584	S	S	.	*	H	α-helix	trans	-71	-36.8	-179.7	-70.4	-16.8	0	0	0	112.4	L85 N86 K91 E92	L85-N89 WeakPolarHBondContact O-CB 3.31Å; L85-N89 PolarHBondContact O-N 3.34Å; L85-N89 PolarHBondContact O-ND2 2.8Å; N86-N89 PolarHBondContact O-N 3.15Å; N89-K91 PolarHBondContact O-N 2.76Å; N89-E92 PolarHBondContact O-N 2.7Å
90	E	63.5	Low	62.3	Low	144 Å²	144	114.8 Å²	114.8	67%	0.673	59%	0.591	S	S	*	*	H	α-helix	trans	-64.7	-28.7	172.1	-75.2	179.6	176	0	0	111.4	N86	N86-E90 VanDerWaalsContact O-CB 3.31Å; N86-E90 WeakPolarHBondContact O-CB 3.38Å; N86-E90 VanDerWaalsContact O-CG 3.31Å; N86-E90 WeakPolarHBondContact O-CG 3.31Å; N86-E90 PolarHBondContact O-N 2.84Å
91	K	57.3	Low	61.3	Low	67 Å²	67	113.1 Å²	113.1	29%	0.291	59%	0.592	S	S	.	*	H	α-helix	trans	-75.3	-20.9	176.6	-108.4	-176.5	174	-163.4	0	115.2	V87 Y88 N89 F93 P98 I100	V87-K91 WeakPolarHBondContact O-CB 2.89Å; V87-K91 PolarHBondContact O-N 3.35Å; Y88-K91 WeakPolarHBondContact O-CB 3.24Å; Y88-K91 PolarHBondContact O-N 3Å; N89-K91 PolarHBondContact O-N 2.76Å; K91-F93 VanDerWaalsContact C-N 3.28Å; K91-F93 PolarHBondContact O-N 2.66Å; K91-P98 WeakPolarHBondContact CE-O 3.43Å; K91-P98 PolarHBondContact NZ-O 3.24Å; K91-I100 HydrophobicContact CD-CD1 3.83Å; K91-I100 HydrophobicContact CD-CG1 4.36Å
92	E	55.9	Low	60	Low	152 Å²	152	115.2 Å²	115.2	71%	0.71	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-6.4	176.8	-75.9	-155.8	152.9	0	0	113.5	Y88 N89	Y88-E92 PolarHBondContact O-N 3.44Å; N89-E92 PolarHBondContact O-N 2.7Å
93	F	53.9	Low	58.6	Low	200 Å²	200	118.2 Å²	118.2	88%	0.877	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.4	9.1	-178	-138.4	-97.7	0	0	0	115.5	K91	K91-F93 VanDerWaalsContact C-N 3.28Å; K91-F93 PolarHBondContact O-N 2.66Å
94	S	51	Low	57.6	Low	62 Å²	62	122.6 Å²	122.6	43%	0.434	63%	0.631	S	S	.	*			trans	-139	107.8	175.6	64.7	0	0	0	0	112	S96	S94-S96 PolarHBondContact O-N 2.73Å
95	E	45.4	Very low	56.7	Low	208 Å²	208	119.4 Å²	119.4	97%	0.972	62%	0.619	S	S	*	*	S	Bend	trans	-66.8	72.3	170.3	-71.1	-174.7	151.6	0	0	111.6
96	S	49.2	Very low	56.2	Low	90 Å²	90	120.5 Å²	120.5	63%	0.629	63%	0.625	S	S	*	*	S	Bend	trans	-168.8	96.6	161.6	53.9	0	0	0	0	107.6	S94 P98	S94-S96 PolarHBondContact O-N 2.73Å; S96-P98 WeakPolarHBondContact O-CD 3.31Å
97	R	46.2	Very low	56.2	Low	242 Å²	242	119.4 Å²	119.4	91%	0.913	62%	0.617	S	S	*	*			trans	-63.3	114.5	-177.8	-74.5	175.5	170.6	-177.9	-3.2	111
98	P	44.4	Very low	56.7	Low	86 Å²	86	119.7 Å²	119.7	56%	0.558	61%	0.613	S	S	*	*			trans	-81	135.4	149.5	21.8	-5.5	0	0	0	107.7	K91 S96 I100	K91-P98 WeakPolarHBondContact CE-O 3.43Å; K91-P98 PolarHBondContact NZ-O 3.24Å; S96-P98 WeakPolarHBondContact O-CD 3.31Å; P98-I100 PolarHBondContact O-N 3.18Å
99	S	40.6	Very low	57.3	Low	86 Å²	86	115 Å²	115	60%	0.601	60%	0.596	S	S	*	*			trans	-57.7	130.1	170.9	58.1	0	0	0	0	108.9	I101	S99-I101 PolarHBondContact O-N 3.24Å; S99-I101 PolarHBondContact OG-O 3.5Å
100	I	56.2	Low	58	Low	120 Å²	120	112.5 Å²	112.5	62%	0.615	59%	0.586	S	S	*	*	S	Bend	trans	-70.3	-14.8	172.8	-75	151.9	0	0	0	110.7	K91 P98 P102	K91-I100 HydrophobicContact CD-CD1 3.83Å; K91-I100 HydrophobicContact CD-CG1 4.36Å; P98-I100 PolarHBondContact O-N 3.18Å; I100-P102 WeakPolarHBondContact O-CD 3.28Å
101	I	49.7	Very low	59	Low	129 Å²	129	106.9 Å²	106.9	66%	0.662	56%	0.561	S	S	*	*	S	Bend	trans	-83	117	170.6	-49.6	172.6	0	0	0	106	S99	S99-I101 PolarHBondContact O-N 3.24Å; S99-I101 PolarHBondContact OG-O 3.5Å
102	P	48	Very low	60.5	Low	102 Å²	102	105.9 Å²	105.9	66%	0.662	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-54.4	132	168.5	22.8	-30	0	0	0	107	I100 I104	I100-P102 WeakPolarHBondContact O-CD 3.28Å; P102-I104 PolarHBondContact O-N 2.91Å; P102-I104 VanDerWaalsContact O-N 3.08Å
103	P	45.8	Very low	62	Low	111 Å²	111	101.8 Å²	101.8	72%	0.721	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-53.3	125.9	175.6	22.7	-31.2	0	0	0	107.3	S105	P103-S105 PolarHBondContact O-N 3.09Å
104	I	55.4	Low	63.5	Low	143 Å²	143	95.2 Å²	95.2	73%	0.733	52%	0.516	S	S	*	.			trans	-52.7	110.5	171.8	-61.3	166.7	0	0	0	104.3	P102 D106	P102-I104 PolarHBondContact O-N 2.91Å; P102-I104 VanDerWaalsContact O-N 3.08Å; I104-D106 PolarHBondContact O-N 3.04Å
105	S	59.1	Low	65.2	Low	58 Å²	58	92.4 Å²	92.4	41%	0.406	50%	0.496	S	S	.	.			trans	-59.5	128.8	-175.6	-175.7	0	0	0	0	107	P103 Q107 F108	P103-S105 PolarHBondContact O-N 3.09Å; S105-Q107 PolarHBondContact O-N 3.12Å; S105-F108 PolarHBondContact O-N 3.07Å
106	D	68.2	Low	67	Low	130 Å²	130	85.1 Å²	85.1	70%	0.695	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-1	176.8	-84.8	-40.1	0	0	0	113.6	I104 W236	I104-D106 PolarHBondContact O-N 3.04Å; D106-W236 WeakPolarHBondContact O-CZ2 3.5Å
107	Q	74.7	Confident	68.5	Low	69 Å²	69	85.6 Å²	85.6	32%	0.322	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-8.3	175.9	-57.5	176.5	18.7	0	0	113.5	S105 R144 H145	S105-Q107 PolarHBondContact O-N 3.12Å; Q107-R144 CarbonylContact O-C 3.58Å; Q107-R144 VanDerWaalsContact O-CA 3.26Å; Q107-R144 WeakPolarHBondContact O-CA 3.49Å; Q107-R144 WeakPolarHBondContact O-CG 3.46Å; Q107-H145 HydrophobicContact CB-CB 4.11Å; Q107-H145 PolarHBondContact O-N 3.07Å
108	F	82.9	Confident	70	Confident	75 Å²	75	79.9 Å²	79.9	33%	0.329	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	136.2	-177.7	179.3	-97.9	0	0	0	111.4	S105 C110 L142 S143 R144	S105-F108 PolarHBondContact O-N 3.07Å; F108-C110 HydrophobicContact CE1-CB 4.25Å; F108-L142 HydrophobicContact CE2-CB 4.12Å; F108-L142 HydrophobicContact CZ-CB 4.32Å; F108-L142 HydrophobicContact CZ-CD1 4.38Å; F108-L142 HydrophobicContact CZ-CD2 3.92Å; F108-L142 HydrophobicContact CZ-CG 4.44Å; F108-S143 WeakPolarHBondContact CA-O 3.49Å; F108-R144 HydrophobicContact CD2-CB 4.45Å
109	E	84.3	Confident	71.7	Confident	53 Å²	53	76 Å²	76	25%	0.248	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	135.9	179.1	-179.1	173	171.5	0	0	109.8	T111 S143 Y233 W236	E109-T111 HydrophobicContact CG-CG2 4.08Å; E109-S143 WeakPolarHBondContact CB-OG 3.35Å; E109-S143 PolarHBondContact N-O 3.1Å; E109-S143 PolarHBondContact O-N 2.92Å; E109-S143 PolarHBondContact O-OG 3.02Å; E109-Y233 PolarHBondContact OE1-OH 3.11Å; E109-Y233 VanDerWaalsContact OE2-CE1 3.28Å; E109-Y233 WeakPolarHBondContact OE2-CE1 3.1Å; E109-Y233 PolarHBondContact OE2-OH 2.99Å; E109-W236 HydrophobicContact CB-CH2 3.69Å; E109-W236 HydrophobicContact CB-CZ2 4.47Å; E109-W236 HydrophobicContact CB-CZ3 4.35Å
110	C	86	Confident	73.7	Confident	36 Å²	36	73.2 Å²	73.2	24%	0.243	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	119.5	175.4	177.4	0	0	0	0	107.5	F108 I141 L142	F108-C110 HydrophobicContact CE1-CB 4.25Å; C110-I141 WeakPolarHBondContact CA-O 3.33Å; C110-L142 HydrophobicContact CB-CD2 3.7Å; C110-L142 WeakPolarHBondContact SG-CD2 3.36Å
111	T	85.6	Confident	74.8	Confident	25 Å²	25	73.5 Å²	73.5	15%	0.153	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	142	174	69.4	0	0	0	0	110.5	E109 H113 L140 I141	E109-T111 HydrophobicContact CG-CG2 4.08Å; T111-H113 WeakPolarHBondContact CB-NE2 3.09Å; T111-H113 PolarHBondContact OG1-CD2 3.47Å; T111-H113 PolarHBondContact OG1-NE2 2.92Å; T111-H113 VanDerWaalsContact OG1-NE2 3.11Å; T111-L140 WeakPolarHBondContact O-CA 3.42Å; T111-I141 PolarHBondContact N-O 2.87Å; T111-I141 PolarHBondContact O-N 2.74Å
112	I	87.8	Confident	76.1	Confident	46 Å²	46	69.3 Å²	69.3	24%	0.236	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	124.2	-176.5	-55.4	166.3	0	0	0	107.7	T138 A139 L140 D251 L256	I112-T138 HydrophobicContact CG2-CG2 3.46Å; I112-T138 VanDerWaalsContact CG2-CG2 3.46Å; I112-A139 WeakPolarHBondContact CA-O 3.3Å; I112-L140 HydrophobicContact CG1-CG 4.24Å; I112-D251 HydrophobicContact CG2-CB 4.35Å; I112-L256 HydrophobicContact CD1-CB 4.05Å; I112-L256 VanDerWaalsContact CD1-O 3.24Å; I112-L256 WeakPolarHBondContact CD1-O 3.33Å; I112-L256 HydrophobicContact CG2-CD1 4.35Å
113	H	86.6	Confident	77.7	Confident	66 Å²	66	64.5 Å²	64.5	31%	0.306	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	129.1	-175.9	-62.7	-74.5	0	0	0	111.3	T111 C115 T138 A139 F218	T111-H113 WeakPolarHBondContact CB-NE2 3.09Å; T111-H113 PolarHBondContact OG1-CD2 3.47Å; T111-H113 PolarHBondContact OG1-NE2 2.92Å; T111-H113 VanDerWaalsContact OG1-NE2 3.11Å; H113-C115 PolarHBondContact O-N 3.28Å; H113-T138 WeakPolarHBondContact O-CA 3.23Å; H113-A139 PolarHBondContact N-O 2.97Å; H113-A139 PolarHBondContact O-N 2.81Å; H113-F218 HydrophobicContact CB-CD1 3.81Å; H113-F218 HydrophobicContact CB-CE1 4.12Å
114	T	87.3	Confident	79.4	Confident	63 Å²	63	60.8 Å²	60.8	39%	0.387	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	121.6	164.3	-70.5	0	0	0	0	109.2	P116 D251	T114-P116 WeakPolarHBondContact O-CD 3.31Å; T114-D251 VanDerWaalsContact OG1-CG 3.23Å; T114-D251 PolarHBondContact OG1-OD2 2.85Å
115	C	85.2	Confident	80.5	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.014	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-67.4	125.4	-176.9	-62.5	0	0	0	0	111	H113 Q120 L137	H113-C115 PolarHBondContact O-N 3.28Å; C115-Q120 HydrophobicContact CB-CG 3.87Å; C115-Q120 PolarHBondContact O-NE2 3.32Å; C115-L137 HydrophobicContact CB-CB 4.2Å; C115-L137 WeakPolarHBondContact CB-O 3.28Å; C115-L137 PolarHBondContact N-O 2.97Å; C115-L137 PolarHBondContact SG-O 2.87Å
116	P	83.3	Confident	81.6	Confident	56 Å²	56	56.8 Å²	56.8	36%	0.364	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-57.9	151.3	170.9	-23.2	33.1	0	0	0	111.8	T114 L118 V119 Q120	T114-P116 WeakPolarHBondContact O-CD 3.31Å; P116-L118 PolarHBondContact O-N 3.36Å; P116-L118 VanDerWaalsContact O-N 3.13Å; P116-V119 HydrophobicContact CB-CG2 4.31Å; P116-V119 HydrophobicContact CG-CG2 4.25Å; P116-V119 PolarHBondContact O-N 2.64Å; P116-Q120 PolarHBondContact O-N 3.1Å
117	V	81.5	Confident	82.2	Confident	100 Å²	100	50.9 Å²	50.9	61%	0.606	28%	0.279	S	S	*	.	H	α-helix	trans	-54.3	-37.1	-178.3	179.4	0	0	0	0	112.4	Q120 Q121	V117-Q120 PolarHBondContact O-N 2.94Å; V117-Q121 PolarHBondContact O-N 3.32Å
118	L	77.8	Confident	82.1	Confident	122 Å²	122	51 Å²	51	64%	0.639	29%	0.286	S	S	*	.	H	α-helix	trans	-62.8	-42.7	176.7	-65.8	174.5	0	0	0	112.2	P116 Q121 A122	P116-L118 PolarHBondContact O-N 3.36Å; P116-L118 VanDerWaalsContact O-N 3.13Å; L118-Q121 PolarHBondContact O-N 3.17Å; L118-A122 PolarHBondContact O-N 2.98Å
119	V	80.4	Confident	81.4	Confident	3 Å²	3	51.4 Å²	51.4	2%	0.018	30%	0.298	C	S	.	.	H	α-helix	trans	-68.4	-38.4	177.8	-178.9	0	0	0	0	110.2	P116 Q121 A122 L123 H217 F218	P116-V119 HydrophobicContact CB-CG2 4.31Å; P116-V119 HydrophobicContact CG-CG2 4.25Å; P116-V119 PolarHBondContact O-N 2.64Å; V119-Q121 VanDerWaalsContact C-N 3.25Å; V119-Q121 PolarHBondContact O-N 2.83Å; V119-A122 PolarHBondContact O-N 3.23Å; V119-A122 VanDerWaalsContact O-N 3.15Å; V119-L123 HydrophobicContact CG1-CD1 3.8Å; V119-L123 HydrophobicContact CG1-CG 4.13Å; V119-L123 VanDerWaalsContact O-CG 3.29Å; V119-L123 WeakPolarHBondContact O-CG 3.45Å; V119-L123 PolarHBondContact O-N 3.24Å; V119-H217 HydrophobicContact CG2-CB 3.87Å; V119-F218 HydrophobicContact CG1-CZ 4.05Å
120	Q	81.4	Confident	80.7	Confident	28 Å²	28	51 Å²	51	13%	0.131	29%	0.294	C	S	.	.	H	α-helix	trans	-59.7	-35.4	175.9	-64.9	178.1	26.1	0	0	112.6	C115 P116 V117 L123 A124 L137	C115-Q120 HydrophobicContact CB-CG 3.87Å; C115-Q120 PolarHBondContact O-NE2 3.32Å; P116-Q120 PolarHBondContact O-N 3.1Å; V117-Q120 PolarHBondContact O-N 2.94Å; Q120-L123 PolarHBondContact O-N 3.35Å; Q120-A124 WeakPolarHBondContact O-CB 3.48Å; Q120-A124 PolarHBondContact O-N 3.42Å; Q120-L137 HydrophobicContact CG-CB 4.15Å
121	Q	79	Confident	79.8	Confident	126 Å²	126	57.8 Å²	57.8	59%	0.589	32%	0.32	S	S	*	.	H	α-helix	trans	-67	-41.7	175.4	-70.2	178.4	-8.8	0	0	112.1	V117 L118 V119 A124	V117-Q121 PolarHBondContact O-N 3.32Å; L118-Q121 PolarHBondContact O-N 3.17Å; V119-Q121 VanDerWaalsContact C-N 3.25Å; V119-Q121 PolarHBondContact O-N 2.83Å; Q121-A124 WeakPolarHBondContact O-CB 3.38Å; Q121-A124 PolarHBondContact O-N 2.76Å
122	A	78.9	Confident	79	Confident	41 Å²	41	56.9 Å²	56.9	34%	0.339	31%	0.314	S	S	.	.	H	α-helix	trans	-63.6	-44.5	174.4	0	0	0	0	0	111.2	L118 V119 A124 N125 T214	L118-A122 PolarHBondContact O-N 2.98Å; V119-A122 PolarHBondContact O-N 3.23Å; V119-A122 VanDerWaalsContact O-N 3.15Å; A122-A124 VanDerWaalsContact C-N 3.27Å; A122-A124 PolarHBondContact O-N 2.96Å; A122-N125 WeakPolarHBondContact O-CB 3.32Å; A122-N125 PolarHBondContact O-N 3.38Å; A122-T214 HydrophobicContact CB-CG2 4.34Å
