G4VC75_SCHMA Loading...

Putative ubiquitin-conjugating enzyme morgue

AlphaFold DB , UniProt , Accession G4VC75, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 374 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.1	Very low	39.3	Very low	232 Å²	232	178.9 Å²	178.9	100%	1.143	84%	0.843	S	S	*	*				0	75.1	0	-60	-177.2	-173.3	0	0	105.6
2	T	35.6	Very low	40.1	Very low	135 Å²	135	171.9 Å²	171.9	83%	0.828	84%	0.838	S	S	*	*				46.1	118.1	101.6	36.5	0	0	0	0	110.9
3	E	38.1	Very low	40.2	Very low	193 Å²	193	167.3 Å²	167.3	90%	0.902	83%	0.834	S	S	*	*				-154.4	149.2	53.6	-74	173.9	135.9	0	0	114.4
4	N	35.4	Very low	40.9	Very low	145 Å²	145	167.1 Å²	167.1	78%	0.775	84%	0.837	S	S	*	*			trans	-66.6	151.9	168.8	-69.6	-34.3	0	0	0	113
5	R	42.3	Very low	40.9	Very low	241 Å²	241	166.3 Å²	166.3	91%	0.909	84%	0.837	S	S	*	*			trans	-137.5	107	145.6	-97.7	-173.5	175.6	-176.3	-1.6	110.8
6	L	39.5	Very low	41.6	Very low	120 Å²	120	162.8 Å²	162.8	63%	0.628	83%	0.833	S	S	*	*			trans	-64.4	147	161.4	-83.5	96.9	0	0	0	110.5	E8	L6-E8 HydrophobicContact CD2-CG 4Å
7	F	44.3	Very low	41.5	Very low	206 Å²	206	157.2 Å²	157.2	90%	0.904	83%	0.825	S	S	*	*			trans	-132.3	109.5	143.7	-97.9	-83.6	0	0	0	107.7
8	E	39.5	Very low	41.8	Very low	148 Å²	148	157.8 Å²	157.8	69%	0.692	83%	0.829	S	S	*	*			trans	-80.1	140.5	172.1	-88.6	166.8	159.8	0	0	111.6	L6	L6-E8 HydrophobicContact CD2-CG 4Å
9	E	35.2	Very low	42.1	Very low	161 Å²	161	159.3 Å²	159.3	75%	0.752	83%	0.831	S	S	*	*			trans	41.2	124.5	136.1	-64.2	178.9	165.5	0	0	121.3
10	K	41.3	Very low	41.9	Very low	209 Å²	209	160.9 Å²	160.9	91%	0.909	83%	0.834	S	S	*	*			trans	-141.7	104.9	136.1	-108	179.2	-178.6	177.1	0	109.9
11	E	41.3	Very low	41.9	Very low	178 Å²	178	159.1 Å²	159.1	83%	0.832	83%	0.833	S	S	*	*			trans	-63.5	139.2	162.6	-63	-179.1	142.5	0	0	109.9
12	A	49	Very low	41.9	Very low	95 Å²	95	155.9 Å²	155.9	79%	0.785	82%	0.82	S	S	*	*			trans	-125.4	100.7	163.8	0	0	0	0	0	107.6
13	S	41.4	Very low	42	Very low	112 Å²	112	158.5 Å²	158.5	78%	0.783	82%	0.82	S	S	*	*			trans	-73	126	165.9	47	0	0	0	0	109.3
14	N	50	Low	41.6	Very low	164 Å²	164	155.7 Å²	155.7	88%	0.877	82%	0.816	S	S	*	*			trans	-115.6	99.4	163.3	-85.1	-12.2	0	0	0	108.1
15	D	40.3	Very low	41.4	Very low	155 Å²	155	153 Å²	153	83%	0.829	81%	0.809	S	S	*	*			trans	-74.6	125.2	162	179.1	16.8	0	0	0	108.5
16	S	52.5	Low	40.9	Very low	111 Å²	111	148.1 Å²	148.1	78%	0.776	80%	0.8	S	S	*	*			trans	-142	92.4	163.7	68.2	0	0	0	0	108.4
17	G	40.2	Very low	40.5	Very low	68 Å²	68	150.4 Å²	150.4	70%	0.701	81%	0.812	S	S	*	*			trans	-56.2	133.8	163.4	0	0	0	0	0	110.5
18	N	46.1	Very low	39.7	Very low	167 Å²	167	150.8 Å²	150.8	89%	0.893	81%	0.814	S	S	*	*			trans	-122.7	108.3	165.3	-135.3	32.6	0	0	0	106.5
19	E	46.9	Very low	39.2	Very low	187 Å²	187	147.1 Å²	147.1	87%	0.874	82%	0.816	S	S	*	*			trans	-64.6	134	171.3	-63.9	-178.8	148.5	0	0	109.5
20	E	38.4	Very low	38.8	Very low	191 Å²	191	144.2 Å²	144.2	89%	0.893	82%	0.819	S	S	*	*			trans	-68.6	144.2	166.2	-65.1	-171.6	146.5	0	0	110
21	P	43.2	Very low	38.1	Very low	124 Å²	124	138.5 Å²	138.5	81%	0.805	81%	0.811	S	S	*	*			trans	-111.2	140	154.2	31.7	-20.5	0	0	0	111.9
22	D	40.1	Very low	37.6	Very low	163 Å²	163	142.8 Å²	142.8	87%	0.872	82%	0.82	S	S	*	*			trans	-57.7	162.6	-175.3	-81.9	-57.1	0	0	0	117.1
23	K	37.2	Very low	36.6	Very low	190 Å²	190	143.8 Å²	143.8	83%	0.826	82%	0.821	S	S	*	*			trans	-60.2	135.8	-177.7	-68.2	164.9	178.1	165.7	0	114.9
24	V	29.5	Very low	35.9	Very low	134 Å²	134	144.1 Å²	144.1	81%	0.812	82%	0.823	S	S	*	*				50.2	119.7	123.9	-171.6	0	0	0	0	119.4
25	S	30.6	Very low	34.9	Very low	90 Å²	90	141.1 Å²	141.1	63%	0.629	82%	0.816	S	S	*	*			trans	135.8	121.6	136.6	79.3	0	0	0	0	108.4
26	D	32.5	Very low	34.3	Very low	138 Å²	138	140.1 Å²	140.1	74%	0.738	82%	0.815	S	S	*	*				-176	171.3	62.4	-88.1	-55.3	0	0	0	110.8
27	L	30.6	Very low	33.3	Very low	167 Å²	167	140.5 Å²	140.5	87%	0.874	82%	0.818	S	S	*	*			trans	107	87.7	151.8	-67.4	133.9	0	0	0	119.2
28	F	27.1	Very low	32.6	Very low	214 Å²	214	146.2 Å²	146.2	94%	0.939	83%	0.826	S	S	*	*			trans	-54.8	148.7	138	-96.3	-98.3	0	0	0	112.6
29	G	29.4	Very low	32	Very low	71 Å²	71	145.2 Å²	145.2	73%	0.732	83%	0.826	S	S	*	*			trans	140	85.5	162.3	0	0	0	0	0	112.5
30	A	27.9	Very low	31	Very low	100 Å²	100	142.2 Å²	142.2	83%	0.826	82%	0.82	S	S	*	*				85.8	122.4	83	0	0	0	0	0	115.5
31	A	26.6	Very low	30.8	Very low	90 Å²	90	139.1 Å²	139.1	74%	0.744	82%	0.82	S	S	*	*			trans	75.1	100.3	140	0	0	0	0	0	120.8
32	W	29.4	Very low	30.1	Very low	268 Å²	268	141.5 Å²	141.5	100%	1.015	82%	0.82	S	S	*	*			trans	-127.9	109	145.2	-81.1	55.6	0	0	0	109.5
33	S	29.7	Very low	29.8	Very low	115 Å²	115	141.6 Å²	141.6	80%	0.804	82%	0.821	S	S	*	*			trans	-83.1	140.4	174.5	43.6	0	0	0	0	111.4
34	S	26.3	Very low	29.2	Very low	119 Å²	119	143.7 Å²	143.7	83%	0.832	82%	0.823	S	S	*	*			trans	-85.7	145.7	172.2	50.2	0	0	0	0	111.6
35	S	29.5	Very low	29.4	Very low	102 Å²	102	144.2 Å²	144.2	71%	0.713	83%	0.827	S	S	*	*			trans	-153.8	121.3	163.7	-50	0	0	0	0	110.3
36	T	27	Very low	29.3	Very low	134 Å²	134	145.1 Å²	145.1	82%	0.822	83%	0.83	S	S	*	*			trans	58.7	135.1	147.6	41.7	0	0	0	0	118.3
37	S	31.5	Very low	29.4	Very low	118 Å²	118	145.7 Å²	145.7	83%	0.825	84%	0.838	S	S	*	*			cis	-167.3	157.6	49.1	10.4	0	0	0	0	112.5
38	E	25.3	Very low	29.4	Very low	188 Å²	188	146.7 Å²	146.7	88%	0.879	84%	0.836	S	S	*	*			trans	-64.9	144.8	178.2	-62.9	163.9	127.8	0	0	114.5
39	V	34.1	Very low	29.5	Very low	146 Å²	146	141.4 Å²	141.4	89%	0.885	83%	0.826	S	S	*	*			trans	-145.4	119.2	143	-180	0	0	0	0	110
40	T	25.6	Very low	29.5	Very low	124 Å²	124	149.6 Å²	149.6	76%	0.761	84%	0.835	S	S	*	*			trans	-74	144.9	168.5	41.8	0	0	0	0	113.2
41	S	33.3	Very low	29.5	Very low	126 Å²	126	150 Å²	150	88%	0.881	83%	0.828	S	S	*	*				170.4	158.4	117.6	66.5	0	0	0	0	113
42	Q	28.9	Very low	29.5	Very low	174 Å²	174	151 Å²	151	81%	0.813	83%	0.83	S	S	*	*			trans	-84.3	153.4	-162	-60.9	156.6	-20.4	0	0	113.1
43	N	33.1	Very low	29.4	Very low	166 Å²	166	144.8 Å²	144.8	89%	0.888	83%	0.826	S	S	*	*				-173.3	138.8	120.9	-97.7	-30.4	0	0	0	114.8
44	R	26.3	Very low	29.3	Very low	233 Å²	233	143.2 Å²	143.2	88%	0.879	82%	0.82	S	S	*	*			trans	-76.2	152.4	179.8	-67.4	171.4	170.9	-170.3	-3.1	112.9
45	V	31.9	Very low	29.3	Very low	145 Å²	145	147.9 Å²	147.9	88%	0.879	82%	0.819	S	S	*	*				-153.8	136	128.9	-175.9	0	0	0	0	110
46	P	29.3	Very low	29.2	Very low	109 Å²	109	151 Å²	151	71%	0.708	83%	0.826	S	S	*	*			trans	-105.8	158.7	-175.5	38.8	-30.6	0	0	0	114.7
47	V	34	Very low	29.2	Very low	150 Å²	150	152.2 Å²	152.2	91%	0.909	82%	0.821	S	S	*	*			trans	-129.2	129.3	165.1	179.7	0	0	0	0	111.1
48	K	31.7	Very low	29.1	Very low	188 Å²	188	151.6 Å²	151.6	82%	0.817	81%	0.813	S	S	*	*			trans	-74.1	134.5	-177.4	-63.5	172.5	173.7	175.6	0	110.8
49	S	29.2	Very low	29.3	Very low	104 Å²	104	148.9 Å²	148.9	73%	0.727	81%	0.809	S	S	*	*				110.4	121.1	77	64.9	0	0	0	0	112.9
50	R	28.8	Very low	29	Very low	243 Å²	243	147.5 Å²	147.5	92%	0.917	80%	0.802	S	S	*	*				170.8	154.8	126.5	-95.7	-171.2	171.9	-177.3	-2	112
51	P	29	Very low	29.1	Very low	107 Å²	107	145 Å²	145	70%	0.695	79%	0.789	S	S	*	*				-126.2	161.9	-128.1	41	-26.6	0	0	0	117.1
52	S	26.7	Very low	29	Very low	112 Å²	112	143.2 Å²	143.2	78%	0.783	77%	0.774	S	S	*	*			trans	52.5	111.8	138.1	66.5	0	0	0	0	122.3
53	C	27.1	Very low	29	Very low	137 Å²	137	141.2 Å²	141.2	93%	0.926	77%	0.773	S	S	*	*			trans	-174.1	136.1	133.3	-143.2	0	0	0	0	106.9
54	A	27.5	Very low	28.9	Very low	82 Å²	82	141 Å²	141	68%	0.678	77%	0.767	S	S	*	*			cis	-158.3	136.2	-24.3	0	0	0	0	0	105.4
55	R	25.7	Very low	29	Very low	217 Å²	217	137.8 Å²	137.8	82%	0.819	76%	0.762	S	S	*	*			trans	46.8	86.7	159.4	-58.7	-176.9	-167	173.6	4.3	118.1	F57	R55-F57 HydrophobicContact CB-CE2 4.47Å; R55-F57 PolarHBondContact O-N 3.36Å
56	I	27.7	Very low	28.8	Very low	167 Å²	167	135.6 Å²	135.6	86%	0.856	75%	0.753	S	S	*	*			trans	-78.9	107.5	150.8	-61.6	169.8	0	0	0	106.5
57	F	27	Very low	28.7	Very low	161 Å²	161	138 Å²	138	71%	0.706	75%	0.754	S	S	*	*			trans	-77.5	129.1	159.1	-77.9	-81.8	0	0	0	107.2	R55 V59	R55-F57 HydrophobicContact CB-CE2 4.47Å; R55-F57 PolarHBondContact O-N 3.36Å; F57-V59 PolarHBondContact O-N 2.67Å
58	P	28.2	Very low	28.5	Very low	104 Å²	104	135.9 Å²	135.9	68%	0.675	74%	0.742	S	S	*	*			trans	-69.1	109.5	170.7	28.8	-28.6	0	0	0	106.7	T60	P58-T60 PolarHBondContact O-N 3.39Å
59	V	30.4	Very low	28.3	Very low	131 Å²	131	133.2 Å²	133.2	79%	0.794	74%	0.741	S	S	*	*			trans	-69.1	89.7	164.2	179.6	0	0	0	0	105.6	F57 C61	F57-V59 PolarHBondContact O-N 2.67Å; V59-C61 PolarHBondContact O-N 3.04Å; V59-C61 VanDerWaalsContact O-N 3.15Å
60	T	28	Very low	28.3	Very low	118 Å²	118	132.4 Å²	132.4	72%	0.724	73%	0.732	S	S	*	*			trans	-57.8	116.2	163.3	39.8	0	0	0	0	107.2	P58 P62	P58-T60 PolarHBondContact O-N 3.39Å; T60-P62 VanDerWaalsContact O-CD 3.26Å; T60-P62 WeakPolarHBondContact O-CD 3.29Å
61	C	26.4	Very low	28.3	Very low	72 Å²	72	126.5 Å²	126.5	49%	0.486	73%	0.725	S	S	.	*			trans	-46.5	112.1	170.2	-167	0	0	0	0	108.5	V59 V63	V59-C61 PolarHBondContact O-N 3.04Å; V59-C61 VanDerWaalsContact O-N 3.15Å; C61-V63 VanDerWaalsContact C-N 3.34Å; C61-V63 PolarHBondContact O-N 3.33Å
62	P	31.1	Very low	28.4	Very low	87 Å²	87	132 Å²	132	57%	0.565	73%	0.734	S	S	*	*			trans	-75.4	97.3	178.8	28.6	-27.5	0	0	0	106.6	T60 Q64	T60-P62 VanDerWaalsContact O-CD 3.26Å; T60-P62 WeakPolarHBondContact O-CD 3.29Å; P62-Q64 HydrophobicContact CB-CB 4.41Å; P62-Q64 HydrophobicContact CB-CG 4.33Å; P62-Q64 PolarHBondContact O-N 2.91Å
63	V	30.4	Very low	28.7	Very low	133 Å²	133	130.5 Å²	130.5	81%	0.806	72%	0.723	S	S	*	*			trans	-68.3	69.9	151.7	-175.6	0	0	0	0	106	C61 Q65	C61-V63 VanDerWaalsContact C-N 3.34Å; C61-V63 PolarHBondContact O-N 3.33Å; V63-Q65 PolarHBondContact O-N 3.46Å
64	Q	30.6	Very low	28.7	Very low	161 Å²	161	131.1 Å²	131.1	75%	0.752	72%	0.717	S	S	*	*			trans	-90.8	99.1	169.1	-94.3	178.7	-29.9	0	0	107.3	P62 S66	P62-Q64 HydrophobicContact CB-CB 4.41Å; P62-Q64 HydrophobicContact CB-CG 4.33Å; P62-Q64 PolarHBondContact O-N 2.91Å; Q64-S66 PolarHBondContact O-N 3.18Å
65	Q	27.5	Very low	29	Very low	166 Å²	166	137.7 Å²	137.7	78%	0.776	73%	0.726	S	S	*	*			trans	-60.5	85.8	150	-72.5	175.8	-20.2	0	0	107.3	V63 H67	V63-Q65 PolarHBondContact O-N 3.46Å; Q65-H67 PolarHBondContact O-N 3.31Å
66	S	29.5	Very low	29.3	Very low	98 Å²	98	132 Å²	132	69%	0.685	72%	0.717	S	S	*	*			trans	-75.8	83.2	163.8	60.1	0	0	0	0	107.5	Q64 V68	Q64-S66 PolarHBondContact O-N 3.18Å; S66-V68 PolarHBondContact O-N 2.99Å
67	H	26.8	Very low	29.4	Very low	159 Å²	159	130.2 Å²	130.2	74%	0.736	71%	0.713	S	S	*	*			trans	-64.6	82.9	152.1	-85.5	-77.3	0	0	0	107.3	Q65	Q65-H67 PolarHBondContact O-N 3.31Å
68	V	29.6	Very low	29.7	Very low	107 Å²	107	127.7 Å²	127.7	65%	0.648	71%	0.706	S	S	*	*			trans	-99.8	92.1	157.4	-177.8	0	0	0	0	105.8	S66 T70	S66-V68 PolarHBondContact O-N 2.99Å; V68-T70 HydrophobicContact CG1-CG2 4.15Å; V68-T70 PolarHBondContact O-N 3.05Å
69	T	26.6	Very low	29.7	Very low	131 Å²	131	129.4 Å²	129.4	80%	0.804	71%	0.71	S	S	*	*			trans	-64.1	82.7	162.7	13.3	0	0	0	0	108.4
70	T	30.4	Very low	29.8	Very low	87 Å²	87	132.4 Å²	132.4	53%	0.534	71%	0.708	S	S	.	*			trans	-84	125.1	152.1	41.5	0	0	0	0	107.3	V68 Y72	V68-T70 HydrophobicContact CG1-CG2 4.15Å; V68-T70 PolarHBondContact O-N 3.05Å; T70-Y72 PolarHBondContact O-N 3.24Å
71	P	29.1	Very low	30.1	Very low	120 Å²	120	135 Å²	135	78%	0.779	72%	0.717	S	S	*	*			trans	-71.4	98.1	178	30	-30	0	0	0	107.7	S73	P71-S73 PolarHBondContact O-N 3.12Å
72	Y	30.3	Very low	30.4	Very low	223 Å²	223	136 Å²	136	88%	0.875	72%	0.724	S	S	*	*			trans	-69.9	73.5	154.3	-81.4	-82.1	0	0	0	107.2	T70 N74	T70-Y72 PolarHBondContact O-N 3.24Å; Y72-N74 PolarHBondContact O-N 3.37Å
73	S	33	Very low	30.4	Very low	80 Å²	80	137.7 Å²	137.7	56%	0.559	74%	0.735	S	S	*	*			trans	-72.2	109.8	166.8	173.1	0	0	0	0	107.6	P71 Y75	P71-S73 PolarHBondContact O-N 3.12Å; S73-Y75 PolarHBondContact O-N 3.16Å
74	N	27.7	Very low	30.8	Very low	149 Å²	149	138 Å²	138	80%	0.797	74%	0.737	S	S	*	*			trans	29	82.5	145.9	-67.5	-18.4	0	0	0	115.5	Y72	Y72-N74 PolarHBondContact O-N 3.37Å
75	Y	32.4	Very low	31.1	Very low	220 Å²	220	134.7 Å²	134.7	86%	0.863	73%	0.732	S	S	*	*			trans	-100.2	119.4	151.3	-75.3	-76.8	0	0	0	107.9	S73 V77	S73-Y75 PolarHBondContact O-N 3.16Å; Y75-V77 PolarHBondContact O-N 3.16Å
76	P	31.8	Very low	31.3	Very low	97 Å²	97	132.7 Å²	132.7	63%	0.63	74%	0.737	S	S	*	*			trans	-62	132.2	175	25.7	-29	0	0	0	107.7	I78	P76-I78 HydrophobicContact CG-CG1 4.23Å; P76-I78 PolarHBondContact O-N 2.89Å
77	V	31.4	Very low	31.8	Very low	130 Å²	130	138.7 Å²	138.7	79%	0.788	74%	0.744	S	S	*	*			trans	-58.5	98.4	161.5	177.9	0	0	0	0	105.6	Y75 D79	Y75-V77 PolarHBondContact O-N 3.16Å; V77-D79 PolarHBondContact O-N 3.47Å
78	I	32.3	Very low	32.1	Very low	108 Å²	108	141 Å²	141	55%	0.554	75%	0.752	S	S	*	*			trans	-80.1	99.8	172.8	-70.6	-177.2	0	0	0	106	P76 Y80	P76-I78 HydrophobicContact CG-CG1 4.23Å; P76-I78 PolarHBondContact O-N 2.89Å; I78-Y80 VanDerWaalsContact C-N 3.29Å; I78-Y80 HydrophobicContact CB-CD2 4.41Å; I78-Y80 HydrophobicContact CB-CE2 4.49Å; I78-Y80 HydrophobicContact CG2-CD1 4.39Å; I78-Y80 HydrophobicContact CG2-CD2 2.95Å; I78-Y80 HydrophobicContact CG2-CE1 4.46Å; I78-Y80 HydrophobicContact CG2-CE2 3.04Å; I78-Y80 HydrophobicContact CG2-CG 3.66Å; I78-Y80 PolarHBondContact O-N 3.31Å