123	L	80.5	Confident	77.7	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-66.9	-25	178	-65.9	173.4	0	0	0	113.1	V119 Q120 N125 V126 F127 L132 L137 L208 F246	V119-L123 HydrophobicContact CG1-CD1 3.8Å; V119-L123 HydrophobicContact CG1-CG 4.13Å; V119-L123 VanDerWaalsContact O-CG 3.29Å; V119-L123 WeakPolarHBondContact O-CG 3.45Å; V119-L123 PolarHBondContact O-N 3.24Å; Q120-L123 PolarHBondContact O-N 3.35Å; L123-N125 PolarHBondContact O-N 3.46Å; L123-V126 PolarHBondContact O-N 2.84Å; L123-F127 HydrophobicContact CB-CD2 4.36Å; L123-F127 HydrophobicContact CD2-CE2 4.27Å; L123-F127 WeakPolarHBondContact O-CD2 3.46Å; L123-F127 PolarHBondContact O-N 2.89Å; L123-L132 HydrophobicContact CB-CD1 3.99Å; L123-L137 HydrophobicContact CB-CD2 4.49Å; L123-L137 HydrophobicContact CD1-CD2 3.54Å; L123-L208 HydrophobicContact CD2-CD1 4.42Å; L123-L208 HydrophobicContact CD2-CD2 3.65Å; L123-F246 HydrophobicContact CD1-CD1 3.82Å; L123-F246 HydrophobicContact CD1-CE1 3.41Å; L123-F246 VanDerWaalsContact CD1-CE1 3.41Å; L123-F246 HydrophobicContact CD1-CZ 4.04Å; L123-F246 HydrophobicContact CD2-CE1 3.96Å; L123-F246 HydrophobicContact CD2-CE2 4.19Å; L123-F246 HydrophobicContact CD2-CZ 3.68Å; L123-F246 HydrophobicContact CG-CE1 4.35Å
124	A	80.8	Confident	76.7	Confident	33 Å²	33	64 Å²	64	27%	0.273	35%	0.353	S	S	.	.	H	α-helix	trans	-62.8	-28.2	175.3	0	0	0	0	0	112.4	Q120 Q121 A122 F127 L132	Q120-A124 WeakPolarHBondContact O-CB 3.48Å; Q120-A124 PolarHBondContact O-N 3.42Å; Q121-A124 WeakPolarHBondContact O-CB 3.38Å; Q121-A124 PolarHBondContact O-N 2.76Å; A122-A124 VanDerWaalsContact C-N 3.27Å; A122-A124 PolarHBondContact O-N 2.96Å; A124-F127 CarbonylContact O-C 3.57Å; A124-L132 HydrophobicContact CB-CB 4.49Å; A124-L132 HydrophobicContact CB-CD1 4.24Å
125	N	79.2	Confident	76.2	Confident	111 Å²	111	67 Å²	67	59%	0.594	36%	0.361	S	S	*	.	H	α-helix	trans	-75.8	-31.6	173.6	-62.6	-31.7	0	0	0	112.2	A122 L123 A206	A122-N125 WeakPolarHBondContact O-CB 3.32Å; A122-N125 PolarHBondContact O-N 3.38Å; L123-N125 PolarHBondContact O-N 3.46Å; N125-A206 HydrophobicContact CB-CB 4.08Å
126	V	81.6	Confident	76	Confident	7 Å²	7	70.6 Å²	70.6	4%	0.042	38%	0.384	C	S	.	.	H	α-helix	trans	-75.1	-39.7	178.3	-178.3	0	0	0	0	110.9	L123 P128 I191 P198 G204 A206 L208	L123-V126 PolarHBondContact O-N 2.84Å; V126-P128 WeakPolarHBondContact O-CD 3.39Å; V126-I191 HydrophobicContact CG1-CD1 3.93Å; V126-P198 HydrophobicContact CG1-CG 3.96Å; V126-P198 VanDerWaalsContact O-CG 3.25Å; V126-P198 WeakPolarHBondContact O-CG 3.3Å; V126-G204 PolarHBondContact O-N 3.08Å; V126-A206 HydrophobicContact CG2-CB 3.99Å; V126-L208 HydrophobicContact CG1-CB 4.28Å; V126-L208 HydrophobicContact CG2-CB 4.27Å
127	F	81.5	Confident	76.2	Confident	5 Å²	5	68 Å²	68	2%	0.022	37%	0.367	C	S	.	.			trans	-112.5	65.1	178.9	-57.2	-80.1	0	0	0	111.4	L123 A124 S129 R130 W187 D189 I191 P198 F246	L123-F127 HydrophobicContact CB-CD2 4.36Å; L123-F127 HydrophobicContact CD2-CE2 4.27Å; L123-F127 WeakPolarHBondContact O-CD2 3.46Å; L123-F127 PolarHBondContact O-N 2.89Å; A124-F127 CarbonylContact O-C 3.57Å; F127-S129 PolarHBondContact O-N 2.98Å; F127-S129 VanDerWaalsContact O-N 3.09Å; F127-R130 PolarHBondContact O-N 3.28Å; F127-W187 HydrophobicContact CB-CZ2 4.5Å; F127-W187 AromaticContact CD1-CH2 3.98Å; F127-W187 HydrophobicContact CD1-CH2 3.98Å; F127-W187 AromaticContact CD1-CZ2 3.86Å; F127-W187 HydrophobicContact CD1-CZ2 3.86Å; F127-W187 HydrophobicContact CD2-CH2 4.36Å; F127-W187 HydrophobicContact CE1-CH2 4.18Å; F127-W187 HydrophobicContact CE1-CZ2 4.28Å; F127-W187 HydrophobicContact CG-CH2 4.07Å; F127-W187 HydrophobicContact CG-CZ2 4.2Å; F127-W187 HydrophobicContact CZ-CH2 4.47Å; F127-D189 HydrophobicContact CD1-CB 4.39Å; F127-D189 HydrophobicContact CE1-CB 3.82Å; F127-I191 HydrophobicContact CE1-CD1 4.33Å; F127-I191 HydrophobicContact CE2-CD1 4.24Å; F127-I191 HydrophobicContact CZ-CD1 3.6Å; F127-P198 HydrophobicContact CD1-CB 3.81Å; F127-P198 HydrophobicContact CD1-CG 3.56Å; F127-P198 HydrophobicContact CE1-CB 3.54Å; F127-P198 HydrophobicContact CE1-CG 3.53Å; F127-P198 HydrophobicContact CG-CG 4.38Å; F127-P198 HydrophobicContact CZ-CG 4.31Å; F127-F246 AromaticContact CE2-CD2 3.72Å; F127-F246 HydrophobicContact CE2-CD2 3.72Å; F127-F246 HydrophobicContact CE2-CE2 4.14Å; F127-F246 HydrophobicContact CE2-CG 4.17Å; F127-F246 AromaticContact CZ-CD2 3.64Å; F127-F246 HydrophobicContact CZ-CD2 3.64Å; F127-F246 HydrophobicContact CZ-CE2 4.23Å; F127-F246 HydrophobicContact CZ-CG 4.34Å
128	P	72.1	Confident	76.6	Confident	72 Å²	72	63.2 Å²	63.2	47%	0.468	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-22.2	-174.6	29	-37.5	0	0	0	112.9	V126 R130	V126-P128 WeakPolarHBondContact O-CD 3.39Å; P128-R130 PolarHBondContact O-N 3.16Å; P128-R130 VanDerWaalsContact O-N 3.07Å
129	S	67.7	Low	77.2	Confident	84 Å²	84	57.4 Å²	57.4	59%	0.587	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-15	175.4	-60.3	0	0	0	0	113.3	F127 A202	F127-S129 PolarHBondContact O-N 2.98Å; F127-S129 VanDerWaalsContact O-N 3.09Å; S129-A202 WeakPolarHBondContact OG-CB 3.36Å; S129-A202 PolarHBondContact OG-O 3.34Å; S129-A202 VanDerWaalsContact OG-O 3.11Å
130	R	70.8	Confident	77.6	Confident	43 Å²	43	57.2 Å²	57.2	16%	0.162	31%	0.307	C	S	.	.	S	Bend	trans	-126.3	127.4	-172.5	-161.3	163.3	-174.8	-114.9	-14	111.3	F127 P128 L132 W187 D248	F127-R130 PolarHBondContact O-N 3.28Å; P128-R130 PolarHBondContact O-N 3.16Å; P128-R130 VanDerWaalsContact O-N 3.07Å; R130-L132 HydrophobicContact CB-CD2 4.33Å; R130-L132 HydrophobicContact CB-CG 4.42Å; R130-L132 HydrophobicContact CG-CD2 4.01Å; R130-L132 HydrophobicContact CG-CG 4.48Å; R130-L132 PolarHBondContact O-N 3.07Å; R130-W187 VanDerWaalsContact CD-CD2 3.46Å; R130-D248 IonicContact CZ-OD2 3.34Å; R130-D248 IonicContact NH2-OD2 3.76Å; R130-D248 PolarHBondContact NH2-OD2 2.63Å
131	K	67.5	Low	78	Confident	179 Å²	179	55.9 Å²	55.9	78%	0.778	30%	0.301	S	S	*	.			trans	-74.6	82	166.1	-64.8	-176.6	-177	179.1	0	108.6	S133	K131-S133 PolarHBondContact O-N 2.75Å; K131-S133 VanDerWaalsContact O-N 3.12Å
132	L	67.3	Low	78.4	Confident	6 Å²	6	50.4 Å²	50.4	3%	0.031	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-63.5	-9.9	177.1	-67.2	176.1	0	0	0	113.1	L123 A124 R130 F134 L137	L123-L132 HydrophobicContact CB-CD1 3.99Å; A124-L132 HydrophobicContact CB-CB 4.49Å; A124-L132 HydrophobicContact CB-CD1 4.24Å; R130-L132 HydrophobicContact CB-CD2 4.33Å; R130-L132 HydrophobicContact CB-CG 4.42Å; R130-L132 HydrophobicContact CG-CD2 4.01Å; R130-L132 HydrophobicContact CG-CG 4.48Å; R130-L132 PolarHBondContact O-N 3.07Å; L132-F134 PolarHBondContact O-N 3.41Å; L132-L137 HydrophobicContact CD1-CD2 4.34Å; L132-L137 HydrophobicContact CD2-CD1 4.02Å; L132-L137 HydrophobicContact CD2-CD2 4.32Å
133	S	61.3	Low	78.8	Confident	87 Å²	87	48.4 Å²	48.4	61%	0.608	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-66.8	-8.8	-170.5	58.4	0	0	0	0	116.7	K131	K131-S133 PolarHBondContact O-N 2.75Å; K131-S133 VanDerWaalsContact O-N 3.12Å
134	F	65.9	Low	79	Confident	174 Å²	174	52.7 Å²	52.7	76%	0.763	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-124.4	-5.3	-171.6	-61.1	-69.8	0	0	0	115.5	L132	L132-F134 PolarHBondContact O-N 3.41Å
135	K	76.3	Confident	79.1	Confident	127 Å²	127	52.2 Å²	52.2	55%	0.552	27%	0.267	S	S	*	.	S	Bend	trans	-132.1	141.7	-177.4	-69.8	-171.8	176.1	-173	0	110.4	L137	K135-L137 PolarHBondContact O-N 3.28Å
136	P	81.9	Confident	78.9	Confident	77 Å²	77	47.6 Å²	47.6	50%	0.5	24%	0.243	S	C	.	.			trans	-58.5	137.6	171.9	27.7	-34	0	0	0	109.1
137	L	87.6	Confident	78.2	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.005	26%	0.26	C	S	.	.			trans	-108.5	136.3	174.7	-173.6	72.5	0	0	0	108	C115 Q120 L123 L132 K135 W187 F246 T247	C115-L137 HydrophobicContact CB-CB 4.2Å; C115-L137 WeakPolarHBondContact CB-O 3.28Å; C115-L137 PolarHBondContact N-O 2.97Å; C115-L137 PolarHBondContact SG-O 2.87Å; Q120-L137 HydrophobicContact CG-CB 4.15Å; L123-L137 HydrophobicContact CB-CD2 4.49Å; L123-L137 HydrophobicContact CD1-CD2 3.54Å; L132-L137 HydrophobicContact CD1-CD2 4.34Å; L132-L137 HydrophobicContact CD2-CD1 4.02Å; L132-L137 HydrophobicContact CD2-CD2 4.32Å; K135-L137 PolarHBondContact O-N 3.28Å; L137-W187 HydrophobicContact CD1-CE3 4.25Å; L137-W187 HydrophobicContact CD1-CZ3 3.64Å; L137-F246 HydrophobicContact CD1-CB 4.35Å; L137-F246 HydrophobicContact CD2-CD1 3.98Å; L137-F246 HydrophobicContact CG-CD1 4.48Å; L137-T247 WeakPolarHBondContact CD1-O 3.33Å
138	T	89.4	Confident	77.3	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	130.4	175.6	-55.3	0	0	0	0	108.6	I112 H113 L140 F246 T247 A249 D251 L256	I112-T138 HydrophobicContact CG2-CG2 3.46Å; I112-T138 VanDerWaalsContact CG2-CG2 3.46Å; H113-T138 WeakPolarHBondContact O-CA 3.23Å; T138-L140 HydrophobicContact CG2-CD1 4.32Å; T138-F246 WeakPolarHBondContact O-CA 3.46Å; T138-T247 HydrophobicContact CG2-CG2 4.36Å; T138-T247 PolarHBondContact N-O 3.15Å; T138-T247 PolarHBondContact O-N 3.19Å; T138-A249 VanDerWaalsContact CB-O 3.3Å; T138-A249 WeakPolarHBondContact CB-O 3.45Å; T138-A249 PolarHBondContact OG1-O 2.78Å; T138-D251 HydrophobicContact CG2-CB 4.33Å; T138-L256 HydrophobicContact CG2-CD1 3.98Å
139	A	89.3	Confident	76.6	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	129	170.7	0	0	0	0	0	109.2	I112 H113 F218 I245 F246	I112-A139 WeakPolarHBondContact CA-O 3.3Å; H113-A139 PolarHBondContact N-O 2.97Å; H113-A139 PolarHBondContact O-N 2.81Å; A139-F218 HydrophobicContact CB-CD1 4.46Å; A139-F218 HydrophobicContact CB-CE1 3.63Å; A139-F218 HydrophobicContact CB-CZ 3.72Å; A139-I245 CarbonylContact C-O 3.57Å; A139-I245 WeakPolarHBondContact CA-O 3.12Å; A139-F246 HydrophobicContact CB-CD1 3.94Å; A139-F246 HydrophobicContact CB-CE1 3.75Å
140	L	90.2	Very high	75.4	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	128.5	166.6	-70.8	81	0	0	0	107.4	T111 I112 T138 I245 T247 L256 I259	T111-L140 WeakPolarHBondContact O-CA 3.42Å; I112-L140 HydrophobicContact CG1-CG 4.24Å; T138-L140 HydrophobicContact CG2-CD1 4.32Å; L140-I245 HydrophobicContact CB-CB 4.1Å; L140-I245 PolarHBondContact N-O 3.38Å; L140-I245 PolarHBondContact O-N 3.48Å; L140-T247 HydrophobicContact CD1-CG2 3.57Å; L140-L256 HydrophobicContact CD1-CD2 4.04Å; L140-L256 HydrophobicContact CD2-CD2 4.06Å; L140-I259 HydrophobicContact CD2-CD1 3.7Å; L140-I259 HydrophobicContact CD2-CG2 4.33Å
141	I	88.4	Confident	74.6	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	114.9	-176	-53.5	178.1	0	0	0	107.3	C110 T111 F218 F220 V242 G243 L244	C110-I141 WeakPolarHBondContact CA-O 3.33Å; T111-I141 PolarHBondContact N-O 2.87Å; T111-I141 PolarHBondContact O-N 2.74Å; I141-F218 HydrophobicContact CD1-CB 3.25Å; I141-F218 HydrophobicContact CD1-CD1 3.81Å; I141-F218 HydrophobicContact CD1-CD2 3.69Å; I141-F218 HydrophobicContact CD1-CE2 4.48Å; I141-F218 HydrophobicContact CD1-CG 3.32Å; I141-F220 HydrophobicContact CD1-CE2 3.99Å; I141-F220 HydrophobicContact CG2-CE2 3.85Å; I141-F220 HydrophobicContact CG2-CZ 3.73Å; I141-V242 HydrophobicContact CG2-CG1 3.47Å; I141-V242 VanDerWaalsContact CG2-CG1 3.47Å; I141-G243 WeakPolarHBondContact CA-O 3.38Å; I141-L244 HydrophobicContact CG1-CD2 4.13Å; I141-L244 HydrophobicContact CG2-CD2 4.33Å
142	L	88.8	Confident	74	Confident	10 Å²	10	61 Å²	61	5%	0.052	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	106.5	178.2	-57.9	-168.8	0	0	0	107.5	F108 C110 F170 I177 V242 G243 I245	F108-L142 HydrophobicContact CE2-CB 4.12Å; F108-L142 HydrophobicContact CZ-CB 4.32Å; F108-L142 HydrophobicContact CZ-CD1 4.38Å; F108-L142 HydrophobicContact CZ-CD2 3.92Å; F108-L142 HydrophobicContact CZ-CG 4.44Å; C110-L142 HydrophobicContact CB-CD2 3.7Å; C110-L142 WeakPolarHBondContact SG-CD2 3.36Å; L142-F170 HydrophobicContact CB-CD2 4.24Å; L142-F170 HydrophobicContact CB-CE2 4.19Å; L142-F170 HydrophobicContact CD1-CD2 3.95Å; L142-F170 HydrophobicContact CD1-CE2 3.86Å; L142-F170 HydrophobicContact CG-CE2 4.21Å; L142-I177 HydrophobicContact CD1-CD1 4.16Å; L142-V242 WeakPolarHBondContact O-CA 3.26Å; L142-G243 PolarHBondContact N-O 2.99Å; L142-G243 PolarHBondContact O-N 2.81Å; L142-I245 HydrophobicContact CD1-CD1 3.97Å; L142-I245 HydrophobicContact CG-CD1 4.41Å
143	S	87.1	Confident	73.5	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	139.1	177	60	0	0	0	0	111.1	F108 E109 F241	F108-S143 WeakPolarHBondContact CA-O 3.49Å; E109-S143 WeakPolarHBondContact CB-OG 3.35Å; E109-S143 PolarHBondContact N-O 3.1Å; E109-S143 PolarHBondContact O-N 2.92Å; E109-S143 PolarHBondContact O-OG 3.02Å; S143-F241 CarbonylContact C-O 3.48Å; S143-F241 WeakPolarHBondContact CA-O 3.42Å
144	R	85.4	Confident	73.6	Confident	91 Å²	91	63.8 Å²	63.8	34%	0.343	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	130.1	178.3	-173.6	162.2	179.3	121.1	7.9	111.3	Q107 F108 T146 L166 I240 F241	Q107-R144 CarbonylContact O-C 3.58Å; Q107-R144 VanDerWaalsContact O-CA 3.26Å; Q107-R144 WeakPolarHBondContact O-CA 3.49Å; Q107-R144 WeakPolarHBondContact O-CG 3.46Å; F108-R144 HydrophobicContact CD2-CB 4.45Å; R144-T146 PolarHBondContact O-N 3.38Å; R144-L166 HydrophobicContact CG-CD2 4.34Å; R144-I240 CarbonylContact O-C 3.53Å; R144-I240 WeakPolarHBondContact O-CA 3.46Å; R144-F241 PolarHBondContact N-O 3.17Å; R144-F241 PolarHBondContact O-N 3.24Å