79	D	29.2	Very low	32.8	Very low	141 Å²	141	143.6 Å²	143.6	75%	0.754	76%	0.761	S	S	*	*			trans	-62.4	88.9	162.6	-83.7	-32.9	0	0	0	109.3	V77	V77-D79 PolarHBondContact O-N 3.47Å
80	Y	32.7	Very low	33.4	Very low	193 Å²	193	146.7 Å²	146.7	76%	0.757	76%	0.763	S	S	*	*			trans	-117.2	62.6	161.5	-72.5	-47	0	0	0	110.4	I78	I78-Y80 VanDerWaalsContact C-N 3.29Å; I78-Y80 HydrophobicContact CB-CD2 4.41Å; I78-Y80 HydrophobicContact CB-CE2 4.49Å; I78-Y80 HydrophobicContact CG2-CD1 4.39Å; I78-Y80 HydrophobicContact CG2-CD2 2.95Å; I78-Y80 HydrophobicContact CG2-CE1 4.46Å; I78-Y80 HydrophobicContact CG2-CE2 3.04Å; I78-Y80 HydrophobicContact CG2-CG 3.66Å; I78-Y80 PolarHBondContact O-N 3.31Å
81	L	33.2	Very low	33.7	Very low	174 Å²	174	148.2 Å²	148.2	91%	0.911	78%	0.777	S	S	*	*			trans	-126.9	56.2	154	-69.9	175.9	0	0	0	109.6
82	S	32.2	Very low	34.1	Very low	91 Å²	91	146.8 Å²	146.8	64%	0.636	77%	0.769	S	S	*	*			trans	-70.2	131	153.8	-62.5	0	0	0	0	107.7	V84	S82-V84 PolarHBondContact O-N 2.88Å
83	P	32.7	Very low	34.8	Very low	123 Å²	123	142.2 Å²	142.2	80%	0.799	77%	0.77	S	S	*	*			trans	-65.7	107.5	179	26.4	-30.1	0	0	0	107.6	S85	P83-S85 VanDerWaalsContact C-N 3.29Å; P83-S85 PolarHBondContact O-N 3.1Å
84	V	37.1	Very low	35.8	Very low	139 Å²	139	143.2 Å²	143.2	84%	0.842	78%	0.777	S	S	*	*			trans	-65.5	99.7	171.8	177.5	0	0	0	0	106.7	S82 S86	S82-V84 PolarHBondContact O-N 2.88Å; V84-S86 PolarHBondContact O-N 3.48Å
85	S	37.2	Very low	36.6	Very low	93 Å²	93	141.2 Å²	141.2	65%	0.65	77%	0.773	S	S	*	*			trans	-35.8	126.7	169.4	-172.9	0	0	0	0	110.7	P83 R87	P83-S85 VanDerWaalsContact C-N 3.29Å; P83-S85 PolarHBondContact O-N 3.1Å; S85-R87 VanDerWaalsContact C-N 3.29Å; S85-R87 PolarHBondContact O-N 3.23Å
86	S	33.1	Very low	37.9	Very low	124 Å²	124	139.2 Å²	139.2	87%	0.867	77%	0.774	S	S	*	*			trans	-46.7	79.6	179.6	-42.1	0	0	0	0	113.2	V84	V84-S86 PolarHBondContact O-N 3.48Å
87	R	38.2	Very low	39.4	Very low	223 Å²	223	139.2 Å²	139.2	84%	0.842	78%	0.776	S	S	*	*			trans	-87.3	110.7	164.3	-76.4	-174.6	-176.3	178.9	2.7	106.7	S85 I89	S85-R87 VanDerWaalsContact C-N 3.29Å; S85-R87 PolarHBondContact O-N 3.23Å; R87-I89 PolarHBondContact O-N 3.2Å
88	K	34.6	Very low	41.3	Very low	208 Å²	208	138.5 Å²	138.5	90%	0.904	77%	0.774	S	S	*	*			trans	-48.5	97.3	171.2	-73	178.7	176	178.6	0	109.7	K90	K88-K90 PolarHBondContact O-N 3.43Å
89	I	43.4	Very low	43.7	Very low	162 Å²	162	135.7 Å²	135.7	83%	0.831	76%	0.764	S	S	*	*			trans	-72.4	112.2	166.8	-62	176.2	0	0	0	105.4	R87 S91	R87-I89 PolarHBondContact O-N 3.2Å; I89-S91 PolarHBondContact O-N 3.45Å
90	K	39.4	Very low	46.2	Very low	195 Å²	195	131.9 Å²	131.9	85%	0.848	74%	0.744	S	S	*	*			trans	-54.8	120.5	170.3	-78.2	178	173.9	178.7	0	108	K88 C92	K88-K90 PolarHBondContact O-N 3.43Å; K90-C92 PolarHBondContact O-N 3.09Å
91	S	37.3	Very low	48.5	Very low	120 Å²	120	126.3 Å²	126.3	84%	0.839	72%	0.724	S	S	*	*			trans	-62.3	102.9	173.6	54.1	0	0	0	0	109.6	I89	I89-S91 PolarHBondContact O-N 3.45Å
92	C	36.3	Very low	51	Low	90 Å²	90	123.2 Å²	123.2	61%	0.608	71%	0.709	S	S	*	*			trans	-87.6	113.6	164.6	-159.9	0	0	0	0	107.2	K90 S94	K90-C92 PolarHBondContact O-N 3.09Å; C92-S94 PolarHBondContact O-N 2.66Å
93	S	46.8	Very low	53.7	Low	126 Å²	126	121.5 Å²	121.5	88%	0.881	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	38.4	-170.1	54.4	0	0	0	0	114.5
94	S	53.6	Low	56.6	Low	102 Å²	102	118.7 Å²	118.7	71%	0.713	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-153.1	6	178.1	59.5	0	0	0	0	116.8	C92 M96	C92-S94 PolarHBondContact O-N 2.66Å; S94-M96 PolarHBondContact O-N 3.38Å
95	C	44.5	Very low	59.2	Low	107 Å²	107	114.6 Å²	114.6	72%	0.723	65%	0.649	S	S	*	*			trans	-91.8	101.8	172.8	60.1	0	0	0	0	111	S97	C95-S97 PolarHBondContact O-N 2.93Å
96	M	59.1	Low	61.9	Low	178 Å²	178	116.7 Å²	116.7	88%	0.877	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-64.7	120.5	161.2	-63	-137.2	73.6	0	0	107.4	S94	S94-M96 PolarHBondContact O-N 3.38Å
97	S	63.6	Low	64.7	Low	97 Å²	97	114.7 Å²	114.7	68%	0.678	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-59.5	130.2	167.4	49.4	0	0	0	0	107.8	C95 S99	C95-S97 PolarHBondContact O-N 2.93Å; S97-S99 PolarHBondContact O-N 3.15Å; S97-S99 VanDerWaalsContact O-N 3.12Å
98	P	70.5	Confident	67.3	Low	115 Å²	115	104 Å²	104	75%	0.747	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-55.2	123.6	179.6	22.9	-32.4	0	0	0	109
99	S	83.2	Confident	70.1	Confident	49 Å²	49	96.4 Å²	96.4	34%	0.343	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-80.2	150.5	176.4	-175.9	0	0	0	0	109.2	S97 E101 D102	S97-S99 PolarHBondContact O-N 3.15Å; S97-S99 VanDerWaalsContact O-N 3.12Å; S99-E101 PolarHBondContact O-N 3.18Å; S99-E101 VanDerWaalsContact O-N 3.1Å; S99-E101 PolarHBondContact OG-N 2.94Å; S99-D102 VanDerWaalsContact CB-OD2 3.32Å; S99-D102 WeakPolarHBondContact CB-OD2 2.95Å; S99-D102 PolarHBondContact N-OD2 2.88Å; S99-D102 WeakPolarHBondContact O-CB 3.15Å; S99-D102 PolarHBondContact O-N 3.37Å
100	L	81.2	Confident	72.4	Confident	61 Å²	61	97.4 Å²	97.4	32%	0.319	55%	0.549	S	S	.	.	G	3₁₀ helix	trans	-52.2	-31.2	165.3	-177.3	67.3	0	0	0	110.2	D102 L103 L108 L123	L100-D102 PolarHBondContact O-N 3.25Å; L100-L103 HydrophobicContact CD1-CD1 3.91Å; L100-L103 PolarHBondContact O-N 3.08Å; L100-L108 HydrophobicContact CD1-CD2 3.68Å; L100-L108 HydrophobicContact CG-CD2 3.88Å; L100-L123 HydrophobicContact CD2-CD2 3.81Å
101	E	81.2	Confident	75	Confident	75 Å²	75	90.4 Å²	90.4	35%	0.35	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-71.1	-8.4	178.1	-55.3	-165.8	152.7	0	0	114.6	S99 S127 R129	S99-E101 PolarHBondContact O-N 3.18Å; S99-E101 VanDerWaalsContact O-N 3.1Å; S99-E101 PolarHBondContact OG-N 2.94Å; E101-S127 WeakPolarHBondContact CG-OG 3.5Å; E101-S127 VanDerWaalsContact OE1-CB 3.31Å; E101-S127 WeakPolarHBondContact OE1-CB 3.48Å; E101-S127 PolarHBondContact OE1-OG 2.82Å; E101-R129 HydrophobicContact CG-CB 4.44Å; E101-R129 WeakPolarHBondContact O-CD 3.32Å; E101-R129 PolarHBondContact O-NE 2.89Å; E101-R129 VanDerWaalsContact O-NE 3.16Å; E101-R129 PolarHBondContact O-NH1 3.34Å
102	D	87	Confident	77.6	Confident	110 Å²	110	84.9 Å²	84.9	59%	0.588	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-94.7	-13.1	177.8	-60	-44.5	0	0	0	112.2	S99 L100	S99-D102 VanDerWaalsContact CB-OD2 3.32Å; S99-D102 WeakPolarHBondContact CB-OD2 2.95Å; S99-D102 PolarHBondContact N-OD2 2.88Å; S99-D102 WeakPolarHBondContact O-CB 3.15Å; S99-D102 PolarHBondContact O-N 3.37Å; L100-D102 PolarHBondContact O-N 3.25Å
103	L	88.4	Confident	80.2	Confident	54 Å²	54	86.6 Å²	86.6	28%	0.283	49%	0.486	S	S	.	.	S	Bend	trans	-72.2	136.6	-175.5	-63.9	-177.9	0	0	0	112.1	L100 I107 L108 R129	L100-L103 HydrophobicContact CD1-CD1 3.91Å; L100-L103 PolarHBondContact O-N 3.08Å; L103-I107 HydrophobicContact CB-CB 4.32Å; L103-I107 HydrophobicContact CB-CG2 4.38Å; L103-I107 HydrophobicContact CD1-CG2 3.93Å; L103-L108 HydrophobicContact CB-CD2 4.28Å; L103-L108 HydrophobicContact CB-CG 4.26Å; L103-R129 PolarHBondContact O-NH2 3.44Å
104	P	92.8	Very high	82.3	Confident	64 Å²	64	88.5 Å²	88.5	42%	0.416	48%	0.483	S	S	.	.			trans	-50.2	148	171.2	-25.5	32.7	0	0	0	112.8	E106 I107 L108	P104-E106 VanDerWaalsContact CB-OE2 3.23Å; P104-E106 WeakPolarHBondContact CB-OE2 3.32Å; P104-E106 PolarHBondContact O-N 3.48Å; P104-E106 VanDerWaalsContact O-N 3.15Å; P104-I107 HydrophobicContact CB-CG1 4.35Å; P104-I107 HydrophobicContact CG-CD1 4.25Å; P104-I107 HydrophobicContact CG-CG1 4.43Å; P104-I107 PolarHBondContact O-N 3.17Å; P104-L108 PolarHBondContact O-N 3.11Å; P104-L108 VanDerWaalsContact O-N 3.08Å
105	T	93.1	Very high	84.1	Confident	54 Å²	54	85.8 Å²	85.8	33%	0.331	46%	0.462	S	S	.	.	H	α-helix	trans	-54.7	-36.4	-178	-56.5	0	0	0	0	111.8	I107 L108 L109 V133	T105-I107 VanDerWaalsContact C-N 3.3Å; T105-I107 PolarHBondContact O-N 3.35Å; T105-L108 PolarHBondContact O-N 3.22Å; T105-L109 HydrophobicContact CG2-CD1 4.22Å; T105-L109 HydrophobicContact CG2-CG 4.41Å; T105-L109 WeakPolarHBondContact O-CG 3.42Å; T105-L109 PolarHBondContact O-N 3.34Å; T105-V133 HydrophobicContact CG2-CG1 3.82Å; T105-V133 HydrophobicContact CG2-CG2 4.2Å
106	E	92.6	Very high	86.4	Confident	137 Å²	137	83.3 Å²	83.3	64%	0.64	44%	0.442	S	S	*	.	H	α-helix	trans	-63	-36.4	177.9	-56.1	80.8	-179.8	0	0	112	P104 R110	P104-E106 VanDerWaalsContact CB-OE2 3.23Å; P104-E106 WeakPolarHBondContact CB-OE2 3.32Å; P104-E106 PolarHBondContact O-N 3.48Å; P104-E106 VanDerWaalsContact O-N 3.15Å; E106-R110 WeakPolarHBondContact O-CG 3.41Å; E106-R110 PolarHBondContact O-N 3.39Å
107	I	92.7	Very high	88.1	Confident	81 Å²	81	75.1 Å²	75.1	42%	0.415	40%	0.402	S	S	.	.	H	α-helix	trans	-74	-42.7	176.3	-56.5	-169.3	0	0	0	109.9	L103 P104 T105 L109 R110 V111	L103-I107 HydrophobicContact CB-CB 4.32Å; L103-I107 HydrophobicContact CB-CG2 4.38Å; L103-I107 HydrophobicContact CD1-CG2 3.93Å; P104-I107 HydrophobicContact CB-CG1 4.35Å; P104-I107 HydrophobicContact CG-CD1 4.25Å; P104-I107 HydrophobicContact CG-CG1 4.43Å; P104-I107 PolarHBondContact O-N 3.17Å; T105-I107 VanDerWaalsContact C-N 3.3Å; T105-I107 PolarHBondContact O-N 3.35Å; I107-L109 VanDerWaalsContact C-N 3.29Å; I107-L109 PolarHBondContact O-N 3.03Å; I107-R110 WeakPolarHBondContact O-CB 3.48Å; I107-R110 PolarHBondContact O-N 3.4Å; I107-R110 VanDerWaalsContact O-N 3.13Å; I107-V111 WeakPolarHBondContact O-CG2 3.37Å; I107-V111 PolarHBondContact O-N 3.04Å
108	L	92.7	Very high	89.5	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-57.4	-43.8	175.3	-71.1	175.4	0	0	0	111.6	L100 L103 P104 T105 R110 V111 F112 R129 V133	L100-L108 HydrophobicContact CD1-CD2 3.68Å; L100-L108 HydrophobicContact CG-CD2 3.88Å; L103-L108 HydrophobicContact CB-CD2 4.28Å; L103-L108 HydrophobicContact CB-CG 4.26Å; P104-L108 PolarHBondContact O-N 3.11Å; P104-L108 VanDerWaalsContact O-N 3.08Å; T105-L108 PolarHBondContact O-N 3.22Å; L108-R110 VanDerWaalsContact C-N 3.32Å; L108-R110 PolarHBondContact O-N 3.47Å; L108-V111 WeakPolarHBondContact O-CB 3.4Å; L108-V111 PolarHBondContact O-N 3.44Å; L108-V111 VanDerWaalsContact O-N 3.12Å; L108-F112 HydrophobicContact CB-CE2 4.16Å; L108-F112 HydrophobicContact CB-CZ 4.08Å; L108-F112 HydrophobicContact CD2-CZ 4.42Å; L108-F112 WeakPolarHBondContact O-CB 3.24Å; L108-F112 WeakPolarHBondContact O-CD1 3.41Å; L108-F112 WeakPolarHBondContact O-CG 3.38Å; L108-F112 PolarHBondContact O-N 2.89Å; L108-R129 HydrophobicContact CD1-CG 4.35Å; L108-V133 HydrophobicContact CD1-CG2 4.24Å
109	L	92.7	Very high	90.6	Very high	47 Å²	47	68.2 Å²	68.2	25%	0.246	36%	0.355	C	S	.	.	H	α-helix	trans	-62.7	-37.6	176.6	-72.6	174.2	0	0	0	112.9	T105 I107 V111 F112 L113 V133 E137	T105-L109 HydrophobicContact CG2-CD1 4.22Å; T105-L109 HydrophobicContact CG2-CG 4.41Å; T105-L109 WeakPolarHBondContact O-CG 3.42Å; T105-L109 PolarHBondContact O-N 3.34Å; I107-L109 VanDerWaalsContact C-N 3.29Å; I107-L109 PolarHBondContact O-N 3.03Å; L109-V111 VanDerWaalsContact C-N 3.34Å; L109-F112 HydrophobicContact CD2-CD2 4.25Å; L109-F112 PolarHBondContact O-N 3.39Å; L109-L113 VanDerWaalsContact O-CG 3.3Å; L109-L113 WeakPolarHBondContact O-CG 3.32Å; L109-L113 PolarHBondContact O-N 3.31Å; L109-V133 HydrophobicContact CD2-CG1 4.15Å; L109-V133 HydrophobicContact CG-CG1 4.39Å; L109-E137 HydrophobicContact CD1-CG 4.14Å; L109-E137 HydrophobicContact CD2-CB 3.53Å; L109-E137 HydrophobicContact CD2-CG 3.78Å; L109-E137 HydrophobicContact CG-CG 4.4Å
110	R	92.9	Very high	91.2	Very high	183 Å²	183	65.9 Å²	65.9	69%	0.691	34%	0.338	S	S	*	.	H	α-helix	trans	-64.1	-39.8	172.9	-68.4	-66.3	-175.5	170.2	0.7	112.1	E106 I107 L108 M114	E106-R110 WeakPolarHBondContact O-CG 3.41Å; E106-R110 PolarHBondContact O-N 3.39Å; I107-R110 WeakPolarHBondContact O-CB 3.48Å; I107-R110 PolarHBondContact O-N 3.4Å; I107-R110 VanDerWaalsContact O-N 3.13Å; L108-R110 VanDerWaalsContact C-N 3.32Å; L108-R110 PolarHBondContact O-N 3.47Å; R110-M114 WeakPolarHBondContact O-CG 3.37Å
111	V	92	Very high	91.8	Very high	48 Å²	48	64.1 Å²	64.1	29%	0.291	33%	0.327	S	S	.	.	H	α-helix	trans	-63.8	-45	173.8	175.3	0	0	0	0	110.5	I107 L108 L109 L113 M114 V115	I107-V111 WeakPolarHBondContact O-CG2 3.37Å; I107-V111 PolarHBondContact O-N 3.04Å; L108-V111 WeakPolarHBondContact O-CB 3.4Å; L108-V111 PolarHBondContact O-N 3.44Å; L108-V111 VanDerWaalsContact O-N 3.12Å; L109-V111 VanDerWaalsContact C-N 3.34Å; V111-L113 VanDerWaalsContact C-N 3.29Å; V111-L113 PolarHBondContact O-N 2.83Å; V111-M114 WeakPolarHBondContact O-CB 3.43Å; V111-M114 PolarHBondContact O-N 2.96Å; V111-V115 PolarHBondContact O-N 3.48Å
112	F	93.5	Very high	92.5	Very high	4 Å²	4	62.7 Å²	62.7	2%	0.018	33%	0.326	C	S	.	.	H	α-helix	trans	-62.4	-34.1	-179.4	-65.3	-11.1	0	0	0	112.9	L108 L109 M114 V115 L120 L123 C130 V133 I134	L108-F112 HydrophobicContact CB-CE2 4.16Å; L108-F112 HydrophobicContact CB-CZ 4.08Å; L108-F112 HydrophobicContact CD2-CZ 4.42Å; L108-F112 WeakPolarHBondContact O-CB 3.24Å; L108-F112 WeakPolarHBondContact O-CD1 3.41Å; L108-F112 WeakPolarHBondContact O-CG 3.38Å; L108-F112 PolarHBondContact O-N 2.89Å; L109-F112 HydrophobicContact CD2-CD2 4.25Å; L109-F112 PolarHBondContact O-N 3.39Å; F112-M114 PolarHBondContact O-N 2.95Å; F112-V115 WeakPolarHBondContact O-CG2 3.27Å; F112-V115 PolarHBondContact O-N 3.07Å; F112-L120 HydrophobicContact CB-CD2 3.56Å; F112-L120 HydrophobicContact CD1-CD2 3.84Å; F112-L120 HydrophobicContact CD2-CD2 4.5Å; F112-L120 HydrophobicContact CG-CD2 3.71Å; F112-L123 HydrophobicContact CD1-CD1 4.06Å; F112-L123 HydrophobicContact CE1-CD1 3.89Å; F112-C130 HydrophobicContact CZ-CB 4.05Å; F112-V133 HydrophobicContact CD2-CG1 4.38Å; F112-V133 HydrophobicContact CE2-CB 4.08Å; F112-V133 HydrophobicContact CE2-CG1 3.73Å; F112-I134 HydrophobicContact CD2-CG1 3.8Å; F112-I134 HydrophobicContact CE1-CD1 4.27Å; F112-I134 HydrophobicContact CE1-CG1 4.45Å; F112-I134 HydrophobicContact CE2-CD1 4.12Å; F112-I134 HydrophobicContact CE2-CG1 3.44Å; F112-I134 VanDerWaalsContact CE2-CG1 3.44Å; F112-I134 HydrophobicContact CG-CG1 4.45Å; F112-I134 HydrophobicContact CZ-CD1 3.98Å; F112-I134 HydrophobicContact CZ-CG1 3.82Å
113	L	90.5	Very high	92.8	Very high	126 Å²	126	59.5 Å²	59.5	66%	0.66	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-16.5	173.7	-71.7	170.6	0	0	0	114	L109 V111	L109-L113 VanDerWaalsContact O-CG 3.3Å; L109-L113 WeakPolarHBondContact O-CG 3.32Å; L109-L113 PolarHBondContact O-N 3.31Å; V111-L113 VanDerWaalsContact C-N 3.29Å; V111-L113 PolarHBondContact O-N 2.83Å
114	M	91.5	Very high	93.1	Very high	166 Å²	166	58.2 Å²	58.2	82%	0.818	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-10.7	-179	-66.8	-177.5	68.1	0	0	113.7	R110 V111 F112	R110-M114 WeakPolarHBondContact O-CG 3.37Å; V111-M114 WeakPolarHBondContact O-CB 3.43Å; V111-M114 PolarHBondContact O-N 2.96Å; F112-M114 PolarHBondContact O-N 2.95Å
115	V	91.4	Very high	93.2	Very high	46 Å²	46	58.9 Å²	58.9	28%	0.279	30%	0.297	S	S	.	.	S	Bend	trans	-108.5	157.4	-177.2	-61.2	0	0	0	0	111	V111 F112 C119 L120 L123	V111-V115 PolarHBondContact O-N 3.48Å; F112-V115 WeakPolarHBondContact O-CG2 3.27Å; F112-V115 PolarHBondContact O-N 3.07Å; V115-C119 HydrophobicContact CB-CB 3.68Å; V115-C119 HydrophobicContact CG1-CB 4.37Å; V115-C119 HydrophobicContact CG2-CB 4.12Å; V115-L120 HydrophobicContact CG2-CD2 3.6Å; V115-L120 HydrophobicContact CG2-CG 3.88Å; V115-L123 HydrophobicContact CG2-CD1 4.42Å
116	D	91.9	Very high	93.2	Very high	54 Å²	54	60.3 Å²	60.3	29%	0.289	31%	0.314	S	S	.	.			trans	-78.6	170.5	175.5	81.4	-14.5	0	0	0	112.3	I118 C119 L120 R150	D116-I118 VanDerWaalsContact C-N 3.26Å; D116-I118 PolarHBondContact O-N 3.43Å; D116-I118 PolarHBondContact OD1-N 2.95Å; D116-C119 WeakPolarHBondContact O-CB 3.26Å; D116-C119 PolarHBondContact O-N 3.26Å; D116-C119 VanDerWaalsContact OD1-CB 3.27Å; D116-C119 WeakPolarHBondContact OD1-CB 3.23Å; D116-C119 PolarHBondContact OD1-N 3.37Å; D116-C119 PolarHBondContact OD1-SG 3.23Å; D116-L120 WeakPolarHBondContact O-CG 3.34Å; D116-L120 PolarHBondContact O-N 2.69Å; D116-R150 IonicContact OD2-NH2 3.22Å; D116-R150 PolarHBondContact OD2-NH2 2.82Å
117	D	93.9	Very high	93.2	Very high	7 Å²	7	54.2 Å²	54.2	4%	0.037	29%	0.287	C	S	.	.	H	α-helix	trans	-61.2	-29.5	-179.6	56.7	-54.4	0	0	0	113.8	W121 Y146 R150 Y167	D117-W121 WeakPolarHBondContact O-CB 3.33Å; D117-W121 PolarHBondContact O-N 2.86Å; D117-Y146 HydrophobicContact CB-CD1 3.58Å; D117-Y146 HydrophobicContact CB-CD2 3.82Å; D117-Y146 HydrophobicContact CB-CE1 3.84Å; D117-Y146 HydrophobicContact CB-CE2 4.07Å; D117-Y146 HydrophobicContact CB-CG 3.55Å; D117-R150 IonicContact OD1-CZ 3.4Å; D117-R150 VanDerWaalsContact OD1-CZ 3.3Å; D117-R150 IonicContact OD1-NE 3.54Å; D117-R150 PolarHBondContact OD1-NE 3.07Å; D117-R150 VanDerWaalsContact OD1-NE 3.11Å; D117-R150 IonicContact OD1-NH2 3.5Å; D117-R150 PolarHBondContact OD1-NH2 2.95Å; D117-R150 WeakPolarHBondContact OD2-CG 3.48Å; D117-R150 IonicContact OD2-CZ 2.95Å; D117-R150 IonicContact OD2-NE 3.11Å; D117-R150 PolarHBondContact OD2-NE 3.03Å; D117-R150 IonicContact OD2-NH2 2.67Å; D117-Y167 HydrophobicContact CB-CE2 4.42Å; D117-Y167 WeakPolarHBondContact CB-OH 3.48Å; D117-Y167 PolarHBondContact O-OH 3.43Å; D117-Y167 PolarHBondContact OD2-OH 3.44Å
118	I	94.1	Very high	93.3	Very high	12 Å²	12	54.6 Å²	54.6	6%	0.062	30%	0.295	C	S	.	.	H	α-helix	trans	-73.7	-39.8	176.1	-63.9	177.5	0	0	0	110.5	D116 W121 S122 M171 L180 E181	D116-I118 VanDerWaalsContact C-N 3.26Å; D116-I118 PolarHBondContact O-N 3.43Å; D116-I118 PolarHBondContact OD1-N 2.95Å; I118-W121 PolarHBondContact O-N 3.45Å; I118-S122 WeakPolarHBondContact O-CB 3.5Å; I118-S122 PolarHBondContact O-N 3.14Å; I118-S122 PolarHBondContact O-OG 3.37Å; I118-M171 HydrophobicContact CG1-CE 4.38Å; I118-M171 HydrophobicContact CG2-CE 4.48Å; I118-L180 HydrophobicContact CD1-CD2 4.42Å; I118-E181 HydrophobicContact CD1-CB 3.75Å; I118-E181 HydrophobicContact CD1-CG 4.14Å
119	C	93.8	Very high	93.4	Very high	55 Å²	55	59 Å²	59	37%	0.372	31%	0.311	S	S	.	.	H	α-helix	trans	-64.8	-43.2	171.9	-70.9	0	0	0	0	111.4	V115 D116 W121 S122 L123	V115-C119 HydrophobicContact CB-CB 3.68Å; V115-C119 HydrophobicContact CG1-CB 4.37Å; V115-C119 HydrophobicContact CG2-CB 4.12Å; D116-C119 WeakPolarHBondContact O-CB 3.26Å; D116-C119 PolarHBondContact O-N 3.26Å; D116-C119 VanDerWaalsContact OD1-CB 3.27Å; D116-C119 WeakPolarHBondContact OD1-CB 3.23Å; D116-C119 PolarHBondContact OD1-N 3.37Å; D116-C119 PolarHBondContact OD1-SG 3.23Å; C119-W121 VanDerWaalsContact C-N 3.34Å; C119-W121 PolarHBondContact O-N 3.49Å; C119-S122 WeakPolarHBondContact O-CB 3.27Å; C119-S122 PolarHBondContact O-N 3.45Å; C119-S122 VanDerWaalsContact O-N 3.1Å; C119-L123 WeakPolarHBondContact O-CG 3.42Å; C119-L123 PolarHBondContact O-N 3.46Å
120	L	94.6	Very high	93.4	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-57.1	-47.9	173.5	-71.5	177.5	0	0	0	111.3	F112 V115 D116 S122 L123 R124 I134 Y146	F112-L120 HydrophobicContact CB-CD2 3.56Å; F112-L120 HydrophobicContact CD1-CD2 3.84Å; F112-L120 HydrophobicContact CD2-CD2 4.5Å; F112-L120 HydrophobicContact CG-CD2 3.71Å; V115-L120 HydrophobicContact CG2-CD2 3.6Å; V115-L120 HydrophobicContact CG2-CG 3.88Å; D116-L120 WeakPolarHBondContact O-CG 3.34Å; D116-L120 PolarHBondContact O-N 2.69Å; L120-S122 VanDerWaalsContact C-N 3.28Å; L120-S122 PolarHBondContact O-N 2.91Å; L120-L123 PolarHBondContact O-N 2.94Å; L120-R124 WeakPolarHBondContact O-CB 3.4Å; L120-R124 PolarHBondContact O-N 3.35Å; L120-I134 HydrophobicContact CD2-CD1 4.32Å; L120-I134 WeakPolarHBondContact O-CD1 3.4Å; L120-Y146 HydrophobicContact CD1-CE2 4Å; L120-Y146 WeakPolarHBondContact CD1-OH 3.39Å
121	W	95.2	Very high	93.6	Very high	24 Å²	24	52.3 Å²	52.3	9%	0.091	28%	0.283	C	S	.	.	H	α-helix	trans	-57	-43.3	174.5	-180	94	0	0	0	111.6	D117 I118 C119 R124 Q125 Y167 M171	D117-W121 WeakPolarHBondContact O-CB 3.33Å; D117-W121 PolarHBondContact O-N 2.86Å; I118-W121 PolarHBondContact O-N 3.45Å; C119-W121 VanDerWaalsContact C-N 3.34Å; C119-W121 PolarHBondContact O-N 3.49Å; W121-R124 WeakPolarHBondContact O-CB 3.49Å; W121-R124 PolarHBondContact O-N 2.94Å; W121-Q125 HydrophobicContact CD2-CG 4.18Å; W121-Q125 HydrophobicContact CE3-CG 4.28Å; W121-Q125 HydrophobicContact CH2-CG 4.02Å; W121-Q125 HydrophobicContact CZ2-CG 3.94Å; W121-Q125 HydrophobicContact CZ3-CG 4.18Å; W121-Q125 WeakPolarHBondContact O-CG 3.43Å; W121-Q125 PolarHBondContact O-N 2.99Å; W121-Q125 VanDerWaalsContact O-N 3.08Å; W121-Y167 HydrophobicContact CB-CE1 4.17Å; W121-Y167 HydrophobicContact CG-CE1 4.42Å; W121-M171 HydrophobicContact CD2-CE 3.97Å; W121-M171 HydrophobicContact CE3-CE 4.2Å; W121-M171 HydrophobicContact CG-CB 4.5Å; W121-M171 HydrophobicContact CG-CE 4.14Å; W121-M171 HydrophobicContact CG-CG 4.24Å; W121-M171 HydrophobicContact CZ2-CB 4.49Å
122	S	94.5	Very high	93.7	Very high	45 Å²	45	53 Å²	53	32%	0.315	29%	0.294	S	S	.	.	H	α-helix	trans	-65.8	-43.1	-180	-59.2	0	0	0	0	112.3	I118 C119 L120 R124 Q125 A126	I118-S122 WeakPolarHBondContact O-CB 3.5Å; I118-S122 PolarHBondContact O-N 3.14Å; I118-S122 PolarHBondContact O-OG 3.37Å; C119-S122 WeakPolarHBondContact O-CB 3.27Å; C119-S122 PolarHBondContact O-N 3.45Å; C119-S122 VanDerWaalsContact O-N 3.1Å; L120-S122 VanDerWaalsContact C-N 3.28Å; L120-S122 PolarHBondContact O-N 2.91Å; S122-R124 VanDerWaalsContact C-N 3.34Å; S122-R124 PolarHBondContact O-N 2.76Å; S122-Q125 PolarHBondContact O-N 3.25Å; S122-A126 WeakPolarHBondContact O-CB 3.36Å; S122-A126 PolarHBondContact O-N 2.99Å
123	L	94.2	Very high	93.8	Very high	43 Å²	43	53.4 Å²	53.4	23%	0.225	30%	0.296	C	S	.	.	H	α-helix	trans	-62.1	-41.6	175	-70.4	170.1	0	0	0	111.6	L100 F112 V115 C119 L120 Q125 A126 S127 C130 I134	L100-L123 HydrophobicContact CD2-CD2 3.81Å; F112-L123 HydrophobicContact CD1-CD1 4.06Å; F112-L123 HydrophobicContact CE1-CD1 3.89Å; V115-L123 HydrophobicContact CG2-CD1 4.42Å; C119-L123 WeakPolarHBondContact O-CG 3.42Å; C119-L123 PolarHBondContact O-N 3.46Å; L120-L123 PolarHBondContact O-N 2.94Å; L123-Q125 VanDerWaalsContact C-N 3.29Å; L123-Q125 PolarHBondContact O-N 3.41Å; L123-A126 PolarHBondContact O-N 2.74Å; L123-S127 PolarHBondContact O-N 3.22Å; L123-C130 HydrophobicContact CB-CB 4.33Å; L123-I134 HydrophobicContact CB-CD1 4.26Å
124	R	95.2	Very high	94	Very high	27 Å²	27	47.4 Å²	47.4	10%	0.102	27%	0.265	C	S	.	.	H	α-helix	trans	-60.3	-35.8	174.9	-175.8	-177	-177.3	-76.8	-8.9	112.8	L120 W121 S122 R131 I134 D135 L168	L120-R124 WeakPolarHBondContact O-CB 3.4Å; L120-R124 PolarHBondContact O-N 3.35Å; W121-R124 WeakPolarHBondContact O-CB 3.49Å; W121-R124 PolarHBondContact O-N 2.94Å; S122-R124 VanDerWaalsContact C-N 3.34Å; S122-R124 PolarHBondContact O-N 2.76Å; R124-R131 HydrophobicContact CG-CB 3.95Å; R124-R131 HydrophobicContact CG-CG 3.76Å; R124-R131 WeakPolarHBondContact O-CB 3.38Å; R124-R131 PolarHBondContact O-NE 3.16Å; R124-R131 PolarHBondContact O-NH2 3.06Å; R124-I134 HydrophobicContact CB-CD1 3.96Å; R124-D135 IonicContact CZ-OD1 3.77Å; R124-D135 IonicContact CZ-OD2 2.81Å; R124-D135 IonicContact NE-OD1 3.73Å; R124-D135 PolarHBondContact NE-OD1 3.38Å; R124-D135 IonicContact NE-OD2 2.74Å; R124-D135 IonicContact NH2-OD1 2.82Å; R124-D135 PolarHBondContact NH2-OD1 3.36Å; R124-D135 IonicContact NH2-OD2 3.3Å; R124-D135 PolarHBondContact NH2-OD2 3.27Å; R124-L168 VanDerWaalsContact CZ-CD1 3.48Å
125	Q	93.9	Very high	94.2	Very high	78 Å²	78	41.8 Å²	41.8	36%	0.364	24%	0.239	S	C	.	.	H	α-helix	trans	-75.5	-38.2	176.6	-63.9	-59.3	-8.7	0	0	112	W121 S122 L123 R131	W121-Q125 HydrophobicContact CD2-CG 4.18Å; W121-Q125 HydrophobicContact CE3-CG 4.28Å; W121-Q125 HydrophobicContact CH2-CG 4.02Å; W121-Q125 HydrophobicContact CZ2-CG 3.94Å; W121-Q125 HydrophobicContact CZ3-CG 4.18Å; W121-Q125 WeakPolarHBondContact O-CG 3.43Å; W121-Q125 PolarHBondContact O-N 2.99Å; W121-Q125 VanDerWaalsContact O-N 3.08Å; S122-Q125 PolarHBondContact O-N 3.25Å; L123-Q125 VanDerWaalsContact C-N 3.29Å; L123-Q125 PolarHBondContact O-N 3.41Å; Q125-R131 PolarHBondContact O-NH2 2.61Å
126	A	93.5	Very high	94.3	Very high	83 Å²	83	43.5 Å²	43.5	69%	0.686	25%	0.252	S	S	*	.	H	α-helix	trans	-78.4	-29.8	-173.2	0	0	0	0	0	114.6	S122 L123	S122-A126 WeakPolarHBondContact O-CB 3.36Å; S122-A126 PolarHBondContact O-N 2.99Å; L123-A126 PolarHBondContact O-N 2.74Å
127	S	93.5	Very high	94.4	Very high	9 Å²	9	45.8 Å²	45.8	6%	0.063	26%	0.261	C	S	.	.			trans	-132.3	124.4	-174	170	0	0	0	0	112.2	E101 L123 R129 C130 R131	E101-S127 WeakPolarHBondContact CG-OG 3.5Å; E101-S127 VanDerWaalsContact OE1-CB 3.31Å; E101-S127 WeakPolarHBondContact OE1-CB 3.48Å; E101-S127 PolarHBondContact OE1-OG 2.82Å; L123-S127 PolarHBondContact O-N 3.22Å; S127-R129 PolarHBondContact O-N 3.23Å; S127-R129 PolarHBondContact OG-N 3Å; S127-C130 PolarHBondContact O-N 3.16Å; S127-C130 PolarHBondContact OG-N 3.3Å; S127-C130 VanDerWaalsContact OG-N 3.16Å; S127-R131 WeakPolarHBondContact O-CB 3.49Å; S127-R131 PolarHBondContact O-N 3.28Å
128	P	93.9	Very high	94.4	Very high	90 Å²	90	46.1 Å²	46.1	58%	0.584	26%	0.263	S	S	*	.	H	α-helix	trans	-58.2	-35.3	171.8	-24.3	34.4	0	0	0	113	R131 A132	P128-R131 WeakPolarHBondContact O-CB 3.44Å; P128-R131 PolarHBondContact O-N 3.34Å; P128-A132 PolarHBondContact O-N 3.01Å
129	R	94.1	Very high	94.4	Very high	91 Å²	91	48.3 Å²	48.3	34%	0.343	28%	0.279	S	S	.	.	H	α-helix	trans	-68.1	-48.3	176.3	-179.9	170.8	174.3	147.4	3.8	111.3	E101 L103 L108 S127 R131 A132 V133	E101-R129 HydrophobicContact CG-CB 4.44Å; E101-R129 WeakPolarHBondContact O-CD 3.32Å; E101-R129 PolarHBondContact O-NE 2.89Å; E101-R129 VanDerWaalsContact O-NE 3.16Å; E101-R129 PolarHBondContact O-NH1 3.34Å; L103-R129 PolarHBondContact O-NH2 3.44Å; L108-R129 HydrophobicContact CD1-CG 4.35Å; S127-R129 PolarHBondContact O-N 3.23Å; S127-R129 PolarHBondContact OG-N 3Å; R129-R131 PolarHBondContact O-N 2.83Å; R129-A132 PolarHBondContact O-N 3.34Å; R129-V133 WeakPolarHBondContact O-CG2 3.5Å; R129-V133 PolarHBondContact O-N 3.32Å; R129-V133 VanDerWaalsContact O-N 3.09Å
130	C	94.4	Very high	94.5	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.1	-38.6	175.9	-64	0	0	0	0	110.8	F112 L123 S127 V133 I134	F112-C130 HydrophobicContact CZ-CB 4.05Å; L123-C130 HydrophobicContact CB-CB 4.33Å; S127-C130 PolarHBondContact O-N 3.16Å; S127-C130 PolarHBondContact OG-N 3.3Å; S127-C130 VanDerWaalsContact OG-N 3.16Å; C130-V133 PolarHBondContact O-N 2.83Å; C130-I134 HydrophobicContact CB-CD1 4.34Å; C130-I134 VanDerWaalsContact O-CB 3.23Å; C130-I134 WeakPolarHBondContact O-CB 3.37Å; C130-I134 WeakPolarHBondContact O-CD1 3.44Å; C130-I134 WeakPolarHBondContact O-CG1 3.48Å; C130-I134 PolarHBondContact O-N 3Å