145	H	82	Confident	73.8	Confident	22 Å²	22	57.8 Å²	57.8	10%	0.102	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	128.6	172.5	-170.5	-111.5	0	0	0	110.3	Q107 E149 W236 H239	Q107-H145 HydrophobicContact CB-CB 4.11Å; Q107-H145 PolarHBondContact O-N 3.07Å; H145-E149 IonicContact CE1-OE1 2.79Å; H145-E149 IonicContact NE2-OE1 3.16Å; H145-W236 HydrophobicContact CB-CD2 3.85Å; H145-W236 HydrophobicContact CB-CE3 4.14Å; H145-W236 HydrophobicContact CB-CG 4.21Å; H145-W236 HydrophobicContact CB-CZ2 4.33Å; H145-W236 AromaticContact CD2-CD1 3.45Å; H145-W236 VanDerWaalsContact CD2-CD1 3.45Å; H145-W236 AromaticContact CD2-CG 3.42Å; H145-W236 VanDerWaalsContact CD2-CG 3.42Å; H145-H239 WeakPolarHBondContact CA-O 3.39Å; H145-H239 PolarHBondContact CD2-O 2.83Å
146	T	75.3	Confident	73.7	Confident	14 Å²	14	60.4 Å²	60.4	9%	0.086	32%	0.322	C	S	.	.			trans	-91.8	149.7	170.2	65.9	0	0	0	0	108.9	R144 D148 L166 H239 F241	R144-T146 PolarHBondContact O-N 3.38Å; T146-D148 PolarHBondContact O-N 3.05Å; T146-D148 VanDerWaalsContact O-N 3.17Å; T146-L166 HydrophobicContact CG2-CD1 3.68Å; T146-H239 PolarHBondContact N-O 2.82Å; T146-H239 VanDerWaalsContact OG1-CA 3.23Å; T146-H239 WeakPolarHBondContact OG1-CA 3.44Å; T146-H239 WeakPolarHBondContact OG1-CB 3.48Å; T146-H239 PolarHBondContact OG1-O 2.79Å; T146-F241 HydrophobicContact CG2-CB 4.3Å
147	N	66.9	Low	73.7	Confident	74 Å²	74	63.7 Å²	63.7	40%	0.396	33%	0.331	S	S	.	.	S	Bend	trans	-82.7	12.6	-173.6	-61.2	-70.4	0	0	0	113.8	E149 W154 E162	N147-E149 PolarHBondContact O-N 3.42Å; N147-W154 HydrophobicContact CB-CH2 3.71Å; N147-W154 HydrophobicContact CB-CZ2 3.73Å; N147-E162 PolarHBondContact N-OE1 3.23Å; N147-E162 PolarHBondContact N-OE2 3.02Å; N147-E162 PolarHBondContact ND2-OE1 2.87Å
148	D	63.1	Low	73.3	Confident	54 Å²	54	68.3 Å²	68.3	29%	0.289	35%	0.353	S	S	.	.			trans	-71.1	30.5	-174.8	-174.9	34.1	0	0	0	113.8	T146 S150 H239	T146-D148 PolarHBondContact O-N 3.05Å; T146-D148 VanDerWaalsContact O-N 3.17Å; D148-S150 PolarHBondContact O-N 3.35Å; D148-H239 WeakPolarHBondContact CB-ND1 3.31Å; D148-H239 PolarHBondContact O-CE1 2.96Å; D148-H239 PolarHBondContact O-ND1 3.21Å; D148-H239 VanDerWaalsContact O-ND1 3.15Å; D148-H239 PolarHBondContact O-NE2 3.28Å; D148-H239 IonicContact OD2-CE1 3.5Å; D148-H239 IonicContact OD2-ND1 3.23Å; D148-H239 PolarHBondContact OD2-ND1 2.92Å
149	E	56	Low	72.7	Confident	150 Å²	150	69.8 Å²	69.8	70%	0.701	36%	0.364	S	S	*	.			trans	-73.1	-6.4	-179.7	-69	-159.3	134.4	0	0	113.9	H145 N147	H145-E149 IonicContact CE1-OE1 2.79Å; H145-E149 IonicContact NE2-OE1 3.16Å; N147-E149 PolarHBondContact O-N 3.42Å
150	S	43.5	Very low	72.4	Confident	50 Å²	50	72.4 Å²	72.4	35%	0.35	39%	0.387	S	S	.	.			trans	-113.7	107.2	-175.4	63.9	0	0	0	0	113.4	D148 D152 W154	D148-S150 PolarHBondContact O-N 3.35Å; S150-D152 PolarHBondContact O-N 3.34Å; S150-W154 PolarHBondContact OG-NE1 3.07Å
151	L	52.6	Low	72.2	Confident	179 Å²	179	76.8 Å²	76.8	94%	0.937	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	0.2	169.8	-90.4	161.7	0	0	0	115.4
152	D	56.8	Low	72.1	Confident	165 Å²	165	78.3 Å²	78.3	88%	0.882	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.4	8.3	-167.5	-73.3	-31.8	0	0	0	115.2	S150	S150-D152 PolarHBondContact O-N 3.34Å
153	G	55.8	Low	71.9	Confident	56 Å²	56	81.2 Å²	81.2	58%	0.577	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-155.7	-10.5	-174.5	0	0	0	0	0	119.4
154	W	62.6	Low	72	Confident	95 Å²	95	84.6 Å²	84.6	36%	0.36	45%	0.446	S	S	.	.			trans	-97.7	121	-177	-69.6	60.3	0	0	0	109.8	N147 S150 E158 E162	N147-W154 HydrophobicContact CB-CH2 3.71Å; N147-W154 HydrophobicContact CB-CZ2 3.73Å; S150-W154 PolarHBondContact OG-NE1 3.07Å; W154-E158 HydrophobicContact CE3-CB 4.31Å; W154-E162 HydrophobicContact CZ3-CB 4.29Å; W154-E162 VanDerWaalsContact CZ3-OE2 3.28Å; W154-E162 WeakPolarHBondContact CZ3-OE2 3.33Å
155	S	71.2	Confident	72.3	Confident	48 Å²	48	85.7 Å²	85.7	34%	0.336	46%	0.455	S	S	.	.			trans	-70	152.3	168.7	61.9	0	0	0	0	110.4	E157 E158 A159	S155-E157 PolarHBondContact O-N 2.86Å; S155-E157 VanDerWaalsContact O-N 3.15Å; S155-E158 WeakPolarHBondContact CB-OE2 3.31Å; S155-E158 PolarHBondContact N-OE2 2.96Å; S155-E158 PolarHBondContact O-N 3.26Å; S155-E158 VanDerWaalsContact O-N 3.09Å; S155-E158 WeakPolarHBondContact OG-CB 3.26Å; S155-E158 VanDerWaalsContact OG-CD 3.24Å; S155-E158 WeakPolarHBondContact OG-CG 3.16Å; S155-E158 PolarHBondContact OG-N 3.37Å; S155-E158 VanDerWaalsContact OG-N 3.14Å; S155-E158 PolarHBondContact OG-OE2 3.4Å; S155-A159 PolarHBondContact O-N 3.36Å
156	E	74.6	Confident	72.6	Confident	183 Å²	183	85.6 Å²	85.6	86%	0.855	46%	0.455	S	S	*	.	H	α-helix	trans	-55.7	-29.4	172.2	-173.7	176.5	-176.4	0	0	111.4	A160	E156-A160 VanDerWaalsContact O-CB 3.3Å; E156-A160 WeakPolarHBondContact O-CB 3.19Å; E156-A160 PolarHBondContact O-N 2.9Å
157	E	80.3	Confident	73.4	Confident	146 Å²	146	84.9 Å²	84.9	68%	0.682	45%	0.451	S	S	*	.	H	α-helix	trans	-67.9	-47.9	174.8	-170.2	169.9	-169	0	0	111.9	S155 A159 A160 D161	S155-E157 PolarHBondContact O-N 2.86Å; S155-E157 VanDerWaalsContact O-N 3.15Å; E157-A159 PolarHBondContact O-N 3.4Å; E157-A160 PolarHBondContact O-N 2.83Å; E157-D161 WeakPolarHBondContact O-CB 3.46Å; E157-D161 PolarHBondContact O-N 3.39Å
158	E	80.3	Confident	74.7	Confident	98 Å²	98	86.6 Å²	86.6	46%	0.458	45%	0.452	S	S	.	.	H	α-helix	trans	-65.5	-37.8	177.9	-73.7	160.5	144.4	0	0	112.7	W154 S155 D161 E162	W154-E158 HydrophobicContact CE3-CB 4.31Å; S155-E158 WeakPolarHBondContact CB-OE2 3.31Å; S155-E158 PolarHBondContact N-OE2 2.96Å; S155-E158 PolarHBondContact O-N 3.26Å; S155-E158 VanDerWaalsContact O-N 3.09Å; S155-E158 WeakPolarHBondContact OG-CB 3.26Å; S155-E158 VanDerWaalsContact OG-CD 3.24Å; S155-E158 WeakPolarHBondContact OG-CG 3.16Å; S155-E158 PolarHBondContact OG-N 3.37Å; S155-E158 VanDerWaalsContact OG-N 3.14Å; S155-E158 PolarHBondContact OG-OE2 3.4Å; E158-D161 PolarHBondContact O-N 2.87Å; E158-E162 PolarHBondContact O-N 2.79Å
159	A	77.5	Confident	76	Confident	30 Å²	30	86.7 Å²	86.7	25%	0.248	46%	0.457	C	S	.	.	H	α-helix	trans	-66.5	-40	175	0	0	0	0	0	111.6	S155 E157 H163	S155-A159 PolarHBondContact O-N 3.36Å; E157-A159 PolarHBondContact O-N 3.4Å; A159-H163 WeakPolarHBondContact O-CB 3.25Å; A159-H163 PolarHBondContact O-N 3.5Å
160	A	82.6	Confident	77.8	Confident	56 Å²	56	80.1 Å²	80.1	46%	0.463	43%	0.426	S	S	.	.	H	α-helix	trans	-65.6	-40.2	174.7	0	0	0	0	0	111.8	E156 E157 H163 E164	E156-A160 VanDerWaalsContact O-CB 3.3Å; E156-A160 WeakPolarHBondContact O-CB 3.19Å; E156-A160 PolarHBondContact O-N 2.9Å; E157-A160 PolarHBondContact O-N 2.83Å; A160-H163 PolarHBondContact O-N 3.49Å; A160-E164 WeakPolarHBondContact O-CB 3.43Å; A160-E164 PolarHBondContact O-N 3.46Å
161	D	86.1	Confident	80.2	Confident	92 Å²	92	78.7 Å²	78.7	49%	0.492	41%	0.414	S	S	.	.	H	α-helix	trans	-65.4	-42.8	176.5	-77.9	-10.4	0	0	0	111.9	E157 E158 E164 Q165	E157-D161 WeakPolarHBondContact O-CB 3.46Å; E157-D161 PolarHBondContact O-N 3.39Å; E158-D161 PolarHBondContact O-N 2.87Å; D161-E164 PolarHBondContact O-N 2.74Å; D161-Q165 WeakPolarHBondContact O-CB 3.34Å; D161-Q165 PolarHBondContact O-N 3.32Å
162	E	86	Confident	82.1	Confident	32 Å²	32	74.1 Å²	74.1	15%	0.15	39%	0.393	C	S	.	.	H	α-helix	trans	-60.1	-49.2	173.6	-175.2	-179.5	-153.6	0	0	110.2	N147 W154 E158 E164 Q165 L166	N147-E162 PolarHBondContact N-OE1 3.23Å; N147-E162 PolarHBondContact N-OE2 3.02Å; N147-E162 PolarHBondContact ND2-OE1 2.87Å; W154-E162 HydrophobicContact CZ3-CB 4.29Å; W154-E162 VanDerWaalsContact CZ3-OE2 3.28Å; W154-E162 WeakPolarHBondContact CZ3-OE2 3.33Å; E158-E162 PolarHBondContact O-N 2.79Å; E162-E164 VanDerWaalsContact C-N 3.32Å; E162-E164 PolarHBondContact O-N 3.43Å; E162-Q165 PolarHBondContact O-N 3.28Å; E162-Q165 VanDerWaalsContact O-N 3.17Å; E162-L166 HydrophobicContact CG-CD1 4.27Å; E162-L166 HydrophobicContact CG-CG 4.4Å; E162-L166 VanDerWaalsContact O-CG 3.31Å; E162-L166 WeakPolarHBondContact O-CG 3.33Å; E162-L166 PolarHBondContact O-N 2.98Å
163	H	84.8	Confident	83.8	Confident	71 Å²	71	68.5 Å²	68.5	33%	0.329	37%	0.367	S	S	.	.	H	α-helix	trans	-60.1	-41.8	178.6	-168.2	-84.8	0	0	0	112.1	A159 A160 L166 A167 F241	A159-H163 WeakPolarHBondContact O-CB 3.25Å; A159-H163 PolarHBondContact O-N 3.5Å; A160-H163 PolarHBondContact O-N 3.49Å; H163-L166 PolarHBondContact O-N 3.39Å; H163-A167 VanDerWaalsContact O-CB 3.28Å; H163-A167 WeakPolarHBondContact O-CB 3.25Å; H163-A167 PolarHBondContact O-N 2.96Å; H163-F241 AromaticContact CD2-CD2 3.9Å; H163-F241 AromaticContact CE1-CD2 3.92Å; H163-F241 AromaticContact CE1-CE2 3.94Å; H163-F241 AromaticContact NE2-CD2 3.55Å
164	E	89.5	Confident	85.6	Confident	70 Å²	70	65.9 Å²	65.9	33%	0.327	34%	0.34	S	S	.	.	H	α-helix	trans	-64.1	-40.9	176.3	-161.9	-172.5	-159.8	0	0	111.6	A160 D161 E162 A167 R168 F194	A160-E164 WeakPolarHBondContact O-CB 3.43Å; A160-E164 PolarHBondContact O-N 3.46Å; D161-E164 PolarHBondContact O-N 2.74Å; E162-E164 VanDerWaalsContact C-N 3.32Å; E162-E164 PolarHBondContact O-N 3.43Å; E164-A167 PolarHBondContact O-N 3.45Å; E164-R168 WeakPolarHBondContact O-CG 3.46Å; E164-R168 PolarHBondContact O-N 2.84Å; E164-R168 IonicContact OE1-CZ 2.64Å; E164-R168 IonicContact OE1-NH1 2.83Å; E164-R168 IonicContact OE1-NH2 3.68Å; E164-R168 PolarHBondContact OE1-NH2 3.26Å; E164-R168 IonicContact OE2-CZ 3.63Å; E164-R168 IonicContact OE2-NH1 3.78Å; E164-R168 PolarHBondContact OE2-NH1 2.94Å; E164-R168 IonicContact OE2-NH2 2.66Å; E164-R168 PolarHBondContact OE2-NH2 3.4Å; E164-F194 HydrophobicContact CG-CE1 3.76Å; E164-F194 HydrophobicContact CG-CZ 3.8Å
165	Q	90.3	Very high	87.1	Confident	115 Å²	115	64.6 Å²	64.6	54%	0.537	34%	0.34	S	S	.	.	H	α-helix	trans	-65.9	-41.6	177.2	-176.4	56.7	33	0	0	111.9	D161 E162 R168 S169	D161-Q165 WeakPolarHBondContact O-CB 3.34Å; D161-Q165 PolarHBondContact O-N 3.32Å; E162-Q165 PolarHBondContact O-N 3.28Å; E162-Q165 VanDerWaalsContact O-N 3.17Å; Q165-R168 PolarHBondContact O-N 3.43Å; Q165-S169 PolarHBondContact O-N 2.89Å
166	L	89.9	Confident	88.1	Confident	19 Å²	19	68.3 Å²	68.3	10%	0.099	35%	0.351	C	S	.	.	H	α-helix	trans	-64.4	-43.9	175.1	-68.6	-175.5	0	0	0	111.6	R144 T146 E162 H163 R168 S169 F170 F241	R144-L166 HydrophobicContact CG-CD2 4.34Å; T146-L166 HydrophobicContact CG2-CD1 3.68Å; E162-L166 HydrophobicContact CG-CD1 4.27Å; E162-L166 HydrophobicContact CG-CG 4.4Å; E162-L166 VanDerWaalsContact O-CG 3.31Å; E162-L166 WeakPolarHBondContact O-CG 3.33Å; E162-L166 PolarHBondContact O-N 2.98Å; H163-L166 PolarHBondContact O-N 3.39Å; L166-R168 PolarHBondContact O-N 3.06Å; L166-S169 WeakPolarHBondContact O-CB 3.34Å; L166-S169 PolarHBondContact O-N 2.92Å; L166-F170 WeakPolarHBondContact O-CB 3.38Å; L166-F170 PolarHBondContact O-N 3.42Å; L166-F241 HydrophobicContact CB-CB 4.33Å; L166-F241 HydrophobicContact CB-CD1 4.28Å; L166-F241 HydrophobicContact CB-CD2 4.2Å; L166-F241 HydrophobicContact CB-CG 3.98Å; L166-F241 HydrophobicContact CD1-CB 3.82Å; L166-F241 HydrophobicContact CD1-CG 4.38Å
167	A	91.5	Very high	88.9	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-58.6	-45.6	175.3	0	0	0	0	0	112.3	H163 E164 S169 F170 I171 P193 F194 F241	H163-A167 VanDerWaalsContact O-CB 3.28Å; H163-A167 WeakPolarHBondContact O-CB 3.25Å; H163-A167 PolarHBondContact O-N 2.96Å; E164-A167 PolarHBondContact O-N 3.45Å; A167-S169 PolarHBondContact O-N 3.41Å; A167-F170 PolarHBondContact O-N 3.17Å; A167-I171 VanDerWaalsContact O-CG1 3.28Å; A167-I171 WeakPolarHBondContact O-CG1 3.36Å; A167-I171 PolarHBondContact O-N 2.75Å; A167-P193 HydrophobicContact CB-CB 4.05Å; A167-P193 HydrophobicContact CB-CG 3.62Å; A167-F194 HydrophobicContact CB-CE1 3.85Å; A167-F194 HydrophobicContact CB-CE2 3.9Å; A167-F194 HydrophobicContact CB-CZ 3.43Å; A167-F194 VanDerWaalsContact CB-CZ 3.43Å; A167-F241 HydrophobicContact CB-CE2 3.91Å; A167-F241 HydrophobicContact CB-CZ 4.12Å
168	R	92.9	Very high	89.5	Confident	110 Å²	110	53.8 Å²	53.8	42%	0.415	28%	0.284	S	S	.	.	H	α-helix	trans	-63.1	-41.4	175.7	-72.3	180	-174.6	119.5	-4.8	112.6	E164 Q165 L166 I171 T172 F194	E164-R168 WeakPolarHBondContact O-CG 3.46Å; E164-R168 PolarHBondContact O-N 2.84Å; E164-R168 IonicContact OE1-CZ 2.64Å; E164-R168 IonicContact OE1-NH1 2.83Å; E164-R168 IonicContact OE1-NH2 3.68Å; E164-R168 PolarHBondContact OE1-NH2 3.26Å; E164-R168 IonicContact OE2-CZ 3.63Å; E164-R168 IonicContact OE2-NH1 3.78Å; E164-R168 PolarHBondContact OE2-NH1 2.94Å; E164-R168 IonicContact OE2-NH2 2.66Å; E164-R168 PolarHBondContact OE2-NH2 3.4Å; Q165-R168 PolarHBondContact O-N 3.43Å; L166-R168 PolarHBondContact O-N 3.06Å; R168-I171 PolarHBondContact O-N 3.15Å; R168-T172 PolarHBondContact O-N 2.8Å; R168-T172 VanDerWaalsContact O-N 3.17Å; R168-T172 PolarHBondContact O-OG1 2.77Å; R168-F194 HydrophobicContact CG-CE2 4.48Å; R168-F194 HydrophobicContact CG-CZ 4.32Å