131	R	95.6	Very high	94.6	Very high	90 Å²	90	56.3 Å²	56.3	34%	0.34	31%	0.311	S	S	.	.	H	α-helix	trans	-58.9	-49.7	174.7	-175.7	-178.3	-55	159.6	3.9	113	R124 Q125 S127 P128 R129 V133 I134 D135	R124-R131 HydrophobicContact CG-CB 3.95Å; R124-R131 HydrophobicContact CG-CG 3.76Å; R124-R131 WeakPolarHBondContact O-CB 3.38Å; R124-R131 PolarHBondContact O-NE 3.16Å; R124-R131 PolarHBondContact O-NH2 3.06Å; Q125-R131 PolarHBondContact O-NH2 2.61Å; S127-R131 WeakPolarHBondContact O-CB 3.49Å; S127-R131 PolarHBondContact O-N 3.28Å; P128-R131 WeakPolarHBondContact O-CB 3.44Å; P128-R131 PolarHBondContact O-N 3.34Å; R129-R131 PolarHBondContact O-N 2.83Å; R131-V133 VanDerWaalsContact C-N 3.33Å; R131-V133 PolarHBondContact O-N 3.12Å; R131-I134 PolarHBondContact O-N 3.25Å; R131-D135 VanDerWaalsContact O-CB 3.24Å; R131-D135 WeakPolarHBondContact O-CB 3.36Å; R131-D135 VanDerWaalsContact O-CG 3.29Å; R131-D135 PolarHBondContact O-N 3.4Å
132	A	95.1	Very high	94.6	Very high	64 Å²	64	57.9 Å²	57.9	53%	0.529	32%	0.32	S	S	.	.	H	α-helix	trans	-59.2	-45.5	179.7	0	0	0	0	0	111.6	P128 R129 S136	P128-A132 PolarHBondContact O-N 3.01Å; R129-A132 PolarHBondContact O-N 3.34Å; A132-S136 WeakPolarHBondContact O-CB 3.14Å; A132-S136 PolarHBondContact O-N 2.92Å; A132-S136 VanDerWaalsContact O-N 3.1Å; A132-S136 PolarHBondContact O-OG 3.18Å
133	V	95	Very high	94.8	Very high	11 Å²	11	55.8 Å²	55.8	7%	0.067	31%	0.305	C	S	.	.	H	α-helix	trans	-68.9	-44.4	179.1	-180	0	0	0	0	111.6	T105 L108 L109 F112 R129 C130 R131 D135 S136 E137	T105-V133 HydrophobicContact CG2-CG1 3.82Å; T105-V133 HydrophobicContact CG2-CG2 4.2Å; L108-V133 HydrophobicContact CD1-CG2 4.24Å; L109-V133 HydrophobicContact CD2-CG1 4.15Å; L109-V133 HydrophobicContact CG-CG1 4.39Å; F112-V133 HydrophobicContact CD2-CG1 4.38Å; F112-V133 HydrophobicContact CE2-CB 4.08Å; F112-V133 HydrophobicContact CE2-CG1 3.73Å; R129-V133 WeakPolarHBondContact O-CG2 3.5Å; R129-V133 PolarHBondContact O-N 3.32Å; R129-V133 VanDerWaalsContact O-N 3.09Å; C130-V133 PolarHBondContact O-N 2.83Å; R131-V133 VanDerWaalsContact C-N 3.33Å; R131-V133 PolarHBondContact O-N 3.12Å; V133-D135 VanDerWaalsContact C-N 3.35Å; V133-D135 PolarHBondContact O-N 3.13Å; V133-S136 PolarHBondContact O-N 3.28Å; V133-S136 PolarHBondContact O-OG 3.12Å; V133-E137 HydrophobicContact CG1-CG 3.88Å; V133-E137 VanDerWaalsContact O-CB 3.26Å; V133-E137 WeakPolarHBondContact O-CB 3.47Å; V133-E137 VanDerWaalsContact O-CG 3.27Å; V133-E137 WeakPolarHBondContact O-CG 3.41Å; V133-E137 PolarHBondContact O-N 2.79Å
134	I	95.2	Very high	94.9	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63.3	-42.9	178.9	-72.1	168.4	0	0	0	110.8	F112 L120 L123 R124 C130 R131 S136 I138 W143	F112-I134 HydrophobicContact CD2-CG1 3.8Å; F112-I134 HydrophobicContact CE1-CD1 4.27Å; F112-I134 HydrophobicContact CE1-CG1 4.45Å; F112-I134 HydrophobicContact CE2-CD1 4.12Å; F112-I134 HydrophobicContact CE2-CG1 3.44Å; F112-I134 VanDerWaalsContact CE2-CG1 3.44Å; F112-I134 HydrophobicContact CG-CG1 4.45Å; F112-I134 HydrophobicContact CZ-CD1 3.98Å; F112-I134 HydrophobicContact CZ-CG1 3.82Å; L120-I134 HydrophobicContact CD2-CD1 4.32Å; L120-I134 WeakPolarHBondContact O-CD1 3.4Å; L123-I134 HydrophobicContact CB-CD1 4.26Å; R124-I134 HydrophobicContact CB-CD1 3.96Å; C130-I134 HydrophobicContact CB-CD1 4.34Å; C130-I134 VanDerWaalsContact O-CB 3.23Å; C130-I134 WeakPolarHBondContact O-CB 3.37Å; C130-I134 WeakPolarHBondContact O-CD1 3.44Å; C130-I134 WeakPolarHBondContact O-CG1 3.48Å; C130-I134 PolarHBondContact O-N 3Å; R131-I134 PolarHBondContact O-N 3.25Å; I134-S136 VanDerWaalsContact C-N 3.31Å; I134-S136 PolarHBondContact O-N 3.22Å; I134-I138 HydrophobicContact CG2-CG1 4.07Å; I134-I138 VanDerWaalsContact O-CB 3.32Å; I134-I138 WeakPolarHBondContact O-CB 3.16Å; I134-I138 WeakPolarHBondContact O-CG1 3.23Å; I134-I138 PolarHBondContact O-N 3.15Å; I134-I138 VanDerWaalsContact O-N 3.16Å; I134-W143 HydrophobicContact CG2-CH2 3.98Å; I134-W143 HydrophobicContact CG2-CZ2 3.64Å
135	D	94.8	Very high	94.9	Very high	49 Å²	49	59.6 Å²	59.6	26%	0.262	33%	0.33	S	S	.	.	H	α-helix	trans	-69.4	-26.8	179.6	-74.4	-17.4	0	0	0	112.6	R124 R131 V133 R164	R124-D135 IonicContact CZ-OD1 3.77Å; R124-D135 IonicContact CZ-OD2 2.81Å; R124-D135 IonicContact NE-OD1 3.73Å; R124-D135 PolarHBondContact NE-OD1 3.38Å; R124-D135 IonicContact NE-OD2 2.74Å; R124-D135 IonicContact NH2-OD1 2.82Å; R124-D135 PolarHBondContact NH2-OD1 3.36Å; R124-D135 IonicContact NH2-OD2 3.3Å; R124-D135 PolarHBondContact NH2-OD2 3.27Å; R131-D135 VanDerWaalsContact O-CB 3.24Å; R131-D135 WeakPolarHBondContact O-CB 3.36Å; R131-D135 VanDerWaalsContact O-CG 3.29Å; R131-D135 PolarHBondContact O-N 3.4Å; V133-D135 VanDerWaalsContact C-N 3.35Å; V133-D135 PolarHBondContact O-N 3.13Å; D135-R164 WeakPolarHBondContact OD1-CD 3.39Å; D135-R164 IonicContact OD1-CZ 3.79Å; D135-R164 IonicContact OD1-NE 3.87Å; D135-R164 IonicContact OD1-NH1 2.99Å; D135-R164 PolarHBondContact OD1-NH1 3.26Å; D135-R164 IonicContact OD2-NH1 3.37Å; D135-R164 PolarHBondContact OD2-NH1 3.06Å
136	S	94.1	Very high	95	Very high	81 Å²	81	57.5 Å²	57.5	57%	0.566	32%	0.319	S	S	*	.	H	α-helix	trans	-89.4	-35.8	178.4	69.8	0	0	0	0	114.1	A132 V133 I134	A132-S136 WeakPolarHBondContact O-CB 3.14Å; A132-S136 PolarHBondContact O-N 2.92Å; A132-S136 VanDerWaalsContact O-N 3.1Å; A132-S136 PolarHBondContact O-OG 3.18Å; V133-S136 PolarHBondContact O-N 3.28Å; V133-S136 PolarHBondContact O-OG 3.12Å; I134-S136 VanDerWaalsContact C-N 3.31Å; I134-S136 PolarHBondContact O-N 3.22Å
137	E	93.7	Very high	95.2	Very high	102 Å²	102	53.6 Å²	53.6	48%	0.477	29%	0.287	S	S	.	.	H	α-helix	trans	-101.2	-27.2	-168.3	-57.6	-60.9	137.6	0	0	113.8	L109 V133 S139	L109-E137 HydrophobicContact CD1-CG 4.14Å; L109-E137 HydrophobicContact CD2-CB 3.53Å; L109-E137 HydrophobicContact CD2-CG 3.78Å; L109-E137 HydrophobicContact CG-CG 4.4Å; V133-E137 HydrophobicContact CG1-CG 3.88Å; V133-E137 VanDerWaalsContact O-CB 3.26Å; V133-E137 WeakPolarHBondContact O-CB 3.47Å; V133-E137 VanDerWaalsContact O-CG 3.27Å; V133-E137 WeakPolarHBondContact O-CG 3.41Å; V133-E137 PolarHBondContact O-N 2.79Å; E137-S139 PolarHBondContact O-N 2.8Å
138	I	93.4	Very high	95.2	Very high	15 Å²	15	56.4 Å²	56.4	8%	0.077	31%	0.306	C	S	.	.	S	Bend	trans	-82.9	112.9	178.2	-55	-59.1	0	0	0	109.4	I134 Q142 W143 Y146	I134-I138 HydrophobicContact CG2-CG1 4.07Å; I134-I138 VanDerWaalsContact O-CB 3.32Å; I134-I138 WeakPolarHBondContact O-CB 3.16Å; I134-I138 WeakPolarHBondContact O-CG1 3.23Å; I134-I138 PolarHBondContact O-N 3.15Å; I134-I138 VanDerWaalsContact O-N 3.16Å; I138-Q142 HydrophobicContact CG2-CB 3.97Å; I138-Q142 HydrophobicContact CG2-CG 3.93Å; I138-W143 HydrophobicContact CB-CZ2 4.02Å; I138-W143 HydrophobicContact CG1-CZ2 4.49Å; I138-W143 HydrophobicContact CG2-CD2 4.12Å; I138-W143 HydrophobicContact CG2-CG 4.3Å; I138-W143 HydrophobicContact CG2-CZ2 3.89Å; I138-W143 VanDerWaalsContact CG2-NE1 3.31Å; I138-W143 PolarHBondContact O-NE1 3.07Å; I138-W143 VanDerWaalsContact O-NE1 3.16Å; I138-Y146 HydrophobicContact CG2-CE2 4.29Å
139	S	95.3	Very high	95.2	Very high	57 Å²	57	56.2 Å²	56.2	40%	0.399	30%	0.297	S	S	.	.			trans	-66.5	153.7	-177.1	72.2	0	0	0	0	113.6	E137 Q141 Q142 W143	E137-S139 PolarHBondContact O-N 2.8Å; S139-Q141 PolarHBondContact O-N 2.88Å; S139-Q142 WeakPolarHBondContact O-CB 3.49Å; S139-Q142 PolarHBondContact O-N 3.49Å; S139-Q142 PolarHBondContact OG-N 2.86Å; S139-W143 PolarHBondContact O-N 3.26Å; S139-W143 VanDerWaalsContact O-N 3.12Å
140	E	96.2	Very high	95.2	Very high	70 Å²	70	52.4 Å²	52.4	33%	0.327	28%	0.282	S	S	.	.	H	α-helix	trans	-58	-32.9	175	-68	-61.6	131.9	0	0	113.1	Q142 W143 E144 S162 W163 R164	E140-Q142 VanDerWaalsContact C-N 3.31Å; E140-Q142 PolarHBondContact O-N 3.36Å; E140-W143 PolarHBondContact O-N 3.4Å; E140-E144 PolarHBondContact O-N 3.15Å; E140-S162 WeakPolarHBondContact OE2-CA 3.49Å; E140-W163 WeakPolarHBondContact O-CB 3.37Å; E140-W163 WeakPolarHBondContact OE2-CA 2.98Å; E140-W163 WeakPolarHBondContact OE2-CB 3.45Å; E140-W163 PolarHBondContact OE2-N 3.49Å; E140-R164 WeakPolarHBondContact OE1-CB 3.34Å; E140-R164 PolarHBondContact OE2-N 3.05Å
141	Q	96.4	Very high	95.2	Very high	153 Å²	153	52.9 Å²	52.9	72%	0.715	28%	0.284	S	S	*	.	H	α-helix	trans	-65.1	-35.7	174.5	-69.1	177.7	-9.5	0	0	112.2	S139 E144 S145	S139-Q141 PolarHBondContact O-N 2.88Å; Q141-E144 PolarHBondContact O-N 3.28Å; Q141-S145 PolarHBondContact O-N 2.91Å
142	Q	95.5	Very high	95.1	Very high	58 Å²	58	50.7 Å²	50.7	27%	0.271	28%	0.281	S	S	.	.	H	α-helix	trans	-71.3	-39.6	176.9	-171.8	171	-4	0	0	110.9	I138 S139 E140 S145 Y146	I138-Q142 HydrophobicContact CG2-CB 3.97Å; I138-Q142 HydrophobicContact CG2-CG 3.93Å; S139-Q142 WeakPolarHBondContact O-CB 3.49Å; S139-Q142 PolarHBondContact O-N 3.49Å; S139-Q142 PolarHBondContact OG-N 2.86Å; E140-Q142 VanDerWaalsContact C-N 3.31Å; E140-Q142 PolarHBondContact O-N 3.36Å; Q142-S145 WeakPolarHBondContact O-CB 3.47Å; Q142-S145 PolarHBondContact O-N 2.85Å; Q142-Y146 HydrophobicContact CG-CD2 4.45Å; Q142-Y146 HydrophobicContact CG-CE1 4.28Å; Q142-Y146 HydrophobicContact CG-CE2 3.74Å; Q142-Y146 PolarHBondContact NE2-OH 3.23Å; Q142-Y146 WeakPolarHBondContact O-CD2 3.3Å; Q142-Y146 VanDerWaalsContact O-CG 3.28Å; Q142-Y146 PolarHBondContact O-N 3.32Å
143	W	97	Very high	95.1	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.5	-40.9	171.7	-68.7	111.3	0	0	0	112.8	I134 I138 S139 E140 S145 Y146 V147 W163 R164 Y167	I134-W143 HydrophobicContact CG2-CH2 3.98Å; I134-W143 HydrophobicContact CG2-CZ2 3.64Å; I138-W143 HydrophobicContact CB-CZ2 4.02Å; I138-W143 HydrophobicContact CG1-CZ2 4.49Å; I138-W143 HydrophobicContact CG2-CD2 4.12Å; I138-W143 HydrophobicContact CG2-CG 4.3Å; I138-W143 HydrophobicContact CG2-CZ2 3.89Å; I138-W143 VanDerWaalsContact CG2-NE1 3.31Å; I138-W143 PolarHBondContact O-NE1 3.07Å; I138-W143 VanDerWaalsContact O-NE1 3.16Å; S139-W143 PolarHBondContact O-N 3.26Å; S139-W143 VanDerWaalsContact O-N 3.12Å; E140-W143 PolarHBondContact O-N 3.4Å; W143-S145 VanDerWaalsContact C-N 3.31Å; W143-S145 PolarHBondContact O-N 3.37Å; W143-Y146 HydrophobicContact CD2-CD2 4.34Å; W143-Y146 AromaticContact CE3-CD2 3.76Å; W143-Y146 HydrophobicContact CE3-CD2 3.76Å; W143-Y146 HydrophobicContact CE3-CE2 4.44Å; W143-Y146 HydrophobicContact CZ3-CD2 4.08Å; W143-Y146 WeakPolarHBondContact O-CB 3.41Å; W143-Y146 PolarHBondContact O-N 3.19Å; W143-Y146 VanDerWaalsContact O-N 3.14Å; W143-V147 WeakPolarHBondContact O-CG2 3.42Å; W143-V147 PolarHBondContact O-N 3.02Å; W143-W163 HydrophobicContact CB-CB 3.72Å; W143-R164 HydrophobicContact CB-CB 4.47Å; W143-R164 HydrophobicContact CD2-CB 4.01Å; W143-R164 HydrophobicContact CD2-CG 4Å; W143-R164 HydrophobicContact CG-CB 3.77Å; W143-R164 HydrophobicContact CG-CG 4.27Å; W143-R164 HydrophobicContact CZ2-CG 3.95Å; W143-Y167 AromaticContact CE3-CD1 3.71Å; W143-Y167 HydrophobicContact CE3-CD1 3.71Å; W143-Y167 HydrophobicContact CE3-CD2 4.4Å; W143-Y167 HydrophobicContact CE3-CE1 4.34Å; W143-Y167 AromaticContact CE3-CG 3.75Å; W143-Y167 HydrophobicContact CE3-CG 3.75Å; W143-Y167 AromaticContact CZ3-CD1 3.42Å; W143-Y167 HydrophobicContact CZ3-CD1 3.42Å; W143-Y167 VanDerWaalsContact CZ3-CD1 3.42Å; W143-Y167 AromaticContact CZ3-CE1 3.73Å; W143-Y167 HydrophobicContact CZ3-CE1 3.73Å; W143-Y167 AromaticContact CZ3-CG 3.96Å; W143-Y167 HydrophobicContact CZ3-CG 3.96Å
144	E	97.2	Very high	95.2	Very high	80 Å²	80	49.6 Å²	49.6	37%	0.374	27%	0.265	S	S	.	.	H	α-helix	trans	-57.9	-43.9	172.6	179.4	175.8	-157.9	0	0	111.7	E140 Q141 Y146 V147 S148 W163	E140-E144 PolarHBondContact O-N 3.15Å; Q141-E144 PolarHBondContact O-N 3.28Å; E144-Y146 VanDerWaalsContact C-N 3.32Å; E144-Y146 PolarHBondContact O-N 3.34Å; E144-V147 PolarHBondContact O-N 3.01Å; E144-S148 WeakPolarHBondContact O-CB 3.46Å; E144-S148 PolarHBondContact O-N 3.06Å; E144-S148 PolarHBondContact O-OG 3.45Å; E144-W163 HydrophobicContact CB-CB 4.4Å; E144-W163 HydrophobicContact CB-CD2 3.58Å; E144-W163 HydrophobicContact CB-CE3 4Å; E144-W163 HydrophobicContact CB-CG 3.77Å; E144-W163 HydrophobicContact CB-CZ2 4.26Å; E144-W163 HydrophobicContact CG-CD2 3.88Å; E144-W163 HydrophobicContact CG-CE3 4.11Å; E144-W163 HydrophobicContact CG-CH2 3.88Å; E144-W163 HydrophobicContact CG-CZ2 3.61Å; E144-W163 HydrophobicContact CG-CZ3 4.12Å; E144-W163 VanDerWaalsContact OE1-CZ2 3.32Å; E144-W163 WeakPolarHBondContact OE1-CZ2 3.48Å
145	S	96.1	Very high	95.1	Very high	71 Å²	71	55 Å²	55	50%	0.497	29%	0.294	S	S	.	.	H	α-helix	trans	-62.1	-38.9	175	-175.4	0	0	0	0	112	Q141 Q142 W143 F149	Q141-S145 PolarHBondContact O-N 2.91Å; Q142-S145 WeakPolarHBondContact O-CB 3.47Å; Q142-S145 PolarHBondContact O-N 2.85Å; W143-S145 VanDerWaalsContact C-N 3.31Å; W143-S145 PolarHBondContact O-N 3.37Å; S145-F149 VanDerWaalsContact O-CB 3.26Å; S145-F149 WeakPolarHBondContact O-CB 3.4Å; S145-F149 PolarHBondContact O-N 2.96Å
146	Y	95.8	Very high	95	Very high	34 Å²	34	54.5 Å²	54.5	13%	0.133	29%	0.293	C	S	.	.	H	α-helix	trans	-66.8	-43.1	176.6	-62.6	-32.2	0	0	0	112.2	D117 L120 I138 Q142 W143 E144 F149 R150	D117-Y146 HydrophobicContact CB-CD1 3.58Å; D117-Y146 HydrophobicContact CB-CD2 3.82Å; D117-Y146 HydrophobicContact CB-CE1 3.84Å; D117-Y146 HydrophobicContact CB-CE2 4.07Å; D117-Y146 HydrophobicContact CB-CG 3.55Å; L120-Y146 HydrophobicContact CD1-CE2 4Å; L120-Y146 WeakPolarHBondContact CD1-OH 3.39Å; I138-Y146 HydrophobicContact CG2-CE2 4.29Å; Q142-Y146 HydrophobicContact CG-CD2 4.45Å; Q142-Y146 HydrophobicContact CG-CE1 4.28Å; Q142-Y146 HydrophobicContact CG-CE2 3.74Å; Q142-Y146 PolarHBondContact NE2-OH 3.23Å; Q142-Y146 WeakPolarHBondContact O-CD2 3.3Å; Q142-Y146 VanDerWaalsContact O-CG 3.28Å; Q142-Y146 PolarHBondContact O-N 3.32Å; W143-Y146 HydrophobicContact CD2-CD2 4.34Å; W143-Y146 AromaticContact CE3-CD2 3.76Å; W143-Y146 HydrophobicContact CE3-CD2 3.76Å; W143-Y146 HydrophobicContact CE3-CE2 4.44Å; W143-Y146 HydrophobicContact CZ3-CD2 4.08Å; W143-Y146 WeakPolarHBondContact O-CB 3.41Å; W143-Y146 PolarHBondContact O-N 3.19Å; W143-Y146 VanDerWaalsContact O-N 3.14Å; E144-Y146 VanDerWaalsContact C-N 3.32Å; E144-Y146 PolarHBondContact O-N 3.34Å; Y146-F149 PolarHBondContact O-N 3.31Å; Y146-R150 WeakPolarHBondContact O-CG 3.5Å; Y146-R150 PolarHBondContact O-N 3.31Å
147	V	96.4	Very high	94.8	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.006	29%	0.289	C	S	.	.	H	α-helix	trans	-59.1	-50	174.3	172.9	0	0	0	0	110.5	W143 E144 F149 R150 W151 F154 W163 Y167 M170	W143-V147 WeakPolarHBondContact O-CG2 3.42Å; W143-V147 PolarHBondContact O-N 3.02Å; E144-V147 PolarHBondContact O-N 3.01Å; V147-F149 VanDerWaalsContact C-N 3.26Å; V147-F149 PolarHBondContact O-N 3.39Å; V147-R150 PolarHBondContact O-N 3.08Å; V147-W151 HydrophobicContact CG1-CE3 4.38Å; V147-W151 PolarHBondContact O-N 3.33Å; V147-F154 HydrophobicContact CG1-CD1 3.79Å; V147-F154 HydrophobicContact CG1-CE1 4.18Å; V147-W163 HydrophobicContact CB-CE3 4.33Å; V147-W163 HydrophobicContact CB-CZ3 4.35Å; V147-W163 HydrophobicContact CG1-CZ3 4.19Å; V147-W163 HydrophobicContact CG2-CE3 4.24Å; V147-Y167 HydrophobicContact CG2-CD2 3.92Å; V147-Y167 HydrophobicContact CG2-CG 4.36Å; V147-M170 HydrophobicContact CG1-SD 3.82Å; V147-M170 HydrophobicContact CG2-SD 4.45Å
148	S	94.6	Very high	94.5	Very high	67 Å²	67	52.5 Å²	52.5	47%	0.469	28%	0.283	S	S	.	.	H	α-helix	trans	-61.9	-34.5	-179.6	-58.4	0	0	0	0	112.7	E144	E144-S148 WeakPolarHBondContact O-CB 3.46Å; E144-S148 PolarHBondContact O-N 3.06Å; E144-S148 PolarHBondContact O-OG 3.45Å
149	F	93	Very high	94.5	Very high	86 Å²	86	62.7 Å²	62.7	38%	0.377	32%	0.32	S	S	.	.	H	α-helix	trans	-69.3	-46.4	178.5	-179.6	-107.8	0	0	0	112.3	S145 Y146 V147 R184	S145-F149 VanDerWaalsContact O-CB 3.26Å; S145-F149 WeakPolarHBondContact O-CB 3.4Å; S145-F149 PolarHBondContact O-N 2.96Å; Y146-F149 PolarHBondContact O-N 3.31Å; V147-F149 VanDerWaalsContact C-N 3.26Å; V147-F149 PolarHBondContact O-N 3.39Å; F149-R184 HydrophobicContact CE1-CG 4.35Å; F149-R184 HydrophobicContact CE2-CG 4.17Å; F149-R184 HydrophobicContact CZ-CB 4.04Å; F149-R184 HydrophobicContact CZ-CG 3.86Å; F149-R184 PolarHBondContact O-NH2 3.29Å
150	R	93.9	Very high	94.5	Very high	11 Å²	11	61.3 Å²	61.3	4%	0.042	31%	0.309	C	S	.	.	H	α-helix	trans	-84.2	-34.1	-174.2	-64.6	-60	-179.6	178	0.2	113.8	D116 D117 Y146 V147 P152	D116-R150 IonicContact OD2-NH2 3.22Å; D116-R150 PolarHBondContact OD2-NH2 2.82Å; D117-R150 IonicContact OD1-CZ 3.4Å; D117-R150 VanDerWaalsContact OD1-CZ 3.3Å; D117-R150 IonicContact OD1-NE 3.54Å; D117-R150 PolarHBondContact OD1-NE 3.07Å; D117-R150 VanDerWaalsContact OD1-NE 3.11Å; D117-R150 IonicContact OD1-NH2 3.5Å; D117-R150 PolarHBondContact OD1-NH2 2.95Å; D117-R150 WeakPolarHBondContact OD2-CG 3.48Å; D117-R150 IonicContact OD2-CZ 2.95Å; D117-R150 IonicContact OD2-NE 3.11Å; D117-R150 PolarHBondContact OD2-NE 3.03Å; D117-R150 IonicContact OD2-NH2 2.67Å; Y146-R150 WeakPolarHBondContact O-CG 3.5Å; Y146-R150 PolarHBondContact O-N 3.31Å; V147-R150 PolarHBondContact O-N 3.08Å; R150-P152 VanDerWaalsContact C-CD 3.41Å; R150-P152 WeakPolarHBondContact O-CD 3.34Å
151	W	95.3	Very high	94.3	Very high	10 Å²	10	65.2 Å²	65.2	4%	0.038	33%	0.328	C	S	.	.			trans	-121.3	69.2	178.3	-62	-89.2	0	0	0	111.3	V147 L153 F154 Y167 M170 M171 V174 L180 H247	V147-W151 HydrophobicContact CG1-CE3 4.38Å; V147-W151 PolarHBondContact O-N 3.33Å; W151-L153 PolarHBondContact O-N 3.14Å; W151-F154 HydrophobicContact CB-CB 3.73Å; W151-F154 VanDerWaalsContact O-CB 3.25Å; W151-F154 WeakPolarHBondContact O-CB 3.27Å; W151-F154 PolarHBondContact O-N 2.97Å; W151-Y167 HydrophobicContact CH2-CD2 4.47Å; W151-Y167 HydrophobicContact CH2-CE2 4.33Å; W151-Y167 AromaticContact CZ3-CD2 3.84Å; W151-Y167 HydrophobicContact CZ3-CD2 3.84Å; W151-Y167 AromaticContact CZ3-CE2 3.87Å; W151-Y167 HydrophobicContact CZ3-CE2 3.87Å; W151-M170 HydrophobicContact CB-CE 3.74Å; W151-M170 HydrophobicContact CD2-CB 4.37Å; W151-M170 HydrophobicContact CD2-CE 3.44Å; W151-M170 VanDerWaalsContact CD2-CE 3.44Å; W151-M170 HydrophobicContact CD2-SD 4.17Å; W151-M170 HydrophobicContact CE3-CB 4.33Å; W151-M170 HydrophobicContact CE3-CE 3.9Å; W151-M170 HydrophobicContact CE3-SD 4.03Å; W151-M170 HydrophobicContact CG-CE 3.34Å; W151-M170 HydrophobicContact CH2-CB 3.64Å; W151-M170 HydrophobicContact CZ2-CB 3.64Å; W151-M170 HydrophobicContact CZ3-CB 3.99Å; W151-M170 HydrophobicContact CZ3-SD 4.43Å; W151-M171 HydrophobicContact CH2-CG 4.04Å; W151-M171 HydrophobicContact CH2-SD 3.81Å; W151-M171 HydrophobicContact CZ2-SD 4.39Å; W151-V174 HydrophobicContact CZ2-CG2 3.82Å; W151-L180 HydrophobicContact CH2-CD2 4.17Å; W151-L180 HydrophobicContact CZ2-CD1 4.16Å; W151-L180 HydrophobicContact CZ2-CD2 3.94Å; W151-H247 AromaticContact CD1-CD2 3.99Å; W151-H247 AromaticContact CD1-CE1 3.7Å; W151-H247 AromaticContact CD1-ND1 3.87Å; W151-H247 AromaticContact CD1-NE2 3.76Å
152	P	94.1	Very high	94.3	Very high	44 Å²	44	59 Å²	59	29%	0.286	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-12.7	-176.9	27.8	-37.9	0	0	0	114.8	R150 I219 L230	R150-P152 VanDerWaalsContact C-CD 3.41Å; R150-P152 WeakPolarHBondContact O-CD 3.34Å; P152-I219 HydrophobicContact CB-CD1 3.93Å; P152-I219 HydrophobicContact CG-CD1 3.48Å; P152-I219 VanDerWaalsContact CG-CD1 3.48Å; P152-L230 HydrophobicContact CG-CD2 3.78Å
153	L	95.2	Very high	94.4	Very high	23 Å²	23	58.2 Å²	58.2	12%	0.12	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-10.4	172.7	-70.3	-177.5	0	0	0	113.3	W151 K217 I219 L230 A231 G232 F245	W151-L153 PolarHBondContact O-N 3.14Å; L153-K217 HydrophobicContact CD2-CB 4.32Å; L153-I219 HydrophobicContact CD2-CB 4.47Å; L153-I219 HydrophobicContact CD2-CD1 4.28Å; L153-I219 HydrophobicContact CD2-CG1 4.08Å; L153-I219 HydrophobicContact CD2-CG2 3.73Å; L153-I219 HydrophobicContact CG-CD1 4.23Å; L153-I219 HydrophobicContact CG-CG1 4.19Å; L153-L230 HydrophobicContact CD1-CB 4.47Å; L153-L230 HydrophobicContact CD1-CD2 4.16Å; L153-L230 HydrophobicContact CD1-CG 3.88Å; L153-L230 HydrophobicContact CG-CD2 4.13Å; L153-L230 HydrophobicContact CG-CG 4.38Å; L153-A231 VanDerWaalsContact CD1-C 3.5Å; L153-G232 VanDerWaalsContact CD1-N 3.34Å; L153-F245 HydrophobicContact CB-CE1 3.94Å; L153-F245 HydrophobicContact CB-CZ 4.07Å
154	F	95.9	Very high	94.4	Very high	29 Å²	29	60.9 Å²	60.9	13%	0.127	31%	0.306	C	S	.	.			trans	-72.4	129.2	179.3	176.8	-104.1	0	0	0	110.1	V147 W151 P156 L166 M170 H344 D345	V147-F154 HydrophobicContact CG1-CD1 3.79Å; V147-F154 HydrophobicContact CG1-CE1 4.18Å; W151-F154 HydrophobicContact CB-CB 3.73Å; W151-F154 VanDerWaalsContact O-CB 3.25Å; W151-F154 WeakPolarHBondContact O-CB 3.27Å; W151-F154 PolarHBondContact O-N 2.97Å; F154-P156 HydrophobicContact CE1-CB 3.99Å; F154-P156 HydrophobicContact CE1-CG 4.13Å; F154-P156 HydrophobicContact CZ-CB 3.94Å; F154-L166 HydrophobicContact CE1-CD2 3.83Å; F154-L166 HydrophobicContact CZ-CD1 4.3Å; F154-L166 HydrophobicContact CZ-CD2 3.98Å; F154-M170 HydrophobicContact CB-CE 4.15Å; F154-M170 HydrophobicContact CD1-CE 4.39Å; F154-M170 HydrophobicContact CD2-CE 3.85Å; F154-M170 HydrophobicContact CE2-CE 4.35Å; F154-M170 HydrophobicContact CG-CE 3.87Å; F154-H344 HydrophobicContact CE2-CB 3.86Å; F154-H344 HydrophobicContact CZ-CB 4.38Å; F154-D345 HydrophobicContact CE2-CB 3.89Å
155	N	93.3	Very high	94.4	Very high	115 Å²	115	58.4 Å²	58.4	62%	0.615	30%	0.295	S	S	*	.			trans	-138.3	108.4	175.4	-177.7	36	0	0	0	108.6	N157	N155-N157 PolarHBondContact O-N 3.34Å
156	P	92.6	Very high	94.5	Very high	38 Å²	38	55.3 Å²	55.3	25%	0.247	27%	0.273	C	S	.	.			trans	-69.4	129.9	-175.5	28.4	-33.6	0	0	0	111	F154 V160 W163	F154-P156 HydrophobicContact CE1-CB 3.99Å; F154-P156 HydrophobicContact CE1-CG 4.13Å; F154-P156 HydrophobicContact CZ-CB 3.94Å; P156-V160 HydrophobicContact CB-CG2 3.84Å; P156-V160 HydrophobicContact CG-CG2 4.09Å; P156-W163 HydrophobicContact CG-CH2 4.3Å
157	N	90.3	Very high	94.5	Very high	89 Å²	89	53.7 Å²	53.7	48%	0.476	27%	0.266	S	S	.	.	S	Bend	trans	-84.7	-16.2	176.1	-64.8	-50.1	0	0	0	112.1	N155 D345 Y346	N155-N157 PolarHBondContact O-N 3.34Å; N157-D345 WeakPolarHBondContact CA-O 3.25Å; N157-D345 WeakPolarHBondContact CB-O 3.29Å; N157-D345 PolarHBondContact N-O 3.46Å; N157-D345 PolarHBondContact ND2-OD2 3.44Å; N157-Y346 HydrophobicContact CB-CD1 4.17Å; N157-Y346 HydrophobicContact CB-CE1 3.94Å; N157-Y346 WeakPolarHBondContact ND2-CE2 3.35Å; N157-Y346 PolarHBondContact ND2-OH 2.83Å
158	C	87.8	Confident	94.6	Very high	51 Å²	51	54 Å²	54	35%	0.345	27%	0.268	S	S	.	.	S	Bend	trans	-115.3	164.2	173.3	63.2	0	0	0	0	111.9	V160 D345	C158-V160 PolarHBondContact O-N 3.37Å; C158-D345 PolarHBondContact N-O 2.74Å
159	R	92.6	Very high	94.7	Very high	229 Å²	229	51.1 Å²	51.1	86%	0.864	25%	0.248	S	C	*	.			trans	-65.9	128.6	172.1	-178.2	179.7	178.6	-176.4	-1	109.6
160	V	94.5	Very high	94.9	Very high	28 Å²	28	47.2 Å²	47.2	17%	0.17	23%	0.231	C	C	.	.			trans	-81.9	121.4	173.4	-177	0	0	0	0	109.2	P156 C158 W163 L166	P156-V160 HydrophobicContact CB-CG2 3.84Å; P156-V160 HydrophobicContact CG-CG2 4.09Å; C158-V160 PolarHBondContact O-N 3.37Å; V160-W163 HydrophobicContact CB-CD2 4.17Å; V160-W163 HydrophobicContact CB-CE3 4.48Å; V160-W163 HydrophobicContact CB-CH2 4.37Å; V160-W163 HydrophobicContact CB-CZ2 4.05Å; V160-W163 HydrophobicContact CG1-CD2 3.76Å; V160-W163 HydrophobicContact CG1-CE3 4.02Å; V160-W163 HydrophobicContact CG1-CG 4.05Å; V160-W163 HydrophobicContact CG2-CE3 4.47Å; V160-W163 HydrophobicContact CG2-CH2 3.93Å; V160-W163 HydrophobicContact CG2-CZ2 4.07Å; V160-W163 HydrophobicContact CG2-CZ3 4.13Å; V160-L166 HydrophobicContact CG1-CB 4.24Å; V160-L166 HydrophobicContact CG1-CD2 3.79Å; V160-L166 HydrophobicContact CG2-CD2 3.89Å
161	E	93.4	Very high	95.1	Very high	153 Å²	153	47 Å²	47	72%	0.715	23%	0.23	S	C	*	.	S	Bend	trans	-83.7	-35.4	-180	-64.1	-177.4	168.8	0	0	112.6
162	S	96.2	Very high	95.1	Very high	22 Å²	22	50.7 Å²	50.7	15%	0.154	25%	0.248	C	C	.	.			trans	-143.4	103.6	178.1	151.5	0	0	0	0	109.5	E140 R164 L165 L166	E140-S162 WeakPolarHBondContact OE2-CA 3.49Å; S162-R164 VanDerWaalsContact C-N 3.26Å; S162-R164 PolarHBondContact O-N 3.33Å; S162-L165 PolarHBondContact O-N 2.62Å; S162-L165 WeakPolarHBondContact OG-CB 3.26Å; S162-L165 PolarHBondContact OG-N 2.93Å; S162-L166 PolarHBondContact O-N 3.19Å
163	W	97.2	Very high	95.3	Very high	41 Å²	41	48.9 Å²	48.9	16%	0.155	24%	0.236	C	C	.	.	H	α-helix	trans	-61.4	-35	173.7	-72.3	108	0	0	0	112.1	E140 W143 E144 V147 P156 V160 L166 Y167	E140-W163 WeakPolarHBondContact O-CB 3.37Å; E140-W163 WeakPolarHBondContact OE2-CA 2.98Å; E140-W163 WeakPolarHBondContact OE2-CB 3.45Å; E140-W163 PolarHBondContact OE2-N 3.49Å; W143-W163 HydrophobicContact CB-CB 3.72Å; E144-W163 HydrophobicContact CB-CB 4.4Å; E144-W163 HydrophobicContact CB-CD2 3.58Å; E144-W163 HydrophobicContact CB-CE3 4Å; E144-W163 HydrophobicContact CB-CG 3.77Å; E144-W163 HydrophobicContact CB-CZ2 4.26Å; E144-W163 HydrophobicContact CG-CD2 3.88Å; E144-W163 HydrophobicContact CG-CE3 4.11Å; E144-W163 HydrophobicContact CG-CH2 3.88Å; E144-W163 HydrophobicContact CG-CZ2 3.61Å; E144-W163 HydrophobicContact CG-CZ3 4.12Å; E144-W163 VanDerWaalsContact OE1-CZ2 3.32Å; E144-W163 WeakPolarHBondContact OE1-CZ2 3.48Å; V147-W163 HydrophobicContact CB-CE3 4.33Å; V147-W163 HydrophobicContact CB-CZ3 4.35Å; V147-W163 HydrophobicContact CG1-CZ3 4.19Å; V147-W163 HydrophobicContact CG2-CE3 4.24Å; P156-W163 HydrophobicContact CG-CH2 4.3Å; V160-W163 HydrophobicContact CB-CD2 4.17Å; V160-W163 HydrophobicContact CB-CE3 4.48Å; V160-W163 HydrophobicContact CB-CH2 4.37Å; V160-W163 HydrophobicContact CB-CZ2 4.05Å; V160-W163 HydrophobicContact CG1-CD2 3.76Å; V160-W163 HydrophobicContact CG1-CE3 4.02Å; V160-W163 HydrophobicContact CG1-CG 4.05Å; V160-W163 HydrophobicContact CG2-CE3 4.47Å; V160-W163 HydrophobicContact CG2-CH2 3.93Å; V160-W163 HydrophobicContact CG2-CZ2 4.07Å; V160-W163 HydrophobicContact CG2-CZ3 4.13Å; W163-L166 HydrophobicContact CE3-CD2 3.76Å; W163-L166 HydrophobicContact CZ3-CD2 3.81Å; W163-L166 PolarHBondContact O-N 3.1Å; W163-Y167 WeakPolarHBondContact O-CB 3.26Å; W163-Y167 PolarHBondContact O-N 2.91Å