169	S	91.7	Very high	90.1	Very high	56 Å²	56	51.7 Å²	51.7	39%	0.392	28%	0.28	S	S	.	.	H	α-helix	trans	-62.4	-45.6	175.7	-170.5	0	0	0	0	110.9	Q165 L166 A167 T172 S173	Q165-S169 PolarHBondContact O-N 2.89Å; L166-S169 WeakPolarHBondContact O-CB 3.34Å; L166-S169 PolarHBondContact O-N 2.92Å; A167-S169 PolarHBondContact O-N 3.41Å; S169-T172 PolarHBondContact O-N 2.65Å; S169-S173 PolarHBondContact O-N 3.49Å; S169-S173 VanDerWaalsContact O-N 3.1Å; S169-S173 PolarHBondContact O-OG 3.14Å
170	F	92.7	Very high	90.8	Very high	12 Å²	12	53 Å²	53	5%	0.053	29%	0.287	C	S	.	.	H	α-helix	trans	-59.9	-47.8	177.3	168.3	-103.1	0	0	0	111.9	L142 L166 A167 T172 S173 A174 F190 P193 F241 G243 I245	L142-F170 HydrophobicContact CB-CD2 4.24Å; L142-F170 HydrophobicContact CB-CE2 4.19Å; L142-F170 HydrophobicContact CD1-CD2 3.95Å; L142-F170 HydrophobicContact CD1-CE2 3.86Å; L142-F170 HydrophobicContact CG-CE2 4.21Å; L166-F170 WeakPolarHBondContact O-CB 3.38Å; L166-F170 PolarHBondContact O-N 3.42Å; A167-F170 PolarHBondContact O-N 3.17Å; F170-T172 VanDerWaalsContact C-N 3.27Å; F170-T172 PolarHBondContact O-N 3.5Å; F170-S173 PolarHBondContact O-N 3.19Å; F170-A174 HydrophobicContact CE1-CB 4.25Å; F170-A174 HydrophobicContact CE2-CB 4.1Å; F170-A174 HydrophobicContact CZ-CB 3.95Å; F170-A174 WeakPolarHBondContact O-CB 3.41Å; F170-A174 PolarHBondContact O-N 2.9Å; F170-F190 AromaticContact CE1-CD2 3.92Å; F170-F190 HydrophobicContact CE1-CD2 3.92Å; F170-F190 HydrophobicContact CE1-CE2 4.5Å; F170-F190 HydrophobicContact CZ-CB 4.49Å; F170-F190 HydrophobicContact CZ-CD2 4.32Å; F170-P193 HydrophobicContact CD1-CG 4.15Å; F170-F241 HydrophobicContact CB-CE1 3.59Å; F170-F241 HydrophobicContact CB-CZ 3.98Å; F170-F241 HydrophobicContact CD1-CE1 4.38Å; F170-F241 HydrophobicContact CD1-CZ 4.3Å; F170-F241 HydrophobicContact CD2-CE1 4.44Å; F170-F241 AromaticContact CG-CE1 3.88Å; F170-F241 HydrophobicContact CG-CE1 3.88Å; F170-F241 HydrophobicContact CG-CZ 4.23Å; F170-G243 VanDerWaalsContact CZ-CA 3.44Å; F170-I245 HydrophobicContact CE2-CD1 4.15Å; F170-I245 HydrophobicContact CE2-CG1 4.01Å; F170-I245 HydrophobicContact CZ-CD1 4.5Å; F170-I245 HydrophobicContact CZ-CG1 3.94Å
171	I	94.1	Very high	91.2	Very high	20 Å²	20	50.3 Å²	50.3	10%	0.103	27%	0.265	C	S	.	.	H	α-helix	trans	-56.8	-44.3	178.9	-70.1	166.5	0	0	0	110.7	A167 R168 A174 I175 F190 P193 F194 Y199	A167-I171 VanDerWaalsContact O-CG1 3.28Å; A167-I171 WeakPolarHBondContact O-CG1 3.36Å; A167-I171 PolarHBondContact O-N 2.75Å; R168-I171 PolarHBondContact O-N 3.15Å; I171-A174 PolarHBondContact O-N 2.87Å; I171-I175 HydrophobicContact CG2-CD1 3.83Å; I171-I175 HydrophobicContact CG2-CG1 4.48Å; I171-I175 WeakPolarHBondContact O-CD1 3.47Å; I171-I175 WeakPolarHBondContact O-CG1 3.39Å; I171-I175 PolarHBondContact O-N 2.75Å; I171-F190 HydrophobicContact CB-CE2 4.46Å; I171-F190 HydrophobicContact CG1-CE2 4.19Å; I171-F190 HydrophobicContact CG2-CE2 4.35Å; I171-F190 HydrophobicContact CG2-CZ 4.19Å; I171-P193 HydrophobicContact CD1-CG 4.04Å; I171-P193 HydrophobicContact CG1-CG 4.06Å; I171-F194 HydrophobicContact CD1-CD2 3.77Å; I171-F194 HydrophobicContact CD1-CE2 3.62Å; I171-Y199 HydrophobicContact CG2-CE2 3.83Å
172	T	93.5	Very high	91.4	Very high	82 Å²	82	49.7 Å²	49.7	50%	0.503	26%	0.258	S	S	.	.	H	α-helix	trans	-60.7	-50	179.5	-53.6	0	0	0	0	110.9	R168 S169 F170 I175 E176	R168-T172 PolarHBondContact O-N 2.8Å; R168-T172 VanDerWaalsContact O-N 3.17Å; R168-T172 PolarHBondContact O-OG1 2.77Å; S169-T172 PolarHBondContact O-N 2.65Å; F170-T172 VanDerWaalsContact C-N 3.27Å; F170-T172 PolarHBondContact O-N 3.5Å; T172-I175 PolarHBondContact O-N 3.01Å; T172-E176 PolarHBondContact O-N 2.81Å
173	S	92.3	Very high	91.7	Very high	48 Å²	48	55.5 Å²	55.5	34%	0.336	29%	0.286	S	S	.	.	H	α-helix	trans	-65.9	-38.7	178.1	-58.6	0	0	0	0	112.8	S169 F170 I175 E176 I177	S169-S173 PolarHBondContact O-N 3.49Å; S169-S173 VanDerWaalsContact O-N 3.1Å; S169-S173 PolarHBondContact O-OG 3.14Å; F170-S173 PolarHBondContact O-N 3.19Å; S173-I175 VanDerWaalsContact C-N 3.34Å; S173-I175 PolarHBondContact O-N 3.33Å; S173-E176 PolarHBondContact O-N 3.35Å; S173-I177 VanDerWaalsContact O-CG1 3.32Å; S173-I177 WeakPolarHBondContact O-CG1 3.45Å; S173-I177 PolarHBondContact O-N 3.47Å
174	A	93.2	Very high	91.9	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-66.5	-35.4	179.6	0	0	0	0	0	112	F170 I171 C178 F190 I245	F170-A174 HydrophobicContact CE1-CB 4.25Å; F170-A174 HydrophobicContact CE2-CB 4.1Å; F170-A174 HydrophobicContact CZ-CB 3.95Å; F170-A174 WeakPolarHBondContact O-CB 3.41Å; F170-A174 PolarHBondContact O-N 2.9Å; I171-A174 PolarHBondContact O-N 2.87Å; A174-C178 VanDerWaalsContact O-CB 3.23Å; A174-C178 WeakPolarHBondContact O-CB 3.49Å; A174-C178 PolarHBondContact O-N 3.18Å; A174-C178 PolarHBondContact O-SG 3.36Å; A174-F190 HydrophobicContact CB-CB 4.14Å; A174-F190 HydrophobicContact CB-CD1 3.75Å; A174-F190 HydrophobicContact CB-CD2 3.75Å; A174-F190 HydrophobicContact CB-CE1 3.95Å; A174-F190 HydrophobicContact CB-CE2 3.96Å; A174-F190 HydrophobicContact CB-CG 3.63Å; A174-F190 HydrophobicContact CB-CZ 4.03Å; A174-I245 HydrophobicContact CB-CD1 3.84Å; A174-I245 HydrophobicContact CB-CG1 4.11Å
175	I	94.1	Very high	91.9	Very high	69 Å²	69	56.2 Å²	56.2	35%	0.354	31%	0.309	S	S	.	.	H	α-helix	trans	-61.5	-46.5	172.6	-70.6	164.8	0	0	0	110.4	I171 T172 S173 C178 S179 F190 Y199	I171-I175 HydrophobicContact CG2-CD1 3.83Å; I171-I175 HydrophobicContact CG2-CG1 4.48Å; I171-I175 WeakPolarHBondContact O-CD1 3.47Å; I171-I175 WeakPolarHBondContact O-CG1 3.39Å; I171-I175 PolarHBondContact O-N 2.75Å; T172-I175 PolarHBondContact O-N 3.01Å; S173-I175 VanDerWaalsContact C-N 3.34Å; S173-I175 PolarHBondContact O-N 3.33Å; I175-C178 PolarHBondContact O-N 3.15Å; I175-S179 WeakPolarHBondContact O-CB 3.2Å; I175-S179 PolarHBondContact O-N 3.29Å; I175-F190 HydrophobicContact CG1-CE1 3.82Å; I175-F190 HydrophobicContact CG1-CZ 3.79Å; I175-Y199 HydrophobicContact CD1-CE1 3.83Å; I175-Y199 HydrophobicContact CG1-CD1 4.46Å; I175-Y199 HydrophobicContact CG1-CE1 3.96Å
176	E	92.6	Very high	91.9	Very high	125 Å²	125	53.7 Å²	53.7	58%	0.584	30%	0.295	S	S	*	.	H	α-helix	trans	-64.3	-45.1	179.6	-68	179.2	177.7	0	0	112.1	T172 S173 S179 S180	T172-E176 PolarHBondContact O-N 2.81Å; S173-E176 PolarHBondContact O-N 3.35Å; E176-S179 PolarHBondContact O-N 3.3Å; E176-S180 WeakPolarHBondContact O-CB 3.28Å; E176-S180 PolarHBondContact O-N 3.17Å; E176-S180 PolarHBondContact O-OG 3.39Å
177	I	91.6	Very high	91.9	Very high	25 Å²	25	55.4 Å²	55.4	13%	0.128	30%	0.3	C	S	.	.	H	α-helix	trans	-60.4	-47.7	175.7	-68.6	165.6	0	0	0	110.3	L142 S173 S179 S180 L181 I245 I259	L142-I177 HydrophobicContact CD1-CD1 4.16Å; S173-I177 VanDerWaalsContact O-CG1 3.32Å; S173-I177 WeakPolarHBondContact O-CG1 3.45Å; S173-I177 PolarHBondContact O-N 3.47Å; I177-S179 PolarHBondContact O-N 3.31Å; I177-S180 PolarHBondContact O-N 2.92Å; I177-L181 HydrophobicContact CG2-CD1 3.94Å; I177-L181 WeakPolarHBondContact O-CG 3.37Å; I177-L181 PolarHBondContact O-N 3.32Å; I177-I245 HydrophobicContact CB-CD1 4.35Å; I177-I245 HydrophobicContact CD1-CD1 3.84Å; I177-I245 HydrophobicContact CG2-CD1 4.2Å; I177-I259 HydrophobicContact CD1-CG2 4.01Å; I177-I259 HydrophobicContact CG1-CG2 4.47Å; I177-I259 HydrophobicContact CG2-CD1 3.81Å
178	C	93	Very high	91.9	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-66	-36.8	179.3	-71.4	0	0	0	0	112.6	A174 I175 K182 A188 I200	A174-C178 VanDerWaalsContact O-CB 3.23Å; A174-C178 WeakPolarHBondContact O-CB 3.49Å; A174-C178 PolarHBondContact O-N 3.18Å; A174-C178 PolarHBondContact O-SG 3.36Å; I175-C178 PolarHBondContact O-N 3.15Å; C178-K182 WeakPolarHBondContact O-CB 3.21Å; C178-K182 VanDerWaalsContact O-CG 3.24Å; C178-K182 WeakPolarHBondContact O-CG 3.27Å; C178-K182 PolarHBondContact O-N 2.82Å; C178-A188 HydrophobicContact CB-CB 4.07Å; C178-I200 HydrophobicContact CB-CD1 3.54Å
179	S	92.2	Very high	91.8	Very high	54 Å²	54	50.2 Å²	50.2	38%	0.378	28%	0.281	S	S	.	.	H	α-helix	trans	-62.2	-48.5	174.5	-165.3	0	0	0	0	110.4	I175 E176 I177 L181 K182 E183	I175-S179 WeakPolarHBondContact O-CB 3.2Å; I175-S179 PolarHBondContact O-N 3.29Å; E176-S179 PolarHBondContact O-N 3.3Å; I177-S179 PolarHBondContact O-N 3.31Å; S179-L181 VanDerWaalsContact C-N 3.32Å; S179-L181 PolarHBondContact O-N 3.38Å; S179-K182 PolarHBondContact O-N 3.36Å; S179-K182 VanDerWaalsContact O-N 3.11Å; S179-E183 WeakPolarHBondContact O-CG 3.46Å; S179-E183 PolarHBondContact O-N 3.2Å; S179-E183 PolarHBondContact OG-OE1 3.35Å
180	S	91.7	Very high	91.9	Very high	56 Å²	56	47.6 Å²	47.6	39%	0.392	26%	0.262	S	S	.	.	H	α-helix	trans	-59.2	-42.9	179.2	-56.8	0	0	0	0	111.8	E176 I177 E183 L184	E176-S180 WeakPolarHBondContact O-CB 3.28Å; E176-S180 PolarHBondContact O-N 3.17Å; E176-S180 PolarHBondContact O-OG 3.39Å; I177-S180 PolarHBondContact O-N 2.92Å; S180-E183 PolarHBondContact O-N 3.38Å; S180-L184 WeakPolarHBondContact O-CD1 3.37Å; S180-L184 VanDerWaalsContact O-CG 3.31Å; S180-L184 WeakPolarHBondContact O-CG 3.36Å; S180-L184 PolarHBondContact O-N 2.88Å
181	L	91.1	Very high	91.8	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-66	-39.3	176.2	-72.2	168.7	0	0	0	112.5	I177 S179 L184 G185 Y186 A188 T247 A249 V255 L256	I177-L181 HydrophobicContact CG2-CD1 3.94Å; I177-L181 WeakPolarHBondContact O-CG 3.37Å; I177-L181 PolarHBondContact O-N 3.32Å; S179-L181 VanDerWaalsContact C-N 3.32Å; S179-L181 PolarHBondContact O-N 3.38Å; L181-L184 PolarHBondContact O-N 3.26Å; L181-G185 PolarHBondContact O-N 2.86Å; L181-Y186 WeakPolarHBondContact O-CB 3.48Å; L181-Y186 PolarHBondContact O-N 3.4Å; L181-A188 HydrophobicContact CB-CB 3.66Å; L181-A188 HydrophobicContact CD1-CB 3.65Å; L181-A188 HydrophobicContact CG-CB 4.32Å; L181-T247 HydrophobicContact CD1-CG2 4.41Å; L181-A249 HydrophobicContact CD2-CB 4.18Å; L181-V255 HydrophobicContact CD2-CG1 4.34Å; L181-L256 HydrophobicContact CD1-CD2 4.36Å; L181-L256 HydrophobicContact CD2-CD2 3.81Å
182	K	91.1	Very high	91.6	Very high	80 Å²	80	47.6 Å²	47.6	35%	0.348	26%	0.263	S	S	.	.	H	α-helix	trans	-68.2	-37.7	177.1	-75.8	175.2	-175.3	177.4	0	113.1	C178 S179 L184 G185 Y186 A188	C178-K182 WeakPolarHBondContact O-CB 3.21Å; C178-K182 VanDerWaalsContact O-CG 3.24Å; C178-K182 WeakPolarHBondContact O-CG 3.27Å; C178-K182 PolarHBondContact O-N 2.82Å; S179-K182 PolarHBondContact O-N 3.36Å; S179-K182 VanDerWaalsContact O-N 3.11Å; K182-L184 PolarHBondContact O-N 3.47Å; K182-G185 PolarHBondContact O-N 2.88Å; K182-Y186 VanDerWaalsContact CA-O 3.31Å; K182-Y186 WeakPolarHBondContact CA-O 3.35Å; K182-A188 WeakPolarHBondContact CE-O 3.44Å; K182-A188 PolarHBondContact NZ-O 2.92Å; K182-A188 VanDerWaalsContact NZ-O 3.15Å
183	E	91.4	Very high	91.4	Very high	154 Å²	154	44.9 Å²	44.9	72%	0.72	25%	0.247	S	C	*	.	H	α-helix	trans	-61.1	-30.8	174.4	-75.3	171	-155.6	0	0	112	S179 S180 G185	S179-E183 WeakPolarHBondContact O-CG 3.46Å; S179-E183 PolarHBondContact O-N 3.2Å; S179-E183 PolarHBondContact OG-OE1 3.35Å; S180-E183 PolarHBondContact O-N 3.38Å; E183-G185 VanDerWaalsContact C-N 3.27Å; E183-G185 PolarHBondContact O-N 3.4Å
184	L	89.7	Confident	91.1	Very high	89 Å²	89	47.5 Å²	47.5	47%	0.466	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-2	174.6	-63.3	162.6	0	0	0	113.7	S180 L181 K182 Y186 V255	S180-L184 WeakPolarHBondContact O-CD1 3.37Å; S180-L184 VanDerWaalsContact O-CG 3.31Å; S180-L184 WeakPolarHBondContact O-CG 3.36Å; S180-L184 PolarHBondContact O-N 2.88Å; L181-L184 PolarHBondContact O-N 3.26Å; K182-L184 PolarHBondContact O-N 3.47Å; L184-Y186 HydrophobicContact CB-CD2 3.88Å; L184-Y186 HydrophobicContact CB-CE2 4.24Å; L184-V255 HydrophobicContact CD1-CB 3.94Å; L184-V255 HydrophobicContact CD1-CG1 3.71Å; L184-V255 HydrophobicContact CD1-CG2 3.55Å
185	G	89.3	Confident	90.8	Very high	67 Å²	67	50.8 Å²	50.8	69%	0.691	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.8	8	-179.8	0	0	0	0	0	114.9	L181 K182 E183	L181-G185 PolarHBondContact O-N 2.86Å; K182-G185 PolarHBondContact O-N 2.88Å; E183-G185 VanDerWaalsContact C-N 3.27Å; E183-G185 PolarHBondContact O-N 3.4Å
186	Y	89.6	Confident	90.4	Very high	61 Å²	61	47.8 Å²	47.8	24%	0.239	26%	0.259	C	S	.	.			trans	-85.8	146.8	172	-64.4	-70.7	0	0	0	110.9	L181 K182 L184 D248 A249 H253	L181-Y186 WeakPolarHBondContact O-CB 3.48Å; L181-Y186 PolarHBondContact O-N 3.4Å; K182-Y186 VanDerWaalsContact CA-O 3.31Å; K182-Y186 WeakPolarHBondContact CA-O 3.35Å; L184-Y186 HydrophobicContact CB-CD2 3.88Å; L184-Y186 HydrophobicContact CB-CE2 4.24Å; Y186-D248 VanDerWaalsContact CA-OD1 3.28Å; Y186-D248 WeakPolarHBondContact CA-OD1 3.3Å; Y186-D248 VanDerWaalsContact CB-OD1 3.31Å; Y186-D248 WeakPolarHBondContact CB-OD1 3.25Å; Y186-D248 WeakPolarHBondContact CD1-OD1 3.34Å; Y186-A249 VanDerWaalsContact CD1-CA 3.46Å; Y186-A249 HydrophobicContact CD1-CB 3.79Å; Y186-A249 HydrophobicContact CD2-CB 3.97Å; Y186-A249 HydrophobicContact CE1-CB 4.1Å; Y186-A249 HydrophobicContact CE2-CB 4.27Å; Y186-A249 HydrophobicContact CG-CB 3.72Å; Y186-H253 AromaticContact CE2-CD2 3.77Å; Y186-H253 AromaticContact CE2-CE1 3.77Å; Y186-H253 AromaticContact CE2-NE2 3.53Å; Y186-H253 AromaticContact CZ-CD2 3.71Å; Y186-H253 AromaticContact CZ-NE2 3.86Å; Y186-H253 PolarHBondContact OH-CD2 3.16Å; Y186-H253 PolarHBondContact OH-NE2 2.86Å
187	W	90.3	Very high	90.2	Very high	55 Å²	55	45.6 Å²	45.6	21%	0.208	25%	0.247	C	C	.	.			trans	-76.7	130.7	164.5	174.9	84.9	0	0	0	108.8	F127 R130 L137 D189 F246 T247 D248	F127-W187 HydrophobicContact CB-CZ2 4.5Å; F127-W187 AromaticContact CD1-CH2 3.98Å; F127-W187 HydrophobicContact CD1-CH2 3.98Å; F127-W187 AromaticContact CD1-CZ2 3.86Å; F127-W187 HydrophobicContact CD1-CZ2 3.86Å; F127-W187 HydrophobicContact CD2-CH2 4.36Å; F127-W187 HydrophobicContact CE1-CH2 4.18Å; F127-W187 HydrophobicContact CE1-CZ2 4.28Å; F127-W187 HydrophobicContact CG-CH2 4.07Å; F127-W187 HydrophobicContact CG-CZ2 4.2Å; F127-W187 HydrophobicContact CZ-CH2 4.47Å; R130-W187 VanDerWaalsContact CD-CD2 3.46Å; L137-W187 HydrophobicContact CD1-CE3 4.25Å; L137-W187 HydrophobicContact CD1-CZ3 3.64Å; W187-D189 HydrophobicContact CH2-CB 3.91Å; W187-D189 HydrophobicContact CZ2-CB 3.53Å; W187-F246 HydrophobicContact CH2-CB 4.2Å; W187-F246 HydrophobicContact CZ3-CB 3.97Å; W187-T247 CarbonylContact O-C 3.51Å; W187-T247 WeakPolarHBondContact O-CA 3.39Å; W187-T247 PolarHBondContact O-OG1 3.46Å; W187-T247 VanDerWaalsContact O-OG1 3.07Å; W187-D248 PolarHBondContact N-OD1 3.21Å; W187-D248 PolarHBondContact O-N 3.23Å
188	A	91.1	Very high	90	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	141.2	170.2	0	0	0	0	0	110.5	C178 L181 K182 F246	C178-A188 HydrophobicContact CB-CB 4.07Å; L181-A188 HydrophobicContact CB-CB 3.66Å; L181-A188 HydrophobicContact CD1-CB 3.65Å; L181-A188 HydrophobicContact CG-CB 4.32Å; K182-A188 WeakPolarHBondContact CE-O 3.44Å; K182-A188 PolarHBondContact NZ-O 2.92Å; K182-A188 VanDerWaalsContact NZ-O 3.15Å; A188-F246 CarbonylContact C-O 3.57Å; A188-F246 VanDerWaalsContact CA-O 3.26Å; A188-F246 WeakPolarHBondContact CA-O 3.17Å
189	D	92.4	Very high	89.9	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.011	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	158.4	173.6	-154.5	-9.6	0	0	0	109.1	F127 W187 Y199 I200 G201 F246	F127-D189 HydrophobicContact CD1-CB 4.39Å; F127-D189 HydrophobicContact CE1-CB 3.82Å; W187-D189 HydrophobicContact CH2-CB 3.91Å; W187-D189 HydrophobicContact CZ2-CB 3.53Å; D189-Y199 PolarHBondContact OD1-N 2.8Å; D189-I200 WeakPolarHBondContact OD1-CB 3.41Å; D189-I200 WeakPolarHBondContact OD1-CG1 3.46Å; D189-I200 PolarHBondContact OD1-N 3.32Å; D189-G201 WeakPolarHBondContact OD2-CA 3.49Å; D189-G201 PolarHBondContact OD2-N 2.8Å; D189-F246 PolarHBondContact N-O 3.23Å; D189-F246 PolarHBondContact O-N 3.01Å; D189-F246 VanDerWaalsContact O-O 3.07Å
190	F	92.5	Very high	89.6	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	162.9	-179.8	68.4	-88.7	0	0	0	110.7	F170 I171 A174 I175 P198 Y199 I200 L244 I245	F170-F190 AromaticContact CE1-CD2 3.92Å; F170-F190 HydrophobicContact CE1-CD2 3.92Å; F170-F190 HydrophobicContact CE1-CE2 4.5Å; F170-F190 HydrophobicContact CZ-CB 4.49Å; F170-F190 HydrophobicContact CZ-CD2 4.32Å; I171-F190 HydrophobicContact CB-CE2 4.46Å; I171-F190 HydrophobicContact CG1-CE2 4.19Å; I171-F190 HydrophobicContact CG2-CE2 4.35Å; I171-F190 HydrophobicContact CG2-CZ 4.19Å; A174-F190 HydrophobicContact CB-CB 4.14Å; A174-F190 HydrophobicContact CB-CD1 3.75Å; A174-F190 HydrophobicContact CB-CD2 3.75Å; A174-F190 HydrophobicContact CB-CE1 3.95Å; A174-F190 HydrophobicContact CB-CE2 3.96Å; A174-F190 HydrophobicContact CB-CG 3.63Å; A174-F190 HydrophobicContact CB-CZ 4.03Å; I175-F190 HydrophobicContact CG1-CE1 3.82Å; I175-F190 HydrophobicContact CG1-CZ 3.79Å; F190-P198 CarbonylContact O-C 3.5Å; F190-P198 WeakPolarHBondContact O-CA 3.29Å; F190-Y199 HydrophobicContact CD1-CG 4.45Å; F190-Y199 HydrophobicContact CD2-CG 4.3Å; F190-Y199 AromaticContact CE1-CD1 3.47Å; F190-Y199 HydrophobicContact CE1-CD1 3.47Å; F190-Y199 VanDerWaalsContact CE1-CD1 3.47Å; F190-Y199 HydrophobicContact CE1-CE1 4.25Å; F190-Y199 AromaticContact CE1-CG 3.64Å; F190-Y199 HydrophobicContact CE1-CG 3.64Å; F190-Y199 VanDerWaalsContact CE2-CB 3.4Å; F190-Y199 HydrophobicContact CE2-CD1 4.05Å; F190-Y199 AromaticContact CE2-CD2 3.63Å; F190-Y199 HydrophobicContact CE2-CD2 3.63Å; F190-Y199 HydrophobicContact CE2-CE2 4.38Å; F190-Y199 AromaticContact CE2-CG 3.43Å; F190-Y199 HydrophobicContact CE2-CG 3.43Å; F190-Y199 VanDerWaalsContact CE2-CG 3.43Å; F190-Y199 AromaticContact CZ-CD1 3.18Å; F190-Y199 HydrophobicContact CZ-CD1 3.18Å; F190-Y199 AromaticContact CZ-CD2 3.57Å; F190-Y199 HydrophobicContact CZ-CD2 3.57Å; F190-Y199 AromaticContact CZ-CE1 3.77Å; F190-Y199 HydrophobicContact CZ-CE1 3.77Å; F190-Y199 HydrophobicContact CZ-CE2 4.12Å; F190-Y199 AromaticContact CZ-CG 3.06Å; F190-Y199 HydrophobicContact CZ-CG 3.06Å; F190-Y199 PolarHBondContact O-N 3.49Å; F190-I200 HydrophobicContact CD1-CD1 4.14Å; F190-I200 HydrophobicContact CD1-CG1 4.3Å; F190-I200 HydrophobicContact CE1-CD1 4.14Å; F190-I200 HydrophobicContact CE1-CG1 4.09Å; F190-L244 VanDerWaalsContact CA-O 3.31Å; F190-L244 WeakPolarHBondContact CA-O 3.28Å; F190-L244 VanDerWaalsContact CB-O 3.31Å; F190-L244 WeakPolarHBondContact CB-O 3.48Å; F190-I245 HydrophobicContact CB-CB 4.21Å; F190-I245 HydrophobicContact CB-CG1 3.78Å; F190-I245 HydrophobicContact CB-CG2 4.35Å
191	I	90.9	Very high	89	Confident	9 Å²	9	48.8 Å²	48.8	5%	0.046	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-90.7	125.9	177.1	-58.4	-60	0	0	0	108.8	V126 F127 P193 K197 L208 L244 F246	V126-I191 HydrophobicContact CG1-CD1 3.93Å; F127-I191 HydrophobicContact CE1-CD1 4.33Å; F127-I191 HydrophobicContact CE2-CD1 4.24Å; F127-I191 HydrophobicContact CZ-CD1 3.6Å; I191-P193 WeakPolarHBondContact O-CD 3.31Å; I191-K197 WeakPolarHBondContact CA-O 3.38Å; I191-L208 HydrophobicContact CD1-CB 4.05Å; I191-L208 HydrophobicContact CD1-CD2 4.31Å; I191-L208 HydrophobicContact CG1-CB 4.22Å; I191-L208 HydrophobicContact CG1-CD2 4Å; I191-L208 WeakPolarHBondContact CG2-O 3.47Å; I191-L244 HydrophobicContact CB-CB 4.33Å; I191-L244 HydrophobicContact CG1-CB 4.17Å; I191-L244 HydrophobicContact CG1-CD1 4.34Å; I191-L244 PolarHBondContact N-O 2.89Å; I191-F246 HydrophobicContact CD1-CE2 4.33Å; I191-F246 HydrophobicContact CG1-CD2 4.4Å; I191-F246 HydrophobicContact CG1-CE2 3.84Å
192	D	90.7	Very high	87.9	Confident	23 Å²	23	52 Å²	52	12%	0.123	28%	0.28	C	S	.	.			trans	-64.8	116.3	171.3	176.1	4.7	0	0	0	109.5	F194 T195 G196 K197 Y199	D192-F194 PolarHBondContact O-N 2.85Å; D192-F194 WeakPolarHBondContact OD1-CB 3.31Å; D192-F194 PolarHBondContact OD1-N 2.83Å; D192-T195 WeakPolarHBondContact CB-OG1 3.46Å; D192-T195 VanDerWaalsContact CG-OG1 3.27Å; D192-T195 PolarHBondContact O-N 3.31Å; D192-T195 VanDerWaalsContact OD2-CG2 3.26Å; D192-T195 WeakPolarHBondContact OD2-CG2 3.41Å; D192-T195 PolarHBondContact OD2-OG1 3.04Å; D192-G196 VanDerWaalsContact O-CA 3.27Å; D192-G196 WeakPolarHBondContact O-CA 3.46Å; D192-G196 PolarHBondContact O-N 2.91Å; D192-K197 WeakPolarHBondContact CB-O 3.24Å; D192-K197 PolarHBondContact N-O 2.95Å; D192-Y199 HydrophobicContact CB-CD2 4.1Å
193	P	88	Confident	86.9	Confident	25 Å²	25	52.9 Å²	52.9	16%	0.162	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-23.5	-178.9	26.6	-36.3	0	0	0	113	A167 F170 I171 I191 F241	A167-P193 HydrophobicContact CB-CB 4.05Å; A167-P193 HydrophobicContact CB-CG 3.62Å; F170-P193 HydrophobicContact CD1-CG 4.15Å; I171-P193 HydrophobicContact CD1-CG 4.04Å; I171-P193 HydrophobicContact CG1-CG 4.06Å; I191-P193 WeakPolarHBondContact O-CD 3.31Å; P193-F241 HydrophobicContact CB-CE2 3.98Å; P193-F241 HydrophobicContact CB-CZ 3.85Å; P193-F241 HydrophobicContact CG-CZ 4.2Å
194	F	87	Confident	85.5	Confident	104 Å²	104	46.2 Å²	46.2	46%	0.456	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-35.9	179.6	-64.1	-64.1	0	0	0	113.2	E164 A167 R168 I171 D192	E164-F194 HydrophobicContact CG-CE1 3.76Å; E164-F194 HydrophobicContact CG-CZ 3.8Å; A167-F194 HydrophobicContact CB-CE1 3.85Å; A167-F194 HydrophobicContact CB-CE2 3.9Å; A167-F194 HydrophobicContact CB-CZ 3.43Å; A167-F194 VanDerWaalsContact CB-CZ 3.43Å; R168-F194 HydrophobicContact CG-CE2 4.48Å; R168-F194 HydrophobicContact CG-CZ 4.32Å; I171-F194 HydrophobicContact CD1-CD2 3.77Å; I171-F194 HydrophobicContact CD1-CE2 3.62Å; D192-F194 PolarHBondContact O-N 2.85Å; D192-F194 WeakPolarHBondContact OD1-CB 3.31Å; D192-F194 PolarHBondContact OD1-N 2.83Å
195	T	86.3	Confident	84.5	Confident	68 Å²	68	51.4 Å²	51.4	42%	0.417	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	-18.7	-173.1	63.8	0	0	0	0	113.6	D192 K197 I207	D192-T195 WeakPolarHBondContact CB-OG1 3.46Å; D192-T195 VanDerWaalsContact CG-OG1 3.27Å; D192-T195 PolarHBondContact O-N 3.31Å; D192-T195 VanDerWaalsContact OD2-CG2 3.26Å; D192-T195 WeakPolarHBondContact OD2-CG2 3.41Å; D192-T195 PolarHBondContact OD2-OG1 3.04Å; T195-K197 PolarHBondContact O-N 2.69Å; T195-K197 PolarHBondContact OG1-N 3.01Å; T195-I207 WeakPolarHBondContact O-CG2 3.37Å
196	G	85.8	Confident	83.5	Confident	6 Å²	6	49.8 Å²	49.8	6%	0.062	26%	0.259	C	S	.	.	S	Bend	trans	65.2	17.4	-171	0	0	0	0	0	113.7	D192 I207 L208	D192-G196 VanDerWaalsContact O-CA 3.27Å; D192-G196 WeakPolarHBondContact O-CA 3.46Å; D192-G196 PolarHBondContact O-N 2.91Å; G196-I207 CarbonylContact O-C 3.44Å; G196-I207 WeakPolarHBondContact O-CA 3.36Å; G196-I207 WeakPolarHBondContact O-CG2 3.31Å; G196-L208 CarbonylContact C-O 3.59Å; G196-L208 VanDerWaalsContact CA-O 3.25Å; G196-L208 WeakPolarHBondContact CA-O 3.46Å; G196-L208 PolarHBondContact O-N 2.97Å
197	K	87.8	Confident	82.8	Confident	80 Å²	80	50.5 Å²	50.5	35%	0.348	27%	0.267	S	S	.	.	S	Bend	trans	-102.3	158.9	179.5	-67.2	-179.3	180	-178.4	0	110.3	I191 D192 T195 H203 I207	I191-K197 WeakPolarHBondContact CA-O 3.38Å; D192-K197 WeakPolarHBondContact CB-O 3.24Å; D192-K197 PolarHBondContact N-O 2.95Å; T195-K197 PolarHBondContact O-N 2.69Å; T195-K197 PolarHBondContact OG1-N 3.01Å; K197-H203 HydrophobicContact CB-CB 4.45Å; K197-H203 HydrophobicContact CD-CB 4.39Å; K197-I207 HydrophobicContact CG-CG1 4.22Å
198	P	88.9	Confident	82.1	Confident	2 Å²	2	48 Å²	48	1%	0.013	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-48.3	143.8	166.3	-27.4	35.6	0	0	0	110.7	V126 F127 F190 H203	V126-P198 HydrophobicContact CG1-CG 3.96Å; V126-P198 VanDerWaalsContact O-CG 3.25Å; V126-P198 WeakPolarHBondContact O-CG 3.3Å; F127-P198 HydrophobicContact CD1-CB 3.81Å; F127-P198 HydrophobicContact CD1-CG 3.56Å; F127-P198 HydrophobicContact CE1-CB 3.54Å; F127-P198 HydrophobicContact CE1-CG 3.53Å; F127-P198 HydrophobicContact CG-CG 4.38Å; F127-P198 HydrophobicContact CZ-CG 4.31Å; F190-P198 CarbonylContact O-C 3.5Å; F190-P198 WeakPolarHBondContact O-CA 3.29Å; P198-H203 PolarHBondContact O-CE1 3.28Å; P198-H203 PolarHBondContact O-ND1 3.13Å
199	Y	90.5	Very high	81	Confident	102 Å²	102	54.1 Å²	54.1	40%	0.4	28%	0.284	S	S	.	.	S	Bend	trans	-90.4	-39.1	179.9	-171.6	-89.7	0	0	0	112	I171 I175 D189 F190 D192	I171-Y199 HydrophobicContact CG2-CE2 3.83Å; I175-Y199 HydrophobicContact CD1-CE1 3.83Å; I175-Y199 HydrophobicContact CG1-CD1 4.46Å; I175-Y199 HydrophobicContact CG1-CE1 3.96Å; D189-Y199 PolarHBondContact OD1-N 2.8Å; F190-Y199 HydrophobicContact CD1-CG 4.45Å; F190-Y199 HydrophobicContact CD2-CG 4.3Å; F190-Y199 AromaticContact CE1-CD1 3.47Å; F190-Y199 HydrophobicContact CE1-CD1 3.47Å; F190-Y199 VanDerWaalsContact CE1-CD1 3.47Å; F190-Y199 HydrophobicContact CE1-CE1 4.25Å; F190-Y199 AromaticContact CE1-CG 3.64Å; F190-Y199 HydrophobicContact CE1-CG 3.64Å; F190-Y199 VanDerWaalsContact CE2-CB 3.4Å; F190-Y199 HydrophobicContact CE2-CD1 4.05Å; F190-Y199 AromaticContact CE2-CD2 3.63Å; F190-Y199 HydrophobicContact CE2-CD2 3.63Å; F190-Y199 HydrophobicContact CE2-CE2 4.38Å; F190-Y199 AromaticContact CE2-CG 3.43Å; F190-Y199 HydrophobicContact CE2-CG 3.43Å; F190-Y199 VanDerWaalsContact CE2-CG 3.43Å; F190-Y199 AromaticContact CZ-CD1 3.18Å; F190-Y199 HydrophobicContact CZ-CD1 3.18Å; F190-Y199 AromaticContact CZ-CD2 3.57Å; F190-Y199 HydrophobicContact CZ-CD2 3.57Å; F190-Y199 AromaticContact CZ-CE1 3.77Å; F190-Y199 HydrophobicContact CZ-CE1 3.77Å; F190-Y199 HydrophobicContact CZ-CE2 4.12Å; F190-Y199 AromaticContact CZ-CG 3.06Å; F190-Y199 HydrophobicContact CZ-CG 3.06Å; F190-Y199 PolarHBondContact O-N 3.49Å; D192-Y199 HydrophobicContact CB-CD2 4.1Å