164	R	97	Very high	95.4	Very high	56 Å²	56	48.6 Å²	48.6	21%	0.211	24%	0.235	C	C	.	.	H	α-helix	trans	-57.9	-55	174.2	-177.4	174	61.9	79	13.9	111.2	D135 E140 W143 S162 L166 Y167 L168	D135-R164 WeakPolarHBondContact OD1-CD 3.39Å; D135-R164 IonicContact OD1-CZ 3.79Å; D135-R164 IonicContact OD1-NE 3.87Å; D135-R164 IonicContact OD1-NH1 2.99Å; D135-R164 PolarHBondContact OD1-NH1 3.26Å; D135-R164 IonicContact OD2-NH1 3.37Å; D135-R164 PolarHBondContact OD2-NH1 3.06Å; E140-R164 WeakPolarHBondContact OE1-CB 3.34Å; E140-R164 PolarHBondContact OE2-N 3.05Å; W143-R164 HydrophobicContact CB-CB 4.47Å; W143-R164 HydrophobicContact CD2-CB 4.01Å; W143-R164 HydrophobicContact CD2-CG 4Å; W143-R164 HydrophobicContact CG-CB 3.77Å; W143-R164 HydrophobicContact CG-CG 4.27Å; W143-R164 HydrophobicContact CZ2-CG 3.95Å; S162-R164 VanDerWaalsContact C-N 3.26Å; S162-R164 PolarHBondContact O-N 3.33Å; R164-L166 VanDerWaalsContact C-N 3.32Å; R164-L166 PolarHBondContact O-N 2.98Å; R164-Y167 WeakPolarHBondContact O-CB 3.14Å; R164-Y167 PolarHBondContact O-N 3.49Å; R164-L168 HydrophobicContact CG-CD1 4.49Å; R164-L168 VanDerWaalsContact O-CG 3.32Å; R164-L168 WeakPolarHBondContact O-CG 3.44Å; R164-L168 PolarHBondContact O-N 3.34Å
165	L	96.7	Very high	95.4	Very high	29 Å²	29	48.2 Å²	48.2	15%	0.152	24%	0.235	C	C	.	.	H	α-helix	trans	-63.4	-39.2	-179.8	-167.6	63.7	0	0	0	112.2	S162 L168 N169 A349 D350 S353	S162-L165 PolarHBondContact O-N 2.62Å; S162-L165 WeakPolarHBondContact OG-CB 3.26Å; S162-L165 PolarHBondContact OG-N 2.93Å; L165-L168 HydrophobicContact CD1-CD1 4.35Å; L165-L168 PolarHBondContact O-N 2.89Å; L165-N169 VanDerWaalsContact O-CG 3.31Å; L165-N169 PolarHBondContact O-N 2.91Å; L165-N169 PolarHBondContact O-ND2 2.84Å; L165-A349 HydrophobicContact CB-CB 3.94Å; L165-A349 HydrophobicContact CD2-CB 3.88Å; L165-A349 HydrophobicContact CG-CB 3.89Å; L165-D350 HydrophobicContact CD2-CB 4.48Å; L165-D350 WeakPolarHBondContact CD2-OD1 3.28Å; L165-S353 VanDerWaalsContact CD1-OG 3.27Å; L165-S353 WeakPolarHBondContact CD1-OG 3.38Å; L165-S353 WeakPolarHBondContact CG-OG 3.3Å
166	L	97.7	Very high	95.4	Very high	5 Å²	5	44.6 Å²	44.6	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-57.6	-50.2	172.7	176.2	62.1	0	0	0	111.3	F154 V160 S162 W163 R164 L168 N169 M170 H344 A349	F154-L166 HydrophobicContact CE1-CD2 3.83Å; F154-L166 HydrophobicContact CZ-CD1 4.3Å; F154-L166 HydrophobicContact CZ-CD2 3.98Å; V160-L166 HydrophobicContact CG1-CB 4.24Å; V160-L166 HydrophobicContact CG1-CD2 3.79Å; V160-L166 HydrophobicContact CG2-CD2 3.89Å; S162-L166 PolarHBondContact O-N 3.19Å; W163-L166 HydrophobicContact CE3-CD2 3.76Å; W163-L166 HydrophobicContact CZ3-CD2 3.81Å; W163-L166 PolarHBondContact O-N 3.1Å; R164-L166 VanDerWaalsContact C-N 3.32Å; R164-L166 PolarHBondContact O-N 2.98Å; L166-L168 VanDerWaalsContact C-N 3.29Å; L166-L168 PolarHBondContact O-N 2.98Å; L166-N169 PolarHBondContact O-N 2.93Å; L166-M170 HydrophobicContact CD1-CG 4.02Å; L166-M170 HydrophobicContact CD1-SD 4.02Å; L166-M170 HydrophobicContact CG-CG 4.37Å; L166-M170 HydrophobicContact CG-SD 4.01Å; L166-M170 WeakPolarHBondContact O-CB 3.31Å; L166-M170 VanDerWaalsContact O-CG 3.29Å; L166-M170 WeakPolarHBondContact O-CG 3.45Å; L166-M170 PolarHBondContact O-N 3.09Å; L166-H344 HydrophobicContact CD1-CB 3.89Å; L166-A349 HydrophobicContact CB-CB 4.33Å
167	Y	97.6	Very high	95.4	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-57.3	-42.6	177.1	179.7	-86.6	0	0	0	111.8	D117 W121 W143 V147 W151 W163 R164 M170 M171	D117-Y167 HydrophobicContact CB-CE2 4.42Å; D117-Y167 WeakPolarHBondContact CB-OH 3.48Å; D117-Y167 PolarHBondContact O-OH 3.43Å; D117-Y167 PolarHBondContact OD2-OH 3.44Å; W121-Y167 HydrophobicContact CB-CE1 4.17Å; W121-Y167 HydrophobicContact CG-CE1 4.42Å; W143-Y167 AromaticContact CE3-CD1 3.71Å; W143-Y167 HydrophobicContact CE3-CD1 3.71Å; W143-Y167 HydrophobicContact CE3-CD2 4.4Å; W143-Y167 HydrophobicContact CE3-CE1 4.34Å; W143-Y167 AromaticContact CE3-CG 3.75Å; W143-Y167 HydrophobicContact CE3-CG 3.75Å; W143-Y167 AromaticContact CZ3-CD1 3.42Å; W143-Y167 HydrophobicContact CZ3-CD1 3.42Å; W143-Y167 VanDerWaalsContact CZ3-CD1 3.42Å; W143-Y167 AromaticContact CZ3-CE1 3.73Å; W143-Y167 HydrophobicContact CZ3-CE1 3.73Å; W143-Y167 AromaticContact CZ3-CG 3.96Å; W143-Y167 HydrophobicContact CZ3-CG 3.96Å; V147-Y167 HydrophobicContact CG2-CD2 3.92Å; V147-Y167 HydrophobicContact CG2-CG 4.36Å; W151-Y167 HydrophobicContact CH2-CD2 4.47Å; W151-Y167 HydrophobicContact CH2-CE2 4.33Å; W151-Y167 AromaticContact CZ3-CD2 3.84Å; W151-Y167 HydrophobicContact CZ3-CD2 3.84Å; W151-Y167 AromaticContact CZ3-CE2 3.87Å; W151-Y167 HydrophobicContact CZ3-CE2 3.87Å; W163-Y167 WeakPolarHBondContact O-CB 3.26Å; W163-Y167 PolarHBondContact O-N 2.91Å; R164-Y167 WeakPolarHBondContact O-CB 3.14Å; R164-Y167 PolarHBondContact O-N 3.49Å; Y167-M170 PolarHBondContact O-N 3.26Å; Y167-M171 HydrophobicContact CD1-CG 3.98Å; Y167-M171 HydrophobicContact CE1-CG 3.5Å; Y167-M171 HydrophobicContact CE1-SD 4.39Å; Y167-M171 HydrophobicContact CE2-CG 4.43Å; Y167-M171 WeakPolarHBondContact O-CB 3.41Å; Y167-M171 WeakPolarHBondContact O-CG 3.34Å; Y167-M171 PolarHBondContact O-N 3.02Å
168	L	97.2	Very high	95.4	Very high	9 Å²	9	50.7 Å²	50.7	5%	0.047	23%	0.233	C	C	.	.	H	α-helix	trans	-61.1	-47.5	176.5	-64.4	174.7	0	0	0	111.8	R124 R164 L165 L166 M170 M171 E172	R124-L168 VanDerWaalsContact CZ-CD1 3.48Å; R164-L168 HydrophobicContact CG-CD1 4.49Å; R164-L168 VanDerWaalsContact O-CG 3.32Å; R164-L168 WeakPolarHBondContact O-CG 3.44Å; R164-L168 PolarHBondContact O-N 3.34Å; L165-L168 HydrophobicContact CD1-CD1 4.35Å; L165-L168 PolarHBondContact O-N 2.89Å; L166-L168 VanDerWaalsContact C-N 3.29Å; L166-L168 PolarHBondContact O-N 2.98Å; L168-M170 PolarHBondContact O-N 3.32Å; L168-M171 PolarHBondContact O-N 3.12Å; L168-E172 PolarHBondContact O-N 2.91Å
169	N	97.5	Very high	95.5	Very high	6 Å²	6	48.7 Å²	48.7	3%	0.032	22%	0.219	C	C	.	.	H	α-helix	trans	-62.4	-41.7	177.2	-69.2	-19	0	0	0	111.8	L165 L166 E172 S173 A349 V352 S353	L165-N169 VanDerWaalsContact O-CG 3.31Å; L165-N169 PolarHBondContact O-N 2.91Å; L165-N169 PolarHBondContact O-ND2 2.84Å; L166-N169 PolarHBondContact O-N 2.93Å; N169-E172 PolarHBondContact O-N 3.19Å; N169-S173 PolarHBondContact O-N 3.33Å; N169-S173 VanDerWaalsContact O-N 3.07Å; N169-S173 PolarHBondContact O-OG 2.81Å; N169-A349 PolarHBondContact ND2-O 3.13Å; N169-V352 HydrophobicContact CB-CG1 4.07Å; N169-S353 VanDerWaalsContact CG-OG 3.28Å; N169-S353 PolarHBondContact ND2-OG 3.44Å; N169-S353 VanDerWaalsContact ND2-OG 3.07Å; N169-S353 PolarHBondContact OD1-OG 2.73Å
170	M	97.7	Very high	95.5	Very high	4 Å²	4	37.8 Å²	37.8	2%	0.02	18%	0.178	C	C	.	.	H	α-helix	trans	-65.5	-39.3	176.9	-68.5	-175.2	85.9	0	0	111.5	V147 W151 F154 L166 Y167 L168 E172 S173 V174 H344	V147-M170 HydrophobicContact CG1-SD 3.82Å; V147-M170 HydrophobicContact CG2-SD 4.45Å; W151-M170 HydrophobicContact CB-CE 3.74Å; W151-M170 HydrophobicContact CD2-CB 4.37Å; W151-M170 HydrophobicContact CD2-CE 3.44Å; W151-M170 VanDerWaalsContact CD2-CE 3.44Å; W151-M170 HydrophobicContact CD2-SD 4.17Å; W151-M170 HydrophobicContact CE3-CB 4.33Å; W151-M170 HydrophobicContact CE3-CE 3.9Å; W151-M170 HydrophobicContact CE3-SD 4.03Å; W151-M170 HydrophobicContact CG-CE 3.34Å; W151-M170 HydrophobicContact CH2-CB 3.64Å; W151-M170 HydrophobicContact CZ2-CB 3.64Å; W151-M170 HydrophobicContact CZ3-CB 3.99Å; W151-M170 HydrophobicContact CZ3-SD 4.43Å; F154-M170 HydrophobicContact CB-CE 4.15Å; F154-M170 HydrophobicContact CD1-CE 4.39Å; F154-M170 HydrophobicContact CD2-CE 3.85Å; F154-M170 HydrophobicContact CE2-CE 4.35Å; F154-M170 HydrophobicContact CG-CE 3.87Å; L166-M170 HydrophobicContact CD1-CG 4.02Å; L166-M170 HydrophobicContact CD1-SD 4.02Å; L166-M170 HydrophobicContact CG-CG 4.37Å; L166-M170 HydrophobicContact CG-SD 4.01Å; L166-M170 WeakPolarHBondContact O-CB 3.31Å; L166-M170 VanDerWaalsContact O-CG 3.29Å; L166-M170 WeakPolarHBondContact O-CG 3.45Å; L166-M170 PolarHBondContact O-N 3.09Å; Y167-M170 PolarHBondContact O-N 3.26Å; L168-M170 PolarHBondContact O-N 3.32Å; M170-E172 PolarHBondContact O-N 3.48Å; M170-S173 VanDerWaalsContact O-CB 3.31Å; M170-S173 WeakPolarHBondContact O-CB 3.47Å; M170-S173 PolarHBondContact O-N 2.86Å; M170-S173 VanDerWaalsContact O-N 3.11Å; M170-V174 WeakPolarHBondContact O-CG2 3.44Å; M170-V174 PolarHBondContact O-N 3.4Å; M170-H344 HydrophobicContact CG-CB 4.38Å
171	M	97.1	Very high	95.1	Very high	5 Å²	5	40 Å²	40	3%	0.025	19%	0.187	C	C	.	.	H	α-helix	trans	-63.2	-38.3	173.2	-77.6	-61.6	-68	0	0	112.8	I118 W121 W151 Y167 L168 S173 V174 R177 L180	I118-M171 HydrophobicContact CG1-CE 4.38Å; I118-M171 HydrophobicContact CG2-CE 4.48Å; W121-M171 HydrophobicContact CD2-CE 3.97Å; W121-M171 HydrophobicContact CE3-CE 4.2Å; W121-M171 HydrophobicContact CG-CB 4.5Å; W121-M171 HydrophobicContact CG-CE 4.14Å; W121-M171 HydrophobicContact CG-CG 4.24Å; W121-M171 HydrophobicContact CZ2-CB 4.49Å; W151-M171 HydrophobicContact CH2-CG 4.04Å; W151-M171 HydrophobicContact CH2-SD 3.81Å; W151-M171 HydrophobicContact CZ2-SD 4.39Å; Y167-M171 HydrophobicContact CD1-CG 3.98Å; Y167-M171 HydrophobicContact CE1-CG 3.5Å; Y167-M171 HydrophobicContact CE1-SD 4.39Å; Y167-M171 HydrophobicContact CE2-CG 4.43Å; Y167-M171 WeakPolarHBondContact O-CB 3.41Å; Y167-M171 WeakPolarHBondContact O-CG 3.34Å; Y167-M171 PolarHBondContact O-N 3.02Å; L168-M171 PolarHBondContact O-N 3.12Å; M171-S173 PolarHBondContact O-N 3.25Å; M171-V174 PolarHBondContact O-N 2.93Å; M171-R177 HydrophobicContact CE-CG 4.39Å; M171-L180 HydrophobicContact CE-CD2 4.48Å; M171-L180 HydrophobicContact SD-CD2 3.63Å
172	E	96.1	Very high	94.7	Very high	89 Å²	89	38 Å²	38	42%	0.416	17%	0.173	S	C	.	.	H	α-helix	trans	-68.4	-21.4	173.7	-72.1	-176.6	-174.2	0	0	113.3	L168 N169 M170 V174 R268	L168-E172 PolarHBondContact O-N 2.91Å; N169-E172 PolarHBondContact O-N 3.19Å; M170-E172 PolarHBondContact O-N 3.48Å; E172-V174 VanDerWaalsContact C-N 3.3Å; E172-R268 WeakPolarHBondContact O-CD 3.47Å
173	S	97.5	Very high	94.1	Very high	5 Å²	5	37.4 Å²	37.4	4%	0.035	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-4.4	178.2	-53.9	0	0	0	0	113.5	N169 M170 M171 T267 R268 F341 H344	N169-S173 PolarHBondContact O-N 3.33Å; N169-S173 VanDerWaalsContact O-N 3.07Å; N169-S173 PolarHBondContact O-OG 2.81Å; M170-S173 VanDerWaalsContact O-CB 3.31Å; M170-S173 WeakPolarHBondContact O-CB 3.47Å; M170-S173 PolarHBondContact O-N 2.86Å; M170-S173 VanDerWaalsContact O-N 3.11Å; M171-S173 PolarHBondContact O-N 3.25Å; S173-T267 CarbonylContact O-C 3.51Å; S173-T267 WeakPolarHBondContact O-CA 3.33Å; S173-R268 WeakPolarHBondContact O-CG 3.45Å; S173-R268 PolarHBondContact O-N 3.17Å; S173-F341 WeakPolarHBondContact CB-O 3.18Å; S173-F341 WeakPolarHBondContact OG-CA 3.25Å; S173-F341 PolarHBondContact OG-O 2.87Å; S173-H344 PolarHBondContact OG-CE1 3.34Å; S173-H344 PolarHBondContact OG-NE2 2.68Å
174	V	97.2	Very high	92.8	Very high	17 Å²	17	40.7 Å²	40.7	10%	0.103	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-83.7	127.9	-177.6	172.7	0	0	0	0	110.8	W151 M170 M171 E172 C176 L180 L266	W151-V174 HydrophobicContact CZ2-CG2 3.82Å; M170-V174 WeakPolarHBondContact O-CG2 3.44Å; M170-V174 PolarHBondContact O-N 3.4Å; M171-V174 PolarHBondContact O-N 2.93Å; E172-V174 VanDerWaalsContact C-N 3.3Å; V174-C176 VanDerWaalsContact CG1-C 3.44Å; V174-C176 WeakPolarHBondContact CG1-O 3.32Å; V174-L180 HydrophobicContact CG1-CB 4.12Å; V174-L180 HydrophobicContact CG2-CD1 4.37Å; V174-L180 HydrophobicContact CG2-CD2 3.97Å; V174-L266 CarbonylContact C-O 3.57Å; V174-L266 VanDerWaalsContact CA-O 3.26Å; V174-L266 WeakPolarHBondContact CA-O 3.41Å
175	T	96.9	Very high	91.5	Very high	22 Å²	22	42.5 Å²	42.5	14%	0.135	19%	0.194	C	C	.	.	S	Bend	trans	-68.2	-37.2	175.3	54.7	0	0	0	0	112.6	F265 L266 R268	T175-F265 PolarHBondContact OG1-O 3.34Å; T175-L266 PolarHBondContact N-O 3.22Å; T175-L266 WeakPolarHBondContact OG1-CA 3.5Å; T175-L266 PolarHBondContact OG1-O 2.91Å; T175-R268 HydrophobicContact CG2-CB 4.39Å; T175-R268 HydrophobicContact CG2-CG 3.86Å
176	C	93.5	Very high	89.5	Confident	38 Å²	38	45.6 Å²	45.6	26%	0.257	22%	0.215	S	C	.	.			trans	-146.4	108.3	-177.4	-175.9	0	0	0	0	111.9	V174 F178 C179 L180	V174-C176 VanDerWaalsContact CG1-C 3.44Å; V174-C176 WeakPolarHBondContact CG1-O 3.32Å; C176-F178 VanDerWaalsContact C-N 3.27Å; C176-F178 PolarHBondContact O-N 3.4Å; C176-C179 HydrophobicContact CB-CB 3.98Å; C176-C179 WeakPolarHBondContact O-CB 3.48Å; C176-C179 PolarHBondContact O-N 2.84Å; C176-C179 VanDerWaalsContact O-N 3.07Å; C176-L180 PolarHBondContact O-N 2.87Å
177	R	91.2	Very high	87.5	Confident	139 Å²	139	49.7 Å²	49.7	53%	0.525	24%	0.24	S	C	.	.	H	α-helix	trans	-57	-39.1	179.1	-73	-178.2	-102.9	160.5	-7.7	112.9	M171 C179 L180 E181	M171-R177 HydrophobicContact CE-CG 4.39Å; R177-C179 VanDerWaalsContact C-N 3.31Å; R177-C179 PolarHBondContact O-N 3.48Å; R177-L180 PolarHBondContact O-N 3.32Å; R177-E181 WeakPolarHBondContact O-CB 3.36Å; R177-E181 PolarHBondContact O-N 2.92Å
178	F	90	Very high	85.4	Confident	117 Å²	117	54.9 Å²	54.9	51%	0.513	27%	0.272	S	S	.	.	H	α-helix	trans	-66.2	-30.4	178.2	-174.5	-98.3	0	0	0	113.4	C176 R182	C176-F178 VanDerWaalsContact C-N 3.27Å; C176-F178 PolarHBondContact O-N 3.4Å; F178-R182 VanDerWaalsContact CE2-CZ 3.41Å; F178-R182 WeakPolarHBondContact O-CB 3.27Å; F178-R182 WeakPolarHBondContact O-CG 3.45Å; F178-R182 PolarHBondContact O-N 2.81Å
179	C	89.9	Confident	83.1	Confident	8 Å²	8	62.1 Å²	62.1	5%	0.054	30%	0.303	C	S	.	.	H	α-helix	trans	-73	-41	173.2	-68.2	0	0	0	0	111.1	C176 R177 R182 L183 L249 L266	C176-C179 HydrophobicContact CB-CB 3.98Å; C176-C179 WeakPolarHBondContact O-CB 3.48Å; C176-C179 PolarHBondContact O-N 2.84Å; C176-C179 VanDerWaalsContact O-N 3.07Å; R177-C179 VanDerWaalsContact C-N 3.31Å; R177-C179 PolarHBondContact O-N 3.48Å; C179-R182 PolarHBondContact O-N 2.82Å; C179-L183 PolarHBondContact O-N 3.38Å; C179-L249 HydrophobicContact CB-CD2 4.18Å; C179-L266 HydrophobicContact CB-CD2 3.63Å
180	L	92.5	Very high	81	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-62.8	-45.1	175.4	-172.7	79.4	0	0	0	111.6	I118 W151 M171 V174 C176 R177 R182 L183	I118-L180 HydrophobicContact CD1-CD2 4.42Å; W151-L180 HydrophobicContact CH2-CD2 4.17Å; W151-L180 HydrophobicContact CZ2-CD1 4.16Å; W151-L180 HydrophobicContact CZ2-CD2 3.94Å; M171-L180 HydrophobicContact CE-CD2 4.48Å; M171-L180 HydrophobicContact SD-CD2 3.63Å; V174-L180 HydrophobicContact CG1-CB 4.12Å; V174-L180 HydrophobicContact CG2-CD1 4.37Å; V174-L180 HydrophobicContact CG2-CD2 3.97Å; C176-L180 PolarHBondContact O-N 2.87Å; R177-L180 PolarHBondContact O-N 3.32Å; L180-R182 VanDerWaalsContact C-N 3.27Å; L180-R182 PolarHBondContact O-N 3.4Å; L180-L183 HydrophobicContact CD1-CD1 3.74Å; L180-L183 HydrophobicContact CG-CD1 4.46Å; L180-L183 WeakPolarHBondContact O-CB 3.48Å; L180-L183 WeakPolarHBondContact O-CG 3.45Å; L180-L183 PolarHBondContact O-N 3.11Å
181	E	88.2	Confident	79.5	Confident	74 Å²	74	72.5 Å²	72.5	35%	0.346	36%	0.364	S	S	.	.	H	α-helix	trans	-57.5	-42.3	177	-172.6	-176.4	176.1	0	0	111.5	I118 R177 L183	I118-E181 HydrophobicContact CD1-CB 3.75Å; I118-E181 HydrophobicContact CD1-CG 4.14Å; R177-E181 WeakPolarHBondContact O-CB 3.36Å; R177-E181 PolarHBondContact O-N 2.92Å; E181-L183 VanDerWaalsContact C-N 3.3Å; E181-L183 PolarHBondContact O-N 3.07Å
182	R	84.6	Confident	78.4	Confident	111 Å²	111	81.2 Å²	81.2	42%	0.419	40%	0.404	S	S	.	.	H	α-helix	trans	-72.2	-12.5	-179.7	-85.3	178.4	170.7	62.4	0.8	115.8	F178 C179 L180 R184 L185	F178-R182 VanDerWaalsContact CE2-CZ 3.41Å; F178-R182 WeakPolarHBondContact O-CB 3.27Å; F178-R182 WeakPolarHBondContact O-CG 3.45Å; F178-R182 PolarHBondContact O-N 2.81Å; C179-R182 PolarHBondContact O-N 2.82Å; L180-R182 VanDerWaalsContact C-N 3.27Å; L180-R182 PolarHBondContact O-N 3.4Å; R182-R184 PolarHBondContact O-N 3.49Å; R182-L185 HydrophobicContact CG-CD1 4.46Å; R182-L185 PolarHBondContact O-N 2.7Å
183	L	82	Confident	77.6	Confident	10 Å²	10	77.9 Å²	77.9	5%	0.052	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-30.9	-177.4	-75.6	176.9	0	0	0	113.5	C179 L180 E181 L221 L230 L249 L266	C179-L183 PolarHBondContact O-N 3.38Å; L180-L183 HydrophobicContact CD1-CD1 3.74Å; L180-L183 HydrophobicContact CG-CD1 4.46Å; L180-L183 WeakPolarHBondContact O-CB 3.48Å; L180-L183 WeakPolarHBondContact O-CG 3.45Å; L180-L183 PolarHBondContact O-N 3.11Å; E181-L183 VanDerWaalsContact C-N 3.3Å; E181-L183 PolarHBondContact O-N 3.07Å; L183-L221 HydrophobicContact CB-CD1 4.19Å; L183-L221 HydrophobicContact CD2-CD1 3.57Å; L183-L221 HydrophobicContact CG-CD1 4.5Å; L183-L221 VanDerWaalsContact O-CD1 3.3Å; L183-L221 WeakPolarHBondContact O-CD1 3.32Å; L183-L230 HydrophobicContact CD2-CD1 4.29Å; L183-L249 HydrophobicContact CD2-CD1 3.74Å; L183-L266 HydrophobicContact CD1-CD1 3.94Å; L183-L266 HydrophobicContact CD2-CD1 3.96Å; L183-L266 HydrophobicContact CG-CD1 4.33Å
184	R	71.9	Confident	77.2	Confident	111 Å²	111	80.7 Å²	80.7	42%	0.419	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	0.4	-174.9	-64.4	-74.9	-167.2	158.4	3.1	113.6	F149 R182 P186	F149-R184 HydrophobicContact CE1-CG 4.35Å; F149-R184 HydrophobicContact CE2-CG 4.17Å; F149-R184 HydrophobicContact CZ-CB 4.04Å; F149-R184 HydrophobicContact CZ-CG 3.86Å; F149-R184 PolarHBondContact O-NH2 3.29Å; R182-R184 PolarHBondContact O-N 3.49Å; R184-P186 VanDerWaalsContact O-CD 3.26Å; R184-P186 WeakPolarHBondContact O-CD 3.34Å
185	L	68.5	Low	76.9	Confident	94 Å²	94	88.2 Å²	88.2	49%	0.492	44%	0.442	S	S	.	.	S	Bend	trans	-82.9	112.6	173	-69.5	174.5	0	0	0	107.4	R182 V187	R182-L185 HydrophobicContact CG-CD1 4.46Å; R182-L185 PolarHBondContact O-N 2.7Å; L185-V187 PolarHBondContact O-N 2.88Å
186	P	55.1	Low	76.7	Confident	93 Å²	93	91.6 Å²	91.6	60%	0.604	46%	0.462	S	S	*	.			trans	-55.5	130.6	169	23.8	-30.5	0	0	0	106.7	R184 V188	R184-P186 VanDerWaalsContact O-CD 3.26Å; R184-P186 WeakPolarHBondContact O-CD 3.34Å; P186-V188 WeakPolarHBondContact O-CA 3.37Å; P186-V188 WeakPolarHBondContact O-CG2 3.41Å; P186-V188 PolarHBondContact O-N 3.33Å
187	V	56.4	Low	76.7	Confident	92 Å²	92	89.9 Å²	89.9	56%	0.558	45%	0.45	S	S	*	.			trans	-50.7	117.7	171.5	167.1	0	0	0	0	106.1	L185 F189 H228	L185-V187 PolarHBondContact O-N 2.88Å; V187-F189 CarbonylContact O-C 3.58Å; V187-F189 PolarHBondContact O-N 3.46Å; V187-H228 WeakPolarHBondContact CG2-CE1 3.43Å; V187-H228 WeakPolarHBondContact CG2-NE2 3.36Å
188	V	52.2	Low	76.9	Confident	109 Å²	109	86.8 Å²	86.8	66%	0.661	44%	0.439	S	S	*	.	S	Bend	trans	-64.3	2.4	-154.7	178.2	0	0	0	0	113.3	P186	P186-V188 WeakPolarHBondContact O-CA 3.37Å; P186-V188 WeakPolarHBondContact O-CG2 3.41Å; P186-V188 PolarHBondContact O-N 3.33Å
189	F	49	Very low	77.1	Confident	161 Å²	161	88.6 Å²	88.6	71%	0.706	45%	0.447	S	S	*	.	S	Bend	trans	-141.5	107.2	173.1	-56.9	-77.6	0	0	0	108.9	V187 I191	V187-F189 CarbonylContact O-C 3.58Å; V187-F189 PolarHBondContact O-N 3.46Å; F189-I191 VanDerWaalsContact C-N 3.28Å; F189-I191 PolarHBondContact O-N 2.91Å
190	P	54.5	Low	77.4	Confident	113 Å²	113	92.2 Å²	92.2	73%	0.734	46%	0.459	S	S	*	.			trans	-69.2	94.2	169.1	27.3	-29.3	0	0	0	107.8
191	I	64.3	Low	77.5	Confident	115 Å²	115	92.2 Å²	92.2	59%	0.59	46%	0.459	S	S	*	.			trans	-66.7	127.7	154.7	-59.5	174.5	0	0	0	104.7	F189 A193	F189-I191 VanDerWaalsContact C-N 3.28Å; F189-I191 PolarHBondContact O-N 2.91Å; I191-A193 PolarHBondContact O-N 2.84Å
192	E	74.2	Confident	77.9	Confident	187 Å²	187	91.9 Å²	91.9	87%	0.874	46%	0.457	S	S	*	.			trans	-55.7	111.1	172.7	-75.8	-173.4	176.4	0	0	108.7
193	A	80.1	Confident	78.4	Confident	19 Å²	19	91.4 Å²	91.4	16%	0.157	46%	0.459	C	S	.	.			trans	-59.6	137.7	-179.3	0	0	0	0	0	109.6	I191 K195	I191-A193 PolarHBondContact O-N 2.84Å; A193-K195 PolarHBondContact O-N 3.39Å
194	P	89.2	Confident	79.1	Confident	65 Å²	65	91.4 Å²	91.4	42%	0.422	46%	0.459	S	S	.	.			trans	-52.8	137.4	179.6	-29.2	36	0	0	0	112.2	V196 R197 Y198 D254	P194-V196 PolarHBondContact O-N 2.95Å; P194-V196 VanDerWaalsContact O-N 3.13Å; P194-R197 HydrophobicContact CB-CB 4.13Å; P194-R197 WeakPolarHBondContact O-CA 3.36Å; P194-R197 VanDerWaalsContact O-CB 3.31Å; P194-R197 WeakPolarHBondContact O-CB 3.36Å; P194-R197 PolarHBondContact O-N 2.67Å; P194-Y198 PolarHBondContact O-N 3.1Å; P194-D254 WeakPolarHBondContact CG-O 3.26Å
195	K	91.6	Very high	80.3	Confident	175 Å²	175	87 Å²	87	76%	0.761	44%	0.442	S	S	*	.	H	α-helix	trans	-54.9	-38.7	-174.1	-69.4	-178.1	-179.8	175.9	0	113.4	A193 K199	A193-K195 PolarHBondContact O-N 3.39Å; K195-K199 WeakPolarHBondContact O-CB 3.32Å; K195-K199 VanDerWaalsContact O-CG 3.3Å; K195-K199 WeakPolarHBondContact O-CG 3.39Å; K195-K199 PolarHBondContact O-N 2.86Å
196	V	92.6	Very high	81.5	Confident	93 Å²	93	86.8 Å²	86.8	56%	0.564	44%	0.439	S	S	*	.	H	α-helix	trans	-63.8	-47.8	177.4	178.1	0	0	0	0	110.4	P194 K199 R200	P194-V196 PolarHBondContact O-N 2.95Å; P194-V196 VanDerWaalsContact O-N 3.13Å; V196-K199 PolarHBondContact O-N 2.81Å; V196-R200 VanDerWaalsContact O-CB 3.29Å; V196-R200 WeakPolarHBondContact O-CB 3.4Å; V196-R200 PolarHBondContact O-N 3.18Å
197	R	93.7	Very high	83.4	Confident	2 Å²	2	85.5 Å²	85.5	1%	0.008	43%	0.427	C	S	.	.	H	α-helix	trans	-58.4	-51.1	177	-177.3	-112.2	174.5	-124.4	4	111.5	P194 R200 I201 T225 Y226 S227 V252 P253 Y256	P194-R197 HydrophobicContact CB-CB 4.13Å; P194-R197 WeakPolarHBondContact O-CA 3.36Å; P194-R197 VanDerWaalsContact O-CB 3.31Å; P194-R197 WeakPolarHBondContact O-CB 3.36Å; P194-R197 PolarHBondContact O-N 2.67Å; R197-R200 PolarHBondContact O-N 3.03Å; R197-I201 WeakPolarHBondContact O-CG2 3.25Å; R197-I201 PolarHBondContact O-N 3.27Å; R197-T225 PolarHBondContact NH1-O 3.36Å; R197-Y226 PolarHBondContact NH1-O 3.31Å; R197-Y226 PolarHBondContact NH2-O 2.86Å; R197-S227 VanDerWaalsContact NH2-CA 3.26Å; R197-S227 PolarHBondContact NH2-OG 3.31Å; R197-S227 VanDerWaalsContact NH2-OG 3.07Å; R197-V252 VanDerWaalsContact NH2-CG1 3.34Å; R197-V252 PolarHBondContact NH2-O 2.85Å; R197-P253 PolarHBondContact NE-O 3.11Å; R197-Y256 VanDerWaalsContact CA-O 3.32Å; R197-Y256 WeakPolarHBondContact CA-O 3.46Å; R197-Y256 WeakPolarHBondContact CB-O 3.48Å; R197-Y256 WeakPolarHBondContact CG-O 3.38Å
198	Y	94	Very high	85.3	Confident	74 Å²	74	81.2 Å²	81.2	29%	0.29	40%	0.401	S	S	.	.	H	α-helix	trans	-58.4	-51	178.2	-178.6	-87.4	0	0	0	112.2	P194 R200 I201 K202 A224 Y226	P194-Y198 PolarHBondContact O-N 3.1Å; Y198-R200 VanDerWaalsContact C-N 3.34Å; Y198-R200 PolarHBondContact O-N 2.94Å; Y198-I201 WeakPolarHBondContact O-CG2 3.34Å; Y198-I201 PolarHBondContact O-N 3.46Å; Y198-K202 HydrophobicContact CE1-CD 3.78Å; Y198-K202 WeakPolarHBondContact O-CB 3.34Å; Y198-K202 PolarHBondContact O-N 2.89Å; Y198-A224 WeakPolarHBondContact CE2-O 3.45Å; Y198-Y226 HydrophobicContact CD2-CD2 4.33Å; Y198-Y226 AromaticContact CE2-CD2 3.75Å; Y198-Y226 HydrophobicContact CE2-CD2 3.75Å; Y198-Y226 HydrophobicContact CE2-CE2 4.09Å
199	K	94.6	Very high	87.2	Confident	154 Å²	154	78.5 Å²	78.5	67%	0.67	39%	0.386	S	S	*	.	H	α-helix	trans	-60.8	-44	179.7	-75.5	-179.2	178.4	-172.9	0	111.7	K195 V196 H203	K195-K199 WeakPolarHBondContact O-CB 3.32Å; K195-K199 VanDerWaalsContact O-CG 3.3Å; K195-K199 WeakPolarHBondContact O-CG 3.39Å; K195-K199 PolarHBondContact O-N 2.86Å; V196-K199 PolarHBondContact O-N 2.81Å; K199-H203 VanDerWaalsContact O-CB 3.31Å; K199-H203 WeakPolarHBondContact O-CB 3.31Å; K199-H203 PolarHBondContact O-N 2.9Å; K199-H203 VanDerWaalsContact O-N 3.1Å
200	R	96.1	Very high	89.4	Confident	84 Å²	84	74.9 Å²	74.9	32%	0.317	39%	0.386	S	S	.	.	H	α-helix	trans	-62.2	-53.5	-180	179.6	63.4	-179.6	-138.3	-10.1	111.1	V196 R197 Y198 K202 H203 E204 Y256 P257 L291 L293	V196-R200 VanDerWaalsContact O-CB 3.29Å; V196-R200 WeakPolarHBondContact O-CB 3.4Å; V196-R200 PolarHBondContact O-N 3.18Å; R197-R200 PolarHBondContact O-N 3.03Å; Y198-R200 VanDerWaalsContact C-N 3.34Å; Y198-R200 PolarHBondContact O-N 2.94Å; R200-K202 PolarHBondContact O-N 3.47Å; R200-H203 PolarHBondContact O-N 3.3Å; R200-E204 IonicContact CZ-OE1 3.33Å; R200-E204 IonicContact NE-OE1 2.66Å; R200-E204 PolarHBondContact NE-OE1 3.23Å; R200-E204 IonicContact NH2-OE1 3.2Å; R200-E204 PolarHBondContact NH2-OE1 3.17Å; R200-E204 WeakPolarHBondContact O-CG 3.4Å; R200-E204 PolarHBondContact O-N 3.21Å; R200-Y256 HydrophobicContact CG-CD1 4.47Å; R200-Y256 HydrophobicContact CG-CE1 4.03Å; R200-P257 HydrophobicContact CG-CB 4.26Å; R200-P257 HydrophobicContact CG-CG 4.14Å; R200-L291 PolarHBondContact NH2-O 3.1Å; R200-L293 PolarHBondContact NH2-O 3.41Å
201	I	95.7	Very high	91.2	Very high	0 Å²	0	75.5 Å²	75.5	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-69.2	-37.4	-174.5	-164.9	62.3	0	0	0	112.4	R197 Y198 H203 E204 F205 Y226 F229 V252 Y256 L295	R197-I201 WeakPolarHBondContact O-CG2 3.25Å; R197-I201 PolarHBondContact O-N 3.27Å; Y198-I201 WeakPolarHBondContact O-CG2 3.34Å; Y198-I201 PolarHBondContact O-N 3.46Å; I201-H203 VanDerWaalsContact C-N 3.34Å; I201-E204 PolarHBondContact O-N 3.42Å; I201-F205 WeakPolarHBondContact O-CB 3.32Å; I201-F205 PolarHBondContact O-N 3.06Å; I201-Y226 HydrophobicContact CG2-CG 4.31Å; I201-F229 HydrophobicContact CD1-CE2 4.18Å; I201-F229 HydrophobicContact CD1-CZ 4.29Å; I201-F229 HydrophobicContact CG1-CE2 3.8Å; I201-F229 HydrophobicContact CG1-CZ 3.7Å; I201-V252 HydrophobicContact CD1-CG1 4.13Å; I201-V252 HydrophobicContact CD1-CG2 3.88Å; I201-V252 HydrophobicContact CG1-CG1 4.14Å; I201-V252 HydrophobicContact CG1-CG2 4.2Å; I201-Y256 HydrophobicContact CD1-CD1 4.37Å; I201-Y256 HydrophobicContact CD1-CE1 3.99Å; I201-L295 HydrophobicContact CD1-CD1 3.58Å; I201-L295 HydrophobicContact CD1-CD2 4.45Å; I201-L295 HydrophobicContact CD1-CG 3.81Å
202	K	95.3	Very high	92.6	Very high	67 Å²	67	73.4 Å²	73.4	29%	0.291	38%	0.377	S	S	.	.	H	α-helix	trans	-61.3	-46.4	175.7	178.6	177.2	172.1	178.7	0	110.4	Y198 R200 F205 E206 Y226	Y198-K202 HydrophobicContact CE1-CD 3.78Å; Y198-K202 WeakPolarHBondContact O-CB 3.34Å; Y198-K202 PolarHBondContact O-N 2.89Å; R200-K202 PolarHBondContact O-N 3.47Å; K202-F205 PolarHBondContact O-N 3.34Å; K202-E206 WeakPolarHBondContact CE-OE1 3.47Å; K202-E206 HydrophobicContact CG-CG 4.45Å; K202-E206 IonicContact NZ-OE1 3.83Å; K202-E206 WeakPolarHBondContact O-CB 3.38Å; K202-E206 VanDerWaalsContact O-CG 3.31Å; K202-E206 WeakPolarHBondContact O-CG 3.38Å; K202-E206 PolarHBondContact O-N 2.96Å; K202-Y226 HydrophobicContact CB-CD2 4.3Å; K202-Y226 HydrophobicContact CB-CE2 4.15Å; K202-Y226 HydrophobicContact CD-CE2 4.15Å; K202-Y226 HydrophobicContact CG-CE2 4.01Å