200	I	86.4	Confident	79.9	Confident	75 Å²	75	55.9 Å²	55.9	39%	0.385	29%	0.292	S	S	.	.	S	Bend	trans	-102.4	-42.5	-169.8	-46.8	170.4	0	0	0	112.6	C178 D189 F190	C178-I200 HydrophobicContact CB-CD1 3.54Å; D189-I200 WeakPolarHBondContact OD1-CB 3.41Å; D189-I200 WeakPolarHBondContact OD1-CG1 3.46Å; D189-I200 PolarHBondContact OD1-N 3.32Å; F190-I200 HydrophobicContact CD1-CD1 4.14Å; F190-I200 HydrophobicContact CD1-CG1 4.3Å; F190-I200 HydrophobicContact CE1-CD1 4.14Å; F190-I200 HydrophobicContact CE1-CG1 4.09Å
201	G	77.7	Confident	78.4	Confident	22 Å²	22	57.9 Å²	57.9	23%	0.227	30%	0.304	C	S	.	.	S	Bend	trans	-80.2	164.5	-178.2	0	0	0	0	0	113.3	D189 H203	D189-G201 WeakPolarHBondContact OD2-CA 3.49Å; D189-G201 PolarHBondContact OD2-N 2.8Å; G201-H203 PolarHBondContact O-CE1 2.86Å; G201-H203 VanDerWaalsContact O-CE1 3.24Å; G201-H203 PolarHBondContact O-N 2.86Å; G201-H203 PolarHBondContact O-ND1 3.34Å
202	A	69	Low	77.5	Confident	67 Å²	67	60 Å²	60	55%	0.554	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-65	125.6	173.2	0	0	0	0	0	109.7	S129	S129-A202 WeakPolarHBondContact OG-CB 3.36Å; S129-A202 PolarHBondContact OG-O 3.34Å; S129-A202 VanDerWaalsContact OG-O 3.11Å
203	H	68.7	Low	76.6	Confident	100 Å²	100	63.8 Å²	63.8	46%	0.463	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-74.9	137.5	-172.8	-37.6	-59.1	0	0	0	110.8	K197 P198 G201	K197-H203 HydrophobicContact CB-CB 4.45Å; K197-H203 HydrophobicContact CD-CB 4.39Å; P198-H203 PolarHBondContact O-CE1 3.28Å; P198-H203 PolarHBondContact O-ND1 3.13Å; G201-H203 PolarHBondContact O-CE1 2.86Å; G201-H203 VanDerWaalsContact O-CE1 3.24Å; G201-H203 PolarHBondContact O-N 2.86Å; G201-H203 PolarHBondContact O-ND1 3.34Å
204	G	62.7	Low	75.8	Confident	13 Å²	13	63.2 Å²	63.2	13%	0.134	33%	0.329	C	S	.	.			trans	-74.6	178.7	158.9	0	0	0	0	0	111.8	V126	V126-G204 PolarHBondContact O-N 3.08Å
205	E	68.5	Low	75.1	Confident	198 Å²	198	58.2 Å²	58.2	93%	0.925	31%	0.307	S	S	*	.	S	Bend	trans	-72.6	-19.8	168.6	-65.7	-176.8	168	0	0	112
206	A	68.6	Low	74.7	Confident	33 Å²	33	59.5 Å²	59.5	27%	0.273	31%	0.307	S	S	.	.			trans	-75	138.2	180	0	0	0	0	0	111.7	N125 V126	N125-A206 HydrophobicContact CB-CB 4.08Å; V126-A206 HydrophobicContact CG2-CB 3.99Å
207	I	75.9	Confident	74.2	Confident	77 Å²	77	64.1 Å²	64.1	40%	0.395	33%	0.327	S	S	.	.			trans	-116	127.9	-179.1	-61.8	176.3	0	0	0	106.7	T195 G196 K197 K209	T195-I207 WeakPolarHBondContact O-CG2 3.37Å; G196-I207 CarbonylContact O-C 3.44Å; G196-I207 WeakPolarHBondContact O-CA 3.36Å; G196-I207 WeakPolarHBondContact O-CG2 3.31Å; K197-I207 HydrophobicContact CG-CG1 4.22Å; I207-K209 HydrophobicContact CG2-CG 3.88Å
208	L	74.8	Confident	73.5	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.016	31%	0.312	C	S	.	.			trans	-97.8	116.5	169.2	-166.8	68.1	0	0	0	107.6	L123 V126 I191 G196 D212 T214 M215 L244 F246	L123-L208 HydrophobicContact CD2-CD1 4.42Å; L123-L208 HydrophobicContact CD2-CD2 3.65Å; V126-L208 HydrophobicContact CG1-CB 4.28Å; V126-L208 HydrophobicContact CG2-CB 4.27Å; I191-L208 HydrophobicContact CD1-CB 4.05Å; I191-L208 HydrophobicContact CD1-CD2 4.31Å; I191-L208 HydrophobicContact CG1-CB 4.22Å; I191-L208 HydrophobicContact CG1-CD2 4Å; I191-L208 WeakPolarHBondContact CG2-O 3.47Å; G196-L208 CarbonylContact C-O 3.59Å; G196-L208 VanDerWaalsContact CA-O 3.25Å; G196-L208 WeakPolarHBondContact CA-O 3.46Å; G196-L208 PolarHBondContact O-N 2.97Å; L208-D212 HydrophobicContact CD1-CB 4.09Å; L208-D212 VanDerWaalsContact CD1-OD2 3.28Å; L208-D212 WeakPolarHBondContact CD1-OD2 3.49Å; L208-T214 HydrophobicContact CD1-CG2 4.26Å; L208-M215 HydrophobicContact CD2-CE 4.4Å; L208-M215 HydrophobicContact CG-CE 4.28Å; L208-L244 HydrophobicContact CD2-CD1 3.79Å; L208-L244 HydrophobicContact CG-CD1 4.24Å; L208-F246 HydrophobicContact CD2-CE2 3.77Å; L208-F246 HydrophobicContact CD2-CZ 3.66Å
209	K	68.8	Low	72.6	Confident	127 Å²	127	63.1 Å²	63.1	55%	0.552	34%	0.336	S	S	*	.			trans	-99.4	155.5	175	-65.4	-170.6	178.9	-174.7	0	109.9	I207 T211 D212 M215	I207-K209 HydrophobicContact CG2-CG 3.88Å; K209-T211 PolarHBondContact O-N 3.14Å; K209-D212 WeakPolarHBondContact O-CB 3.01Å; K209-D212 PolarHBondContact O-N 2.75Å; K209-M215 WeakPolarHBondContact O-CE 3.33Å
210	E	67.3	Low	71.7	Confident	39 Å²	39	58.5 Å²	58.5	18%	0.182	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-24.9	172.9	-57.1	-178.1	-167.3	0	0	112.2	M215 V242	E210-M215 WeakPolarHBondContact O-CG 3.33Å; E210-V242 VanDerWaalsContact CD-O 3.24Å; E210-V242 WeakPolarHBondContact CG-O 3.38Å
211	T	62.6	Low	71.1	Confident	42 Å²	42	60 Å²	60	26%	0.258	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	9.3	-178.2	67.9	0	0	0	0	113.9	K209 L222 Q229	K209-T211 PolarHBondContact O-N 3.14Å; T211-L222 WeakPolarHBondContact O-CD2 3.28Å; T211-Q229 WeakPolarHBondContact CB-O 3.45Å; T211-Q229 WeakPolarHBondContact CG2-O 3.36Å; T211-Q229 PolarHBondContact O-OE1 3.23Å; T211-Q229 VanDerWaalsContact O-OE1 3.09Å
212	D	72.2	Confident	70.7	Confident	54 Å²	54	59.8 Å²	59.8	29%	0.289	32%	0.317	S	S	.	.	S	Bend	trans	-72	148	-178.1	-165	2.5	0	0	0	111.6	L208 K209 T214 M215 L222	L208-D212 HydrophobicContact CD1-CB 4.09Å; L208-D212 VanDerWaalsContact CD1-OD2 3.28Å; L208-D212 WeakPolarHBondContact CD1-OD2 3.49Å; K209-D212 WeakPolarHBondContact O-CB 3.01Å; K209-D212 PolarHBondContact O-N 2.75Å; D212-T214 PolarHBondContact O-N 3.41Å; D212-M215 WeakPolarHBondContact O-CB 3.43Å; D212-M215 WeakPolarHBondContact O-CG 3.38Å; D212-M215 PolarHBondContact O-N 3.03Å; D212-L222 WeakPolarHBondContact O-CD1 3.45Å
213	E	70.3	Confident	70.6	Confident	102 Å²	102	60 Å²	60	48%	0.477	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-57.7	-20.1	-178.9	-60.8	-159.4	133.3	0	0	113.3	M215 K216 L222	E213-M215 PolarHBondContact O-N 2.79Å; E213-K216 WeakPolarHBondContact O-CB 3.22Å; E213-K216 PolarHBondContact O-N 3.05Å; E213-K216 VanDerWaalsContact O-N 3.16Å; E213-K216 IonicContact OE1-NZ 3.93Å; E213-L222 HydrophobicContact CG-CD1 4.5Å
214	T	71.7	Confident	70.3	Confident	13 Å²	13	60.4 Å²	60.4	8%	0.08	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-55.8	-31.8	170.9	57.1	0	0	0	0	112.2	A122 L208 D212 K216 H217	A122-T214 HydrophobicContact CB-CG2 4.34Å; L208-T214 HydrophobicContact CD1-CG2 4.26Å; D212-T214 PolarHBondContact O-N 3.41Å; T214-K216 PolarHBondContact O-N 2.85Å; T214-H217 WeakPolarHBondContact O-CB 3.38Å; T214-H217 PolarHBondContact O-N 3.09Å; T214-H217 PolarHBondContact O-ND1 3.4Å
215	M	73.2	Confident	70.3	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-63.7	-25.6	179.7	-59.6	-41.9	150.1	0	0	113.8	L208 K209 E210 D212 E213 H217 F218 F220 L231 L244	L208-M215 HydrophobicContact CD2-CE 4.4Å; L208-M215 HydrophobicContact CG-CE 4.28Å; K209-M215 WeakPolarHBondContact O-CE 3.33Å; E210-M215 WeakPolarHBondContact O-CG 3.33Å; D212-M215 WeakPolarHBondContact O-CB 3.43Å; D212-M215 WeakPolarHBondContact O-CG 3.38Å; D212-M215 PolarHBondContact O-N 3.03Å; E213-M215 PolarHBondContact O-N 2.79Å; M215-H217 PolarHBondContact O-N 2.89Å; M215-F218 PolarHBondContact O-N 3.15Å; M215-F218 HydrophobicContact SD-CD2 3.94Å; M215-F218 HydrophobicContact SD-CE2 4.34Å; M215-F220 HydrophobicContact CB-CB 4.11Å; M215-F220 HydrophobicContact CB-CD2 4.26Å; M215-F220 HydrophobicContact CB-CG 4.43Å; M215-F220 PolarHBondContact O-N 3.06Å; M215-L231 HydrophobicContact CB-CD1 3.69Å; M215-L231 HydrophobicContact CG-CD1 4.02Å; M215-L244 HydrophobicContact CE-CD1 3.24Å; M215-L244 HydrophobicContact CE-CD2 3.93Å; M215-L244 HydrophobicContact CE-CG 4.16Å; M215-L244 HydrophobicContact SD-CD1 4.23Å; M215-L244 HydrophobicContact SD-CD2 3.77Å
216	K	76.5	Confident	69.9	Low	95 Å²	95	62 Å²	62	41%	0.413	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-57.7	-31.6	173.9	-67.5	175.3	176.4	165.1	0	112.3	E213 T214 F218 G219 F220 L222	E213-K216 WeakPolarHBondContact O-CB 3.22Å; E213-K216 PolarHBondContact O-N 3.05Å; E213-K216 VanDerWaalsContact O-N 3.16Å; E213-K216 IonicContact OE1-NZ 3.93Å; T214-K216 PolarHBondContact O-N 2.85Å; K216-F218 PolarHBondContact O-N 2.85Å; K216-G219 PolarHBondContact O-N 3.23Å; K216-F220 WeakPolarHBondContact CA-O 3.48Å; K216-L222 HydrophobicContact CD-CD1 4.32Å; K216-L222 HydrophobicContact CG-CD1 3.94Å; K216-L222 HydrophobicContact CG-CG 4.26Å
217	H	75.3	Confident	69.5	Low	103 Å²	103	66 Å²	66	48%	0.477	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-74.1	-16.6	179.4	-60.4	85.5	0	0	0	113	V119 T214 M215	V119-H217 HydrophobicContact CG2-CB 3.87Å; T214-H217 WeakPolarHBondContact O-CB 3.38Å; T214-H217 PolarHBondContact O-N 3.09Å; T214-H217 PolarHBondContact O-ND1 3.4Å; M215-H217 PolarHBondContact O-N 2.89Å
218	F	74	Confident	68.6	Low	10 Å²	10	65.8 Å²	65.8	4%	0.044	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-100.6	10.3	179	-56.2	-58.7	0	0	0	113	H113 V119 A139 I141 M215 K216 F220	H113-F218 HydrophobicContact CB-CD1 3.81Å; H113-F218 HydrophobicContact CB-CE1 4.12Å; V119-F218 HydrophobicContact CG1-CZ 4.05Å; A139-F218 HydrophobicContact CB-CD1 4.46Å; A139-F218 HydrophobicContact CB-CE1 3.63Å; A139-F218 HydrophobicContact CB-CZ 3.72Å; I141-F218 HydrophobicContact CD1-CB 3.25Å; I141-F218 HydrophobicContact CD1-CD1 3.81Å; I141-F218 HydrophobicContact CD1-CD2 3.69Å; I141-F218 HydrophobicContact CD1-CE2 4.48Å; I141-F218 HydrophobicContact CD1-CG 3.32Å; M215-F218 PolarHBondContact O-N 3.15Å; M215-F218 HydrophobicContact SD-CD2 3.94Å; M215-F218 HydrophobicContact SD-CE2 4.34Å; K216-F218 PolarHBondContact O-N 2.85Å; F218-F220 HydrophobicContact CB-CD2 4.02Å; F218-F220 HydrophobicContact CB-CE2 4.09Å
219	G	70.6	Confident	68	Low	50 Å²	50	68.7 Å²	68.7	52%	0.515	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.7	8.8	175.9	0	0	0	0	0	115.2	K216	K216-G219 PolarHBondContact O-N 3.23Å
220	F	72	Confident	67.6	Low	6 Å²	6	65 Å²	65	3%	0.026	36%	0.36	C	S	.	.			trans	-87.8	145.9	173	-61.1	-92.4	0	0	0	111.5	I141 M215 K216 F218 L231 Y233 I240 V242	I141-F220 HydrophobicContact CD1-CE2 3.99Å; I141-F220 HydrophobicContact CG2-CE2 3.85Å; I141-F220 HydrophobicContact CG2-CZ 3.73Å; M215-F220 HydrophobicContact CB-CB 4.11Å; M215-F220 HydrophobicContact CB-CD2 4.26Å; M215-F220 HydrophobicContact CB-CG 4.43Å; M215-F220 PolarHBondContact O-N 3.06Å; K216-F220 WeakPolarHBondContact CA-O 3.48Å; F218-F220 HydrophobicContact CB-CD2 4.02Å; F218-F220 HydrophobicContact CB-CE2 4.09Å; F220-L231 HydrophobicContact CB-CD1 3.45Å; F220-L231 VanDerWaalsContact CB-CD1 3.45Å; F220-L231 HydrophobicContact CB-CG 4.12Å; F220-L231 HydrophobicContact CD1-CD1 4.09Å; F220-L231 HydrophobicContact CD1-CD2 3.79Å; F220-L231 HydrophobicContact CD1-CG 3.89Å; F220-L231 HydrophobicContact CE1-CD2 4.2Å; F220-L231 HydrophobicContact CG-CD1 3.88Å; F220-L231 HydrophobicContact CG-CD2 4.26Å; F220-L231 HydrophobicContact CG-CG 4.21Å; F220-Y233 AromaticContact CD1-CD2 3.5Å; F220-Y233 HydrophobicContact CD1-CD2 3.5Å; F220-Y233 VanDerWaalsContact CD1-CD2 3.5Å; F220-Y233 HydrophobicContact CD1-CE2 4.25Å; F220-Y233 HydrophobicContact CD1-CG 4.34Å; F220-Y233 AromaticContact CE1-CD2 3.25Å; F220-Y233 HydrophobicContact CE1-CD2 3.25Å; F220-Y233 AromaticContact CE1-CE2 3.74Å; F220-Y233 HydrophobicContact CE1-CE2 3.74Å; F220-Y233 HydrophobicContact CE1-CG 4.05Å; F220-Y233 HydrophobicContact CG-CD2 4.43Å; F220-Y233 HydrophobicContact CZ-CD2 4.03Å; F220-Y233 HydrophobicContact CZ-CE2 4.05Å; F220-I240 HydrophobicContact CE1-CD1 4.16Å; F220-V242 HydrophobicContact CE1-CG2 3.91Å; F220-V242 HydrophobicContact CZ-CG1 4.26Å; F220-V242 HydrophobicContact CZ-CG2 4.3Å
221	E	72.9	Confident	67.7	Low	105 Å²	105	63.8 Å²	63.8	49%	0.491	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	143.3	169.3	-66.5	179.1	171.8	0	0	108.9	R232	E221-R232 HydrophobicContact CB-CB 4.11Å; E221-R232 PolarHBondContact N-O 3.09Å; E221-R232 PolarHBondContact O-N 3.04Å
222	L	69.8	Low	68	Low	18 Å²	18	66.1 Å²	66.1	9%	0.094	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	116.9	173.9	-73	170.7	0	0	0	108.7	T211 D212 E213 K216 V230 L231	T211-L222 WeakPolarHBondContact O-CD2 3.28Å; D212-L222 WeakPolarHBondContact O-CD1 3.45Å; E213-L222 HydrophobicContact CG-CD1 4.5Å; K216-L222 HydrophobicContact CD-CD1 4.32Å; K216-L222 HydrophobicContact CG-CD1 3.94Å; K216-L222 HydrophobicContact CG-CG 4.26Å; L222-V230 WeakPolarHBondContact CA-O 3.4Å; L222-L231 HydrophobicContact CD2-CB 4.32Å; L222-L231 HydrophobicContact CD2-CD1 3.54Å; L222-L231 HydrophobicContact CG-CD1 4.26Å
223	D	66.8	Low	68	Low	71 Å²	71	64.9 Å²	64.9	38%	0.38	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	116.5	172	-79.8	-28.3	0	0	0	108.9	S225 V230 R232	D223-S225 PolarHBondContact O-N 2.8Å; D223-V230 PolarHBondContact N-O 3.38Å; D223-V230 PolarHBondContact O-N 2.88Å; D223-R232 IonicContact OD2-NH1 3.74Å
224	N	62.8	Low	67.9	Low	110 Å²	110	64.5 Å²	64.5	59%	0.588	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.7	106.7	176.5	-70.3	-21	0	0	0	109.1	Q229	N224-Q229 WeakPolarHBondContact OD1-CG 3.34Å; N224-Q229 PolarHBondContact OD1-NE2 2.96Å; N224-Q229 VanDerWaalsContact OD1-NE2 3.11Å
225	S	62.5	Low	67.9	Low	57 Å²	57	69.4 Å²	69.4	40%	0.399	38%	0.376	S	S	.	.			trans	-84.8	168.4	164	79.7	0	0	0	0	110.4	D223 C227 C228	D223-S225 PolarHBondContact O-N 2.8Å; S225-C227 PolarHBondContact O-N 3.47Å; S225-C227 VanDerWaalsContact O-N 3.16Å; S225-C228 WeakPolarHBondContact CA-O 3.46Å; S225-C228 WeakPolarHBondContact CB-O 3.26Å; S225-C228 PolarHBondContact N-O 3.18Å; S225-C228 WeakPolarHBondContact OG-CA 3.49Å; S225-C228 PolarHBondContact OG-N 3.34Å; S225-C228 PolarHBondContact OG-O 3.11Å
226	I	60.2	Low	67.7	Low	187 Å²	187	70.3 Å²	70.3	96%	0.959	38%	0.38	S	S	*	.	S	Bend	trans	-60.2	-28.9	-174.9	-61.9	170	0	0	0	112.3
227	C	58.5	Low	67.5	Low	117 Å²	117	72.1 Å²	72.1	79%	0.791	39%	0.388	S	S	*	.	S	Bend	trans	-119.8	-19.1	-177.4	55.3	0	0	0	0	114.8	S225	S225-C227 PolarHBondContact O-N 3.47Å; S225-C227 VanDerWaalsContact O-N 3.16Å
228	C	58.4	Low	67.3	Low	73 Å²	73	70.9 Å²	70.9	49%	0.493	38%	0.384	S	S	.	.			trans	-142	150.2	-172.8	-62.6	0	0	0	0	111.8	S225	S225-C228 WeakPolarHBondContact CA-O 3.46Å; S225-C228 WeakPolarHBondContact CB-O 3.26Å; S225-C228 PolarHBondContact N-O 3.18Å; S225-C228 WeakPolarHBondContact OG-CA 3.49Å; S225-C228 PolarHBondContact OG-N 3.34Å; S225-C228 PolarHBondContact OG-O 3.11Å
229	Q	61.9	Low	67.3	Low	64 Å²	64	72.7 Å²	72.7	30%	0.299	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	131.2	164.7	-64.3	-175.7	-62.6	0	0	107.8	T211 N224	T211-Q229 WeakPolarHBondContact CB-O 3.45Å; T211-Q229 WeakPolarHBondContact CG2-O 3.36Å; T211-Q229 PolarHBondContact O-OE1 3.23Å; T211-Q229 VanDerWaalsContact O-OE1 3.09Å; N224-Q229 WeakPolarHBondContact OD1-CG 3.34Å; N224-Q229 PolarHBondContact OD1-NE2 2.96Å; N224-Q229 VanDerWaalsContact OD1-NE2 3.11Å
230	V	60.2	Low	67.8	Low	49 Å²	49	71.1 Å²	71.1	30%	0.297	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	125.1	178.7	-178	0	0	0	0	108.1	L222 D223 N238	L222-V230 WeakPolarHBondContact CA-O 3.4Å; D223-V230 PolarHBondContact N-O 3.38Å; D223-V230 PolarHBondContact O-N 2.88Å; V230-N238 HydrophobicContact CG1-CB 3.98Å
231	L	69.8	Low	68.4	Low	14 Å²	14	71 Å²	71	7%	0.073	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	128.2	175.3	-166.8	74	0	0	0	109.5	M215 F220 L222 V242	M215-L231 HydrophobicContact CB-CD1 3.69Å; M215-L231 HydrophobicContact CG-CD1 4.02Å; F220-L231 HydrophobicContact CB-CD1 3.45Å; F220-L231 VanDerWaalsContact CB-CD1 3.45Å; F220-L231 HydrophobicContact CB-CG 4.12Å; F220-L231 HydrophobicContact CD1-CD1 4.09Å; F220-L231 HydrophobicContact CD1-CD2 3.79Å; F220-L231 HydrophobicContact CD1-CG 3.89Å; F220-L231 HydrophobicContact CE1-CD2 4.2Å; F220-L231 HydrophobicContact CG-CD1 3.88Å; F220-L231 HydrophobicContact CG-CD2 4.26Å; F220-L231 HydrophobicContact CG-CG 4.21Å; L222-L231 HydrophobicContact CD2-CB 4.32Å; L222-L231 HydrophobicContact CD2-CD1 3.54Å; L222-L231 HydrophobicContact CG-CD1 4.26Å; L231-V242 HydrophobicContact CD2-CB 3.92Å; L231-V242 HydrophobicContact CD2-CG1 4.41Å; L231-V242 HydrophobicContact CD2-CG2 3.44Å; L231-V242 VanDerWaalsContact CD2-CG2 3.44Å
232	R	68.3	Low	69.1	Low	91 Å²	91	66.1 Å²	66.1	34%	0.343	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	125.8	179.4	-174.6	176.6	176.9	173.6	-5.7	110.2	E221 D223 K237 N238	E221-R232 HydrophobicContact CB-CB 4.11Å; E221-R232 PolarHBondContact N-O 3.09Å; E221-R232 PolarHBondContact O-N 3.04Å; D223-R232 IonicContact OD2-NH1 3.74Å; R232-K237 CarbonylContact C-O 3.56Å; R232-K237 VanDerWaalsContact CA-O 3.28Å; R232-K237 WeakPolarHBondContact CA-O 3.18Å; R232-N238 WeakPolarHBondContact CG-OD1 3.42Å
233	Y	72.2	Confident	70	Confident	28 Å²	28	65.3 Å²	65.3	11%	0.11	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-102.6	137	174.2	-163	-124	0	0	0	110.8	E109 F220 K235 W236 K237 I240	E109-Y233 PolarHBondContact OE1-OH 3.11Å; E109-Y233 VanDerWaalsContact OE2-CE1 3.28Å; E109-Y233 WeakPolarHBondContact OE2-CE1 3.1Å; E109-Y233 PolarHBondContact OE2-OH 2.99Å; F220-Y233 AromaticContact CD1-CD2 3.5Å; F220-Y233 HydrophobicContact CD1-CD2 3.5Å; F220-Y233 VanDerWaalsContact CD1-CD2 3.5Å; F220-Y233 HydrophobicContact CD1-CE2 4.25Å; F220-Y233 HydrophobicContact CD1-CG 4.34Å; F220-Y233 AromaticContact CE1-CD2 3.25Å; F220-Y233 HydrophobicContact CE1-CD2 3.25Å; F220-Y233 AromaticContact CE1-CE2 3.74Å; F220-Y233 HydrophobicContact CE1-CE2 3.74Å; F220-Y233 HydrophobicContact CE1-CG 4.05Å; F220-Y233 HydrophobicContact CG-CD2 4.43Å; F220-Y233 HydrophobicContact CZ-CD2 4.03Å; F220-Y233 HydrophobicContact CZ-CE2 4.05Å; Y233-K235 HydrophobicContact CD1-CB 3.81Å; Y233-K235 HydrophobicContact CE1-CB 3.86Å; Y233-K235 PolarHBondContact O-N 3.24Å; Y233-K235 VanDerWaalsContact O-N 3.09Å; Y233-W236 HydrophobicContact CD1-CB 4.4Å; Y233-W236 HydrophobicContact CD1-CD2 4.19Å; Y233-W236 AromaticContact CD1-CE3 3.97Å; Y233-W236 HydrophobicContact CD1-CE3 3.97Å; Y233-W236 HydrophobicContact CD1-CG 4.43Å; Y233-W236 HydrophobicContact CE1-CE3 4.46Å; Y233-W236 PolarHBondContact O-N 3.16Å; Y233-K237 PolarHBondContact N-O 2.84Å; Y233-K237 WeakPolarHBondContact O-CA 3.48Å; Y233-K237 PolarHBondContact O-N 3.07Å; Y233-I240 HydrophobicContact CD1-CD1 3.85Å; Y233-I240 HydrophobicContact CD2-CD1 4.28Å; Y233-I240 HydrophobicContact CG-CD1 3.58Å
234	P	69.3	Low	71.2	Confident	94 Å²	94	62 Å²	62	61%	0.61	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-33.7	-176.9	-28.4	35.9	0	0	0	113.8
235	K	70.1	Confident	72.6	Confident	115 Å²	115	56.8 Å²	56.8	50%	0.5	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-37.2	-178.5	-164.4	-179	178.9	-171.2	0	113.5	Y233	Y233-K235 HydrophobicContact CD1-CB 3.81Å; Y233-K235 HydrophobicContact CE1-CB 3.86Å; Y233-K235 PolarHBondContact O-N 3.24Å; Y233-K235 VanDerWaalsContact O-N 3.09Å
236	W	69.7	Low	73.9	Confident	20 Å²	20	54.1 Å²	54.1	8%	0.076	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.6	4.9	-164.7	-67.6	-27.9	0	0	0	114.5	D106 E109 H145 Y233 N238 H239 I240	D106-W236 WeakPolarHBondContact O-CZ2 3.5Å; E109-W236 HydrophobicContact CB-CH2 3.69Å; E109-W236 HydrophobicContact CB-CZ2 4.47Å; E109-W236 HydrophobicContact CB-CZ3 4.35Å; H145-W236 HydrophobicContact CB-CD2 3.85Å; H145-W236 HydrophobicContact CB-CE3 4.14Å; H145-W236 HydrophobicContact CB-CG 4.21Å; H145-W236 HydrophobicContact CB-CZ2 4.33Å; H145-W236 AromaticContact CD2-CD1 3.45Å; H145-W236 VanDerWaalsContact CD2-CD1 3.45Å; H145-W236 AromaticContact CD2-CG 3.42Å; H145-W236 VanDerWaalsContact CD2-CG 3.42Å; Y233-W236 HydrophobicContact CD1-CB 4.4Å; Y233-W236 HydrophobicContact CD1-CD2 4.19Å; Y233-W236 AromaticContact CD1-CE3 3.97Å; Y233-W236 HydrophobicContact CD1-CE3 3.97Å; Y233-W236 HydrophobicContact CD1-CG 4.43Å; Y233-W236 HydrophobicContact CE1-CE3 4.46Å; Y233-W236 PolarHBondContact O-N 3.16Å; W236-N238 PolarHBondContact O-N 3.3Å; W236-N238 VanDerWaalsContact O-N 3.17Å; W236-H239 PolarHBondContact O-N 2.91Å; W236-I240 HydrophobicContact CE3-CD1 3.55Å; W236-I240 HydrophobicContact CE3-CG1 3.78Å; W236-I240 HydrophobicContact CZ3-CD1 4.09Å; W236-I240 HydrophobicContact CZ3-CG1 4.26Å
237	K	72.9	Confident	75.3	Confident	132 Å²	132	45.2 Å²	45.2	57%	0.574	24%	0.236	S	C	*	.	B	Isolated β-bridge	trans	51.6	-120.1	-175.5	-57.8	175.4	-176	167.7	0	110.2	R232 Y233	R232-K237 CarbonylContact C-O 3.56Å; R232-K237 VanDerWaalsContact CA-O 3.28Å; R232-K237 WeakPolarHBondContact CA-O 3.18Å; Y233-K237 PolarHBondContact N-O 2.84Å; Y233-K237 WeakPolarHBondContact O-CA 3.48Å; Y233-K237 PolarHBondContact O-N 3.07Å
238	N	70.2	Confident	76.8	Confident	77 Å²	77	40.7 Å²	40.7	41%	0.412	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-1.7	-171.7	-57.9	0.1	0	0	0	112.7	V230 R232 W236 I240	V230-N238 HydrophobicContact CG1-CB 3.98Å; R232-N238 WeakPolarHBondContact CG-OD1 3.42Å; W236-N238 PolarHBondContact O-N 3.3Å; W236-N238 VanDerWaalsContact O-N 3.17Å; N238-I240 VanDerWaalsContact C-N 3.32Å; N238-I240 PolarHBondContact O-N 2.83Å
239	H	74.3	Confident	78.3	Confident	48 Å²	48	37.2 Å²	37.2	22%	0.222	18%	0.18	C	C	.	.			trans	-94.1	67.1	-176.2	-58	-63.9	0	0	0	109.7	H145 T146 D148 W236	H145-H239 WeakPolarHBondContact CA-O 3.39Å; H145-H239 PolarHBondContact CD2-O 2.83Å; T146-H239 PolarHBondContact N-O 2.82Å; T146-H239 VanDerWaalsContact OG1-CA 3.23Å; T146-H239 WeakPolarHBondContact OG1-CA 3.44Å; T146-H239 WeakPolarHBondContact OG1-CB 3.48Å; T146-H239 PolarHBondContact OG1-O 2.79Å; D148-H239 WeakPolarHBondContact CB-ND1 3.31Å; D148-H239 PolarHBondContact O-CE1 2.96Å; D148-H239 PolarHBondContact O-ND1 3.21Å; D148-H239 VanDerWaalsContact O-ND1 3.15Å; D148-H239 PolarHBondContact O-NE2 3.28Å; D148-H239 IonicContact OD2-CE1 3.5Å; D148-H239 IonicContact OD2-ND1 3.23Å; D148-H239 PolarHBondContact OD2-ND1 2.92Å; W236-H239 PolarHBondContact O-N 2.91Å
240	I	80.1	Confident	79.4	Confident	17 Å²	17	35.2 Å²	35.2	9%	0.087	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	131.8	-171.6	-164.8	170.8	0	0	0	111.6	R144 F220 Y233 W236 N238 V242	R144-I240 CarbonylContact O-C 3.53Å; R144-I240 WeakPolarHBondContact O-CA 3.46Å; F220-I240 HydrophobicContact CE1-CD1 4.16Å; Y233-I240 HydrophobicContact CD1-CD1 3.85Å; Y233-I240 HydrophobicContact CD2-CD1 4.28Å; Y233-I240 HydrophobicContact CG-CD1 3.58Å; W236-I240 HydrophobicContact CE3-CD1 3.55Å; W236-I240 HydrophobicContact CE3-CG1 3.78Å; W236-I240 HydrophobicContact CZ3-CD1 4.09Å; W236-I240 HydrophobicContact CZ3-CG1 4.26Å; N238-I240 VanDerWaalsContact C-N 3.32Å; N238-I240 PolarHBondContact O-N 2.83Å; I240-V242 HydrophobicContact CD1-CG2 3.93Å; I240-V242 HydrophobicContact CG1-CG2 3.79Å; I240-V242 HydrophobicContact CG2-CG2 4.32Å
241	F	85.6	Confident	80.4	Confident	5 Å²	5	35.9 Å²	35.9	2%	0.022	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	132.1	163.6	175.5	-91	0	0	0	108.5	S143 R144 T146 H163 L166 A167 F170 P193	S143-F241 CarbonylContact C-O 3.48Å; S143-F241 WeakPolarHBondContact CA-O 3.42Å; R144-F241 PolarHBondContact N-O 3.17Å; R144-F241 PolarHBondContact O-N 3.24Å; T146-F241 HydrophobicContact CG2-CB 4.3Å; H163-F241 AromaticContact CD2-CD2 3.9Å; H163-F241 AromaticContact CE1-CD2 3.92Å; H163-F241 AromaticContact CE1-CE2 3.94Å; H163-F241 AromaticContact NE2-CD2 3.55Å; L166-F241 HydrophobicContact CB-CB 4.33Å; L166-F241 HydrophobicContact CB-CD1 4.28Å; L166-F241 HydrophobicContact CB-CD2 4.2Å; L166-F241 HydrophobicContact CB-CG 3.98Å; L166-F241 HydrophobicContact CD1-CB 3.82Å; L166-F241 HydrophobicContact CD1-CG 4.38Å; A167-F241 HydrophobicContact CB-CE2 3.91Å; A167-F241 HydrophobicContact CB-CZ 4.12Å; F170-F241 HydrophobicContact CB-CE1 3.59Å; F170-F241 HydrophobicContact CB-CZ 3.98Å; F170-F241 HydrophobicContact CD1-CE1 4.38Å; F170-F241 HydrophobicContact CD1-CZ 4.3Å; F170-F241 HydrophobicContact CD2-CE1 4.44Å; F170-F241 AromaticContact CG-CE1 3.88Å; F170-F241 HydrophobicContact CG-CE1 3.88Å; F170-F241 HydrophobicContact CG-CZ 4.23Å; P193-F241 HydrophobicContact CB-CE2 3.98Å; P193-F241 HydrophobicContact CB-CZ 3.85Å; P193-F241 HydrophobicContact CG-CZ 4.2Å
242	V	87	Confident	81	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.006	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	113.6	-178.9	179.8	0	0	0	0	111.3	I141 L142 E210 F220 L231 I240 L244	I141-V242 HydrophobicContact CG2-CG1 3.47Å; I141-V242 VanDerWaalsContact CG2-CG1 3.47Å; L142-V242 WeakPolarHBondContact O-CA 3.26Å; E210-V242 VanDerWaalsContact CD-O 3.24Å; E210-V242 WeakPolarHBondContact CG-O 3.38Å; F220-V242 HydrophobicContact CE1-CG2 3.91Å; F220-V242 HydrophobicContact CZ-CG1 4.26Å; F220-V242 HydrophobicContact CZ-CG2 4.3Å; L231-V242 HydrophobicContact CD2-CB 3.92Å; L231-V242 HydrophobicContact CD2-CG1 4.41Å; L231-V242 HydrophobicContact CD2-CG2 3.44Å; L231-V242 VanDerWaalsContact CD2-CG2 3.44Å; I240-V242 HydrophobicContact CD1-CG2 3.93Å; I240-V242 HydrophobicContact CG1-CG2 3.79Å; I240-V242 HydrophobicContact CG2-CG2 4.32Å; V242-L244 HydrophobicContact CG1-CD2 4.33Å
243	G	90.1	Very high	81.6	Confident	2 Å²	2	40.9 Å²	40.9	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	142.3	172.7	0	0	0	0	0	112.5	I141 L142 F170	I141-G243 WeakPolarHBondContact CA-O 3.38Å; L142-G243 PolarHBondContact N-O 2.99Å; L142-G243 PolarHBondContact O-N 2.81Å; F170-G243 VanDerWaalsContact CZ-CA 3.44Å
244	L	90.6	Very high	81.8	Confident	2 Å²	2	43.2 Å²	43.2	1%	0.01	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	123.2	-175.9	-57.2	162.7	0	0	0	111.2	I141 F190 I191 L208 M215 V242 F246	I141-L244 HydrophobicContact CG1-CD2 4.13Å; I141-L244 HydrophobicContact CG2-CD2 4.33Å; F190-L244 VanDerWaalsContact CA-O 3.31Å; F190-L244 WeakPolarHBondContact CA-O 3.28Å; F190-L244 VanDerWaalsContact CB-O 3.31Å; F190-L244 WeakPolarHBondContact CB-O 3.48Å; I191-L244 HydrophobicContact CB-CB 4.33Å; I191-L244 HydrophobicContact CG1-CB 4.17Å; I191-L244 HydrophobicContact CG1-CD1 4.34Å; I191-L244 PolarHBondContact N-O 2.89Å; L208-L244 HydrophobicContact CD2-CD1 3.79Å; L208-L244 HydrophobicContact CG-CD1 4.24Å; M215-L244 HydrophobicContact CE-CD1 3.24Å; M215-L244 HydrophobicContact CE-CD2 3.93Å; M215-L244 HydrophobicContact CE-CG 4.16Å; M215-L244 HydrophobicContact SD-CD1 4.23Å; M215-L244 HydrophobicContact SD-CD2 3.77Å; V242-L244 HydrophobicContact CG1-CD2 4.33Å; L244-F246 HydrophobicContact CB-CE2 3.95Å; L244-F246 HydrophobicContact CB-CZ 4.32Å
245	I	92	Very high	82.1	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	136.5	174.2	-53.5	171.8	0	0	0	107.9	A139 L140 L142 F170 A174 I177 F190	A139-I245 CarbonylContact C-O 3.57Å; A139-I245 WeakPolarHBondContact CA-O 3.12Å; L140-I245 HydrophobicContact CB-CB 4.1Å; L140-I245 PolarHBondContact N-O 3.38Å; L140-I245 PolarHBondContact O-N 3.48Å; L142-I245 HydrophobicContact CD1-CD1 3.97Å; L142-I245 HydrophobicContact CG-CD1 4.41Å; F170-I245 HydrophobicContact CE2-CD1 4.15Å; F170-I245 HydrophobicContact CE2-CG1 4.01Å; F170-I245 HydrophobicContact CZ-CD1 4.5Å; F170-I245 HydrophobicContact CZ-CG1 3.94Å; A174-I245 HydrophobicContact CB-CD1 3.84Å; A174-I245 HydrophobicContact CB-CG1 4.11Å; I177-I245 HydrophobicContact CB-CD1 4.35Å; I177-I245 HydrophobicContact CD1-CD1 3.84Å; I177-I245 HydrophobicContact CG2-CD1 4.2Å; F190-I245 HydrophobicContact CB-CB 4.21Å; F190-I245 HydrophobicContact CB-CG1 3.78Å; F190-I245 HydrophobicContact CB-CG2 4.35Å
246	F	90.5	Very high	82.5	Confident	1 Å²	1	35.4 Å²	35.4	0%	0.004	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	138.9	179.9	-64.1	-80.7	0	0	0	110.1	L123 F127 L137 T138 A139 W187 A188 D189 I191 L208 L244	L123-F246 HydrophobicContact CD1-CD1 3.82Å; L123-F246 HydrophobicContact CD1-CE1 3.41Å; L123-F246 VanDerWaalsContact CD1-CE1 3.41Å; L123-F246 HydrophobicContact CD1-CZ 4.04Å; L123-F246 HydrophobicContact CD2-CE1 3.96Å; L123-F246 HydrophobicContact CD2-CE2 4.19Å; L123-F246 HydrophobicContact CD2-CZ 3.68Å; L123-F246 HydrophobicContact CG-CE1 4.35Å; F127-F246 AromaticContact CE2-CD2 3.72Å; F127-F246 HydrophobicContact CE2-CD2 3.72Å; F127-F246 HydrophobicContact CE2-CE2 4.14Å; F127-F246 HydrophobicContact CE2-CG 4.17Å; F127-F246 AromaticContact CZ-CD2 3.64Å; F127-F246 HydrophobicContact CZ-CD2 3.64Å; F127-F246 HydrophobicContact CZ-CE2 4.23Å; F127-F246 HydrophobicContact CZ-CG 4.34Å; L137-F246 HydrophobicContact CD1-CB 4.35Å; L137-F246 HydrophobicContact CD2-CD1 3.98Å; L137-F246 HydrophobicContact CG-CD1 4.48Å; T138-F246 WeakPolarHBondContact O-CA 3.46Å; A139-F246 HydrophobicContact CB-CD1 3.94Å; A139-F246 HydrophobicContact CB-CE1 3.75Å; W187-F246 HydrophobicContact CH2-CB 4.2Å; W187-F246 HydrophobicContact CZ3-CB 3.97Å; A188-F246 CarbonylContact C-O 3.57Å; A188-F246 VanDerWaalsContact CA-O 3.26Å; A188-F246 WeakPolarHBondContact CA-O 3.17Å; D189-F246 PolarHBondContact N-O 3.23Å; D189-F246 PolarHBondContact O-N 3.01Å; D189-F246 VanDerWaalsContact O-O 3.07Å; I191-F246 HydrophobicContact CD1-CE2 4.33Å; I191-F246 HydrophobicContact CG1-CD2 4.4Å; I191-F246 HydrophobicContact CG1-CE2 3.84Å; L208-F246 HydrophobicContact CD2-CE2 3.77Å; L208-F246 HydrophobicContact CD2-CZ 3.66Å; L244-F246 HydrophobicContact CB-CE2 3.95Å; L244-F246 HydrophobicContact CB-CZ 4.32Å
247	T	90.6	Very high	82.7	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	157	-179.7	-176	0	0	0	0	111.9	L137 T138 L140 L181 W187 A249 L256	L137-T247 WeakPolarHBondContact CD1-O 3.33Å; T138-T247 HydrophobicContact CG2-CG2 4.36Å; T138-T247 PolarHBondContact N-O 3.15Å; T138-T247 PolarHBondContact O-N 3.19Å; L140-T247 HydrophobicContact CD1-CG2 3.57Å; L181-T247 HydrophobicContact CD1-CG2 4.41Å; W187-T247 CarbonylContact O-C 3.51Å; W187-T247 WeakPolarHBondContact O-CA 3.39Å; W187-T247 PolarHBondContact O-OG1 3.46Å; W187-T247 VanDerWaalsContact O-OG1 3.07Å; T247-A249 HydrophobicContact CG2-CB 3.94Å; T247-A249 WeakPolarHBondContact OG1-CB 3.23Å; T247-A249 PolarHBondContact OG1-N 2.82Å; T247-A249 VanDerWaalsContact OG1-N 3.1Å; T247-L256 HydrophobicContact CG2-CD1 4.26Å; T247-L256 HydrophobicContact CG2-CD2 4.3Å
248	D	90	Very high	82.5	Confident	22 Å²	22	41.8 Å²	41.8	12%	0.118	21%	0.208	C	C	.	.	S	Bend	trans	-95.6	7.5	166.8	73	-11	0	0	0	114.5	R130 Y186 W187	R130-D248 IonicContact CZ-OD2 3.34Å; R130-D248 IonicContact NH2-OD2 3.76Å; R130-D248 PolarHBondContact NH2-OD2 2.63Å; Y186-D248 VanDerWaalsContact CA-OD1 3.28Å; Y186-D248 WeakPolarHBondContact CA-OD1 3.3Å; Y186-D248 VanDerWaalsContact CB-OD1 3.31Å; Y186-D248 WeakPolarHBondContact CB-OD1 3.25Å; Y186-D248 WeakPolarHBondContact CD1-OD1 3.34Å; W187-D248 PolarHBondContact N-OD1 3.21Å; W187-D248 PolarHBondContact O-N 3.23Å
249	A	88.2	Confident	82.3	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.208	C	C	.	.	S	Bend	trans	-64.3	131.5	164.9	0	0	0	0	0	109.3	T138 L181 Y186 T247 H253 L256	T138-A249 VanDerWaalsContact CB-O 3.3Å; T138-A249 WeakPolarHBondContact CB-O 3.45Å; T138-A249 PolarHBondContact OG1-O 2.78Å; L181-A249 HydrophobicContact CD2-CB 4.18Å; Y186-A249 VanDerWaalsContact CD1-CA 3.46Å; Y186-A249 HydrophobicContact CD1-CB 3.79Å; Y186-A249 HydrophobicContact CD2-CB 3.97Å; Y186-A249 HydrophobicContact CE1-CB 4.1Å; Y186-A249 HydrophobicContact CE2-CB 4.27Å; Y186-A249 HydrophobicContact CG-CB 3.72Å; T247-A249 HydrophobicContact CG2-CB 3.94Å; T247-A249 WeakPolarHBondContact OG1-CB 3.23Å; T247-A249 PolarHBondContact OG1-N 2.82Å; T247-A249 VanDerWaalsContact OG1-N 3.1Å; A249-H253 HydrophobicContact CB-CB 4.49Å; A249-L256 HydrophobicContact CB-CD1 4.04Å; A249-L256 HydrophobicContact CB-CD2 4.46Å; A249-L256 HydrophobicContact CB-CG 4.31Å
250	P	85.3	Confident	82.7	Confident	21 Å²	21	41.7 Å²	41.7	14%	0.136	21%	0.207	C	C	.	.			trans	-63.4	148.2	174.1	25.6	-30.8	0	0	0	110.4	Y252 H253 L256	P250-Y252 HydrophobicContact CB-CD1 3.72Å; P250-Y252 HydrophobicContact CB-CD2 4.34Å; P250-Y252 HydrophobicContact CB-CE1 3.3Å; P250-Y252 HydrophobicContact CB-CE2 3.96Å; P250-Y252 HydrophobicContact CB-CG 4.23Å; P250-Y252 VanDerWaalsContact CB-CZ 3.41Å; P250-Y252 HydrophobicContact CG-CD1 4.46Å; P250-Y252 HydrophobicContact CG-CD2 4.22Å; P250-Y252 HydrophobicContact CG-CE1 3.97Å; P250-Y252 HydrophobicContact CG-CE2 3.67Å; P250-Y252 PolarHBondContact O-N 2.9Å; P250-Y252 VanDerWaalsContact O-N 3.14Å; P250-H253 HydrophobicContact CG-CB 4.17Å; P250-H253 WeakPolarHBondContact O-CB 3.28Å; P250-H253 PolarHBondContact O-N 2.77Å; P250-L256 WeakPolarHBondContact O-CD1 3.39Å
251	D	82.2	Confident	82.8	Confident	64 Å²	64	43 Å²	43	34%	0.342	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-30	180	56.4	4.4	0	0	0	113.8	I112 T114 T138 H253 M257	I112-D251 HydrophobicContact CG2-CB 4.35Å; T114-D251 VanDerWaalsContact OG1-CG 3.23Å; T114-D251 PolarHBondContact OG1-OD2 2.85Å; T138-D251 HydrophobicContact CG2-CB 4.33Å; D251-H253 VanDerWaalsContact C-N 3.28Å; D251-H253 PolarHBondContact O-N 2.9Å; D251-M257 WeakPolarHBondContact O-CE 3.48Å
252	Y	81	Confident	82.7	Confident	178 Å²	178	45.1 Å²	45.1	70%	0.698	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-0.2	175.9	61.4	-99.2	0	0	0	114.8	P250	P250-Y252 HydrophobicContact CB-CD1 3.72Å; P250-Y252 HydrophobicContact CB-CD2 4.34Å; P250-Y252 HydrophobicContact CB-CE1 3.3Å; P250-Y252 HydrophobicContact CB-CE2 3.96Å; P250-Y252 HydrophobicContact CB-CG 4.23Å; P250-Y252 VanDerWaalsContact CB-CZ 3.41Å; P250-Y252 HydrophobicContact CG-CD1 4.46Å; P250-Y252 HydrophobicContact CG-CD2 4.22Å; P250-Y252 HydrophobicContact CG-CE1 3.97Å; P250-Y252 HydrophobicContact CG-CE2 3.67Å; P250-Y252 PolarHBondContact O-N 2.9Å; P250-Y252 VanDerWaalsContact O-N 3.14Å
253	H	81.1	Confident	82.4	Confident	32 Å²	32	47.7 Å²	47.7	15%	0.148	24%	0.237	C	C	.	.			trans	-66.9	131.3	-178.3	-167.3	-93.3	0	0	0	110.4	Y186 A249 P250 D251 V255 L256 M257	Y186-H253 AromaticContact CE2-CD2 3.77Å; Y186-H253 AromaticContact CE2-CE1 3.77Å; Y186-H253 AromaticContact CE2-NE2 3.53Å; Y186-H253 AromaticContact CZ-CD2 3.71Å; Y186-H253 AromaticContact CZ-NE2 3.86Å; Y186-H253 PolarHBondContact OH-CD2 3.16Å; Y186-H253 PolarHBondContact OH-NE2 2.86Å; A249-H253 HydrophobicContact CB-CB 4.49Å; P250-H253 HydrophobicContact CG-CB 4.17Å; P250-H253 WeakPolarHBondContact O-CB 3.28Å; P250-H253 PolarHBondContact O-N 2.77Å; D251-H253 VanDerWaalsContact C-N 3.28Å; D251-H253 PolarHBondContact O-N 2.9Å; H253-V255 VanDerWaalsContact CE1-CG2 3.46Å; H253-V255 WeakPolarHBondContact CE1-CG2 3.36Å; H253-V255 WeakPolarHBondContact ND1-CB 3.46Å; H253-V255 PolarHBondContact ND1-N 2.59Å; H253-V255 PolarHBondContact O-N 3.23Å; H253-L256 HydrophobicContact CB-CG 4.43Å; H253-L256 PolarHBondContact O-N 3.43Å; H253-M257 PolarHBondContact O-N 3.41Å
254	P	76.7	Confident	81.9	Confident	77 Å²	77	50.6 Å²	50.6	50%	0.5	25%	0.25	S	S	.	.	H	α-helix	trans	-58.5	-30.2	-174.2	22.4	-34.5	0	0	0	112.7	L256 M257 H258	P254-L256 VanDerWaalsContact C-N 3.3Å; P254-L256 PolarHBondContact O-N 2.83Å; P254-M257 WeakPolarHBondContact O-CB 3.28Å; P254-M257 PolarHBondContact O-N 3.3Å; P254-M257 VanDerWaalsContact O-N 3.15Å; P254-H258 PolarHBondContact O-N 2.94Å; P254-H258 PolarHBondContact O-ND1 3.22Å
255	V	76.6	Confident	81.3	Confident	44 Å²	44	53.8 Å²	53.8	27%	0.267	27%	0.266	S	S	.	.	H	α-helix	trans	-67	-32.5	179.3	175.2	0	0	0	0	111.8	L181 L184 H253 M257 H258 I259	L181-V255 HydrophobicContact CD2-CG1 4.34Å; L184-V255 HydrophobicContact CD1-CB 3.94Å; L184-V255 HydrophobicContact CD1-CG1 3.71Å; L184-V255 HydrophobicContact CD1-CG2 3.55Å; H253-V255 VanDerWaalsContact CE1-CG2 3.46Å; H253-V255 WeakPolarHBondContact CE1-CG2 3.36Å; H253-V255 WeakPolarHBondContact ND1-CB 3.46Å; H253-V255 PolarHBondContact ND1-N 2.59Å; H253-V255 PolarHBondContact O-N 3.23Å; V255-M257 VanDerWaalsContact C-N 3.33Å; V255-H258 PolarHBondContact O-N 2.81Å; V255-I259 WeakPolarHBondContact O-CG1 3.36Å
256	L	78.8	Confident	80.6	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-72.3	-31	174	-58.9	-173.7	0	0	0	111.9	I112 T138 L140 L181 T247 A249 P250 H253 P254 H258 I259	I112-L256 HydrophobicContact CD1-CB 4.05Å; I112-L256 VanDerWaalsContact CD1-O 3.24Å; I112-L256 WeakPolarHBondContact CD1-O 3.33Å; I112-L256 HydrophobicContact CG2-CD1 4.35Å; T138-L256 HydrophobicContact CG2-CD1 3.98Å; L140-L256 HydrophobicContact CD1-CD2 4.04Å; L140-L256 HydrophobicContact CD2-CD2 4.06Å; L181-L256 HydrophobicContact CD1-CD2 4.36Å; L181-L256 HydrophobicContact CD2-CD2 3.81Å; T247-L256 HydrophobicContact CG2-CD1 4.26Å; T247-L256 HydrophobicContact CG2-CD2 4.3Å; A249-L256 HydrophobicContact CB-CD1 4.04Å; A249-L256 HydrophobicContact CB-CD2 4.46Å; A249-L256 HydrophobicContact CB-CG 4.31Å; P250-L256 WeakPolarHBondContact O-CD1 3.39Å; H253-L256 HydrophobicContact CB-CG 4.43Å; H253-L256 PolarHBondContact O-N 3.43Å; P254-L256 VanDerWaalsContact C-N 3.3Å; P254-L256 PolarHBondContact O-N 2.83Å; L256-H258 PolarHBondContact O-N 3.17Å; L256-I259 HydrophobicContact CD2-CD1 3.87Å; L256-I259 PolarHBondContact O-N 3.09Å
257	M	72.9	Confident	79.8	Confident	123 Å²	123	62 Å²	62	61%	0.606	31%	0.307	S	S	*	.	H	α-helix	trans	-72.4	-13.8	177.2	-64.1	-73.3	142.5	0	0	113.8	D251 H253 P254 V255	D251-M257 WeakPolarHBondContact O-CE 3.48Å; H253-M257 PolarHBondContact O-N 3.41Å; P254-M257 WeakPolarHBondContact O-CB 3.28Å; P254-M257 PolarHBondContact O-N 3.3Å; P254-M257 VanDerWaalsContact O-N 3.15Å; V255-M257 VanDerWaalsContact C-N 3.33Å
258	H	69.7	Low	78.9	Confident	164 Å²	164	67.2 Å²	67.2	76%	0.759	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	-1.3	177.6	-70.7	81.1	0	0	0	113.3	P254 V255 L256	P254-H258 PolarHBondContact O-N 2.94Å; P254-H258 PolarHBondContact O-ND1 3.22Å; V255-H258 PolarHBondContact O-N 2.81Å; L256-H258 PolarHBondContact O-N 3.17Å
259	I	64.9	Low	77.9	Confident	81 Å²	81	71.3 Å²	71.3	42%	0.415	35%	0.352	S	S	.	.			trans	-81.9	0	172.3	-65.6	168.1	0	0	0	108.6	L140 I177 V255 L256	L140-I259 HydrophobicContact CD2-CD1 3.7Å; L140-I259 HydrophobicContact CD2-CG2 4.33Å; I177-I259 HydrophobicContact CD1-CG2 4.01Å; I177-I259 HydrophobicContact CG1-CG2 4.47Å; I177-I259 HydrophobicContact CG2-CD1 3.81Å; V255-I259 WeakPolarHBondContact O-CG1 3.36Å; L256-I259 HydrophobicContact CD2-CD1 3.87Å; L256-I259 PolarHBondContact O-N 3.09Å

Retrieved 259 of 259 residues in 241.1 ms (Link to these results)

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