203	H	95.8	Very high	93.6	Very high	102 Å²	102	65.6 Å²	65.6	47%	0.472	34%	0.343	S	S	.	.	H	α-helix	trans	-62.7	-44.3	177.1	-178.9	59.2	0	0	0	112.3	K199 R200 I201 F205 E206 N207	K199-H203 VanDerWaalsContact O-CB 3.31Å; K199-H203 WeakPolarHBondContact O-CB 3.31Å; K199-H203 PolarHBondContact O-N 2.9Å; K199-H203 VanDerWaalsContact O-N 3.1Å; R200-H203 PolarHBondContact O-N 3.3Å; I201-H203 VanDerWaalsContact C-N 3.34Å; H203-F205 VanDerWaalsContact C-N 3.34Å; H203-F205 PolarHBondContact O-N 3.27Å; H203-E206 PolarHBondContact O-N 2.94Å; H203-N207 PolarHBondContact CD2-ND2 3.46Å; H203-N207 PolarHBondContact CE1-ND2 2.66Å; H203-N207 VanDerWaalsContact CE1-ND2 3.3Å; H203-N207 PolarHBondContact CE1-OD1 3.46Å; H203-N207 VanDerWaalsContact CE1-OD1 3.31Å; H203-N207 PolarHBondContact NE2-ND2 3.14Å; H203-N207 WeakPolarHBondContact O-CB 3.48Å; H203-N207 PolarHBondContact O-N 3.46Å; H203-N207 PolarHBondContact O-ND2 2.74Å; H203-N207 PolarHBondContact O-OD1 2.78Å
204	E	96.6	Very high	94.3	Very high	10 Å²	10	73.9 Å²	73.9	5%	0.047	37%	0.371	C	S	.	.	H	α-helix	trans	-61	-41.6	175.7	-73.4	-172.9	-162.2	0	0	112.6	R200 I201 N207 L208 Y256 S294 L295	R200-E204 IonicContact CZ-OE1 3.33Å; R200-E204 IonicContact NE-OE1 2.66Å; R200-E204 PolarHBondContact NE-OE1 3.23Å; R200-E204 IonicContact NH2-OE1 3.2Å; R200-E204 PolarHBondContact NH2-OE1 3.17Å; R200-E204 WeakPolarHBondContact O-CG 3.4Å; R200-E204 PolarHBondContact O-N 3.21Å; I201-E204 PolarHBondContact O-N 3.42Å; E204-N207 PolarHBondContact O-N 2.92Å; E204-L208 WeakPolarHBondContact O-CB 3.35Å; E204-L208 WeakPolarHBondContact O-CG 3.27Å; E204-L208 PolarHBondContact O-N 2.97Å; E204-Y256 PolarHBondContact OE1-OH 3.1Å; E204-Y256 PolarHBondContact OE2-OH 3.22Å; E204-Y256 VanDerWaalsContact OE2-OH 3.07Å; E204-S294 VanDerWaalsContact CD-CB 3.47Å; E204-S294 VanDerWaalsContact OE2-CA 3.25Å; E204-S294 WeakPolarHBondContact OE2-CA 3.41Å; E204-S294 WeakPolarHBondContact OE2-CB 2.86Å; E204-L295 PolarHBondContact OE2-N 3.43Å
205	F	96.1	Very high	94.5	Very high	17 Å²	17	71.2 Å²	71.2	8%	0.075	36%	0.356	C	S	.	.	H	α-helix	trans	-66.1	-45.1	176.7	174.7	-103.9	0	0	0	112.1	I201 K202 H203 N207 L208 C209 I218 T220 Y226 F229	I201-F205 WeakPolarHBondContact O-CB 3.32Å; I201-F205 PolarHBondContact O-N 3.06Å; K202-F205 PolarHBondContact O-N 3.34Å; H203-F205 VanDerWaalsContact C-N 3.34Å; H203-F205 PolarHBondContact O-N 3.27Å; F205-N207 VanDerWaalsContact C-N 3.31Å; F205-N207 PolarHBondContact O-N 2.84Å; F205-L208 WeakPolarHBondContact O-CB 3.44Å; F205-L208 PolarHBondContact O-N 3.22Å; F205-C209 WeakPolarHBondContact CZ-SG 3.47Å; F205-C209 PolarHBondContact O-N 2.99Å; F205-C209 PolarHBondContact O-SG 3.29Å; F205-I218 HydrophobicContact CD2-CG2 4.46Å; F205-I218 HydrophobicContact CE2-CG2 4.28Å; F205-T220 HydrophobicContact CE1-CG2 4.12Å; F205-T220 HydrophobicContact CE2-CG2 4.47Å; F205-T220 HydrophobicContact CZ-CG2 3.88Å; F205-Y226 HydrophobicContact CB-CD1 4.49Å; F205-Y226 HydrophobicContact CB-CE1 4.47Å; F205-Y226 HydrophobicContact CD1-CD1 4.26Å; F205-Y226 AromaticContact CD1-CE1 3.56Å; F205-Y226 HydrophobicContact CD1-CE1 3.56Å; F205-Y226 HydrophobicContact CE1-CE1 4.02Å; F205-Y226 HydrophobicContact CG-CD1 4.4Å; F205-Y226 HydrophobicContact CG-CE1 4.14Å; F205-F229 HydrophobicContact CB-CE1 4.01Å; F205-F229 HydrophobicContact CB-CZ 4.47Å; F205-F229 AromaticContact CD2-CD1 3.79Å; F205-F229 HydrophobicContact CD2-CD1 3.79Å; F205-F229 AromaticContact CD2-CE1 3.44Å; F205-F229 HydrophobicContact CD2-CE1 3.44Å; F205-F229 VanDerWaalsContact CD2-CE1 3.44Å; F205-F229 HydrophobicContact CE2-CD1 4.12Å; F205-F229 HydrophobicContact CE2-CE1 4.07Å; F205-F229 AromaticContact CG-CE1 3.8Å; F205-F229 HydrophobicContact CG-CE1 3.8Å
206	E	95.2	Very high	94.7	Very high	90 Å²	90	63.2 Å²	63.2	42%	0.421	32%	0.322	S	S	.	.	H	α-helix	trans	-60	-41.7	176.5	-74.7	171.8	167.9	0	0	111.4	K202 H203 C209 A210	K202-E206 WeakPolarHBondContact CE-OE1 3.47Å; K202-E206 HydrophobicContact CG-CG 4.45Å; K202-E206 IonicContact NZ-OE1 3.83Å; K202-E206 WeakPolarHBondContact O-CB 3.38Å; K202-E206 VanDerWaalsContact O-CG 3.31Å; K202-E206 WeakPolarHBondContact O-CG 3.38Å; K202-E206 PolarHBondContact O-N 2.96Å; H203-E206 PolarHBondContact O-N 2.94Å; E206-C209 PolarHBondContact O-N 3.09Å; E206-A210 WeakPolarHBondContact O-CB 3.44Å; E206-A210 PolarHBondContact O-N 3.38Å
207	N	95	Very high	94.9	Very high	67 Å²	67	63.2 Å²	63.2	36%	0.358	31%	0.314	S	S	.	.	H	α-helix	trans	-63.7	-45.1	175.2	-66.4	-13.8	0	0	0	111.6	H203 E204 F205 C209 A210 D211	H203-N207 PolarHBondContact CD2-ND2 3.46Å; H203-N207 PolarHBondContact CE1-ND2 2.66Å; H203-N207 VanDerWaalsContact CE1-ND2 3.3Å; H203-N207 PolarHBondContact CE1-OD1 3.46Å; H203-N207 VanDerWaalsContact CE1-OD1 3.31Å; H203-N207 PolarHBondContact NE2-ND2 3.14Å; H203-N207 WeakPolarHBondContact O-CB 3.48Å; H203-N207 PolarHBondContact O-N 3.46Å; H203-N207 PolarHBondContact O-ND2 2.74Å; H203-N207 PolarHBondContact O-OD1 2.78Å; E204-N207 PolarHBondContact O-N 2.92Å; F205-N207 VanDerWaalsContact C-N 3.31Å; F205-N207 PolarHBondContact O-N 2.84Å; N207-C209 VanDerWaalsContact C-N 3.29Å; N207-C209 PolarHBondContact O-N 3.15Å; N207-A210 PolarHBondContact O-N 2.98Å; N207-A210 VanDerWaalsContact O-N 3.13Å; N207-D211 PolarHBondContact O-N 2.86Å
208	L	94.6	Very high	95	Very high	2 Å²	2	64 Å²	64	1%	0.01	32%	0.318	C	S	.	.	H	α-helix	trans	-60.2	-36.2	175.7	-89.5	170	0	0	0	113.2	E204 F205 D211 P212 P213 I218 L295 E296	E204-L208 WeakPolarHBondContact O-CB 3.35Å; E204-L208 WeakPolarHBondContact O-CG 3.27Å; E204-L208 PolarHBondContact O-N 2.97Å; F205-L208 WeakPolarHBondContact O-CB 3.44Å; F205-L208 PolarHBondContact O-N 3.22Å; L208-D211 CarbonylContact O-C 3.55Å; L208-P212 VanDerWaalsContact O-CA 3.23Å; L208-P212 WeakPolarHBondContact O-CA 3.26Å; L208-P212 WeakPolarHBondContact O-CB 3.43Å; L208-P213 HydrophobicContact CD2-CG 4.41Å; L208-I218 HydrophobicContact CB-CG2 4.17Å; L208-I218 HydrophobicContact CD1-CD1 4.13Å; L208-L295 HydrophobicContact CD1-CB 3.72Å; L208-E296 HydrophobicContact CD1-CB 4.43Å; L208-E296 HydrophobicContact CD2-CB 3.62Å; L208-E296 HydrophobicContact CD2-CG 3.77Å; L208-E296 HydrophobicContact CG-CB 3.97Å
209	C	93	Very high	95	Very high	51 Å²	51	62.5 Å²	62.5	35%	0.345	32%	0.315	S	S	.	.	H	α-helix	trans	-74.7	-31.8	175.2	-71.2	0	0	0	0	112.5	F205 E206 N207	F205-C209 WeakPolarHBondContact CZ-SG 3.47Å; F205-C209 PolarHBondContact O-N 2.99Å; F205-C209 PolarHBondContact O-SG 3.29Å; E206-C209 PolarHBondContact O-N 3.09Å; N207-C209 VanDerWaalsContact C-N 3.29Å; N207-C209 PolarHBondContact O-N 3.15Å
210	A	94.6	Very high	95	Very high	86 Å²	86	56.4 Å²	56.4	71%	0.711	29%	0.29	S	S	*	.	H	α-helix	trans	-73.7	-38.7	179.1	0	0	0	0	0	112.4	E206 N207	E206-A210 WeakPolarHBondContact O-CB 3.44Å; E206-A210 PolarHBondContact O-N 3.38Å; N207-A210 PolarHBondContact O-N 2.98Å; N207-A210 VanDerWaalsContact O-N 3.13Å
211	D	94.1	Very high	94.7	Very high	126 Å²	126	54.1 Å²	54.1	67%	0.674	28%	0.284	S	S	*	.	S	Bend	trans	-138.3	77	179.2	-168.1	21.9	0	0	0	110.6	N207 L208	N207-D211 PolarHBondContact O-N 2.86Å; L208-D211 CarbonylContact O-C 3.55Å
212	P	93.5	Very high	94.2	Very high	71 Å²	71	55.8 Å²	55.8	46%	0.461	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-70.1	130.4	-179.2	27.1	-33	0	0	0	110.7	L208	L208-P212 VanDerWaalsContact O-CA 3.23Å; L208-P212 WeakPolarHBondContact O-CA 3.26Å; L208-P212 WeakPolarHBondContact O-CB 3.43Å
213	P	94.6	Very high	93.7	Very high	23 Å²	23	57.2 Å²	57.2	15%	0.149	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-57.2	148.3	173	-24.7	33.9	0	0	0	112	L208 G215 I216 E296 I300	L208-P213 HydrophobicContact CD2-CG 4.41Å; P213-G215 PolarHBondContact O-N 2.88Å; P213-I216 HydrophobicContact CB-CB 4.33Å; P213-I216 HydrophobicContact CB-CD1 3.87Å; P213-I216 HydrophobicContact CG-CD1 4.36Å; P213-I216 PolarHBondContact O-N 2.77Å; P213-E296 HydrophobicContact CG-CG 3.87Å; P213-I300 HydrophobicContact CB-CD1 4.33Å; P213-I300 HydrophobicContact CB-CG1 4.08Å; P213-I300 HydrophobicContact CG-CD1 4Å; P213-I300 HydrophobicContact CG-CG1 4.02Å
214	Y	94	Very high	93.3	Very high	192 Å²	192	55.9 Å²	55.9	75%	0.753	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	130.6	-179.7	-179.8	-90.6	0	0	0	111.7	I216	Y214-I216 PolarHBondContact O-N 2.85Å
215	G	94.1	Very high	92.9	Very high	10 Å²	10	56.4 Å²	56.4	10%	0.103	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	3.6	-179.3	0	0	0	0	0	114.8	P213 I233 E234	P213-G215 PolarHBondContact O-N 2.88Å; G215-I233 CarbonylContact O-C 3.58Å; G215-I233 WeakPolarHBondContact O-CA 3.27Å; G215-E234 PolarHBondContact O-N 2.98Å
216	I	96.3	Very high	92.7	Very high	7 Å²	7	56.8 Å²	56.8	4%	0.036	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	128.7	179.4	-67.2	165.5	0	0	0	110.1	P213 Y214 G232 I233 L299 L303	P213-I216 HydrophobicContact CB-CB 4.33Å; P213-I216 HydrophobicContact CB-CD1 3.87Å; P213-I216 HydrophobicContact CG-CD1 4.36Å; P213-I216 PolarHBondContact O-N 2.77Å; Y214-I216 PolarHBondContact O-N 2.85Å; I216-G232 WeakPolarHBondContact CA-O 3.35Å; I216-I233 HydrophobicContact CG1-CG1 4.47Å; I216-L299 HydrophobicContact CD1-CB 3.85Å; I216-L299 HydrophobicContact CG2-CB 4.39Å; I216-L299 HydrophobicContact CG2-CD1 3.91Å; I216-L303 HydrophobicContact CD1-CD2 4.42Å
217	K	95.8	Very high	92.5	Very high	92 Å²	92	53.2 Å²	53.2	40%	0.4	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	145.3	171.2	-67.1	167.8	-179.5	138.5	0	108.4	L153 A231 G232 E234 F245	L153-K217 HydrophobicContact CD2-CB 4.32Å; K217-A231 CarbonylContact O-C 3.58Å; K217-A231 WeakPolarHBondContact O-CA 3.42Å; K217-G232 PolarHBondContact N-O 3.48Å; K217-G232 PolarHBondContact O-N 2.81Å; K217-E234 IonicContact NZ-OE1 3.63Å; K217-E234 PolarHBondContact NZ-OE1 2.89Å; K217-F245 HydrophobicContact CD-CE2 4.17Å; K217-F245 HydrophobicContact CD-CZ 4.2Å
218	I	95.7	Very high	92.3	Very high	19 Å²	19	51.3 Å²	51.3	10%	0.097	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	141.1	176.9	-168.2	170.8	0	0	0	110.8	F205 L208 F229 L230 A231 I250 L295 L299	F205-I218 HydrophobicContact CD2-CG2 4.46Å; F205-I218 HydrophobicContact CE2-CG2 4.28Å; L208-I218 HydrophobicContact CB-CG2 4.17Å; L208-I218 HydrophobicContact CD1-CD1 4.13Å; I218-F229 HydrophobicContact CD1-CB 4.09Å; I218-F229 HydrophobicContact CD1-CD1 4.13Å; I218-F229 HydrophobicContact CD1-CG 4.32Å; I218-F229 HydrophobicContact CG1-CB 4.2Å; I218-F229 HydrophobicContact CG1-CD1 4.36Å; I218-L230 WeakPolarHBondContact CA-O 3.18Å; I218-A231 HydrophobicContact CG1-CB 4.4Å; I218-I250 HydrophobicContact CD1-CD1 4.21Å; I218-L295 HydrophobicContact CD1-CD1 4.41Å; I218-L299 HydrophobicContact CD1-CD1 4.3Å
219	I	95.1	Very high	92.2	Very high	42 Å²	42	51.2 Å²	51.2	22%	0.215	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	151	168.7	58	168.7	0	0	0	109.5	P152 L153 L221 F229 L230	P152-I219 HydrophobicContact CB-CD1 3.93Å; P152-I219 HydrophobicContact CG-CD1 3.48Å; P152-I219 VanDerWaalsContact CG-CD1 3.48Å; L153-I219 HydrophobicContact CD2-CB 4.47Å; L153-I219 HydrophobicContact CD2-CD1 4.28Å; L153-I219 HydrophobicContact CD2-CG1 4.08Å; L153-I219 HydrophobicContact CD2-CG2 3.73Å; L153-I219 HydrophobicContact CG-CD1 4.23Å; L153-I219 HydrophobicContact CG-CG1 4.19Å; I219-L221 HydrophobicContact CD1-CD2 4.05Å; I219-L221 HydrophobicContact CG1-CD2 4.48Å; I219-F229 VanDerWaalsContact O-CA 3.31Å; I219-F229 WeakPolarHBondContact O-CA 3.49Å; I219-F229 WeakPolarHBondContact O-CB 3.42Å; I219-L230 HydrophobicContact CD1-CB 4.3Å; I219-L230 HydrophobicContact CD1-CD2 4.28Å; I219-L230 HydrophobicContact CG1-CB 3.88Å; I219-L230 PolarHBondContact N-O 2.94Å; I219-L230 PolarHBondContact O-N 3.13Å
220	T	93.1	Very high	92.4	Very high	26 Å²	26	48.8 Å²	48.8	16%	0.16	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	135.8	166.4	-175.2	0	0	0	0	109.8	F205 D222 T223 Y226 H228	F205-T220 HydrophobicContact CE1-CG2 4.12Å; F205-T220 HydrophobicContact CE2-CG2 4.47Å; F205-T220 HydrophobicContact CZ-CG2 3.88Å; T220-D222 PolarHBondContact OG1-N 3.35Å; T220-D222 PolarHBondContact OG1-O 2.95Å; T220-T223 HydrophobicContact CG2-CG2 3.62Å; T220-Y226 HydrophobicContact CG2-CE1 4.23Å; T220-H228 PolarHBondContact OG1-O 2.91Å
221	L	89.7	Confident	92.5	Very high	36 Å²	36	44.7 Å²	44.7	19%	0.188	24%	0.243	C	C	.	.	S	Bend	trans	-91.4	-10.7	175.6	-56.3	169.6	0	0	0	111.4	L183 I219 H228 L230	L183-L221 HydrophobicContact CB-CD1 4.19Å; L183-L221 HydrophobicContact CD2-CD1 3.57Å; L183-L221 HydrophobicContact CG-CD1 4.5Å; L183-L221 VanDerWaalsContact O-CD1 3.3Å; L183-L221 WeakPolarHBondContact O-CD1 3.32Å; I219-L221 HydrophobicContact CD1-CD2 4.05Å; I219-L221 HydrophobicContact CG1-CD2 4.48Å; L221-H228 HydrophobicContact CB-CB 3.93Å; L221-H228 HydrophobicContact CD1-CB 4.26Å; L221-H228 PolarHBondContact N-O 3.38Å; L221-L230 HydrophobicContact CD1-CB 4.17Å; L221-L230 HydrophobicContact CD2-CB 4.24Å; L221-L230 HydrophobicContact CG-CB 4.33Å
222	D	85.6	Confident	92.6	Very high	35 Å²	35	38.7 Å²	38.7	19%	0.187	21%	0.21	C	C	.	.			trans	-147.2	107.5	178.3	170.7	12.1	0	0	0	110.4	T220 A224 T225 Y226	T220-D222 PolarHBondContact OG1-N 3.35Å; T220-D222 PolarHBondContact OG1-O 2.95Å; D222-A224 WeakPolarHBondContact OD1-CA 3.45Å; D222-A224 VanDerWaalsContact OD1-CB 3.29Å; D222-A224 WeakPolarHBondContact OD1-CB 3.34Å; D222-A224 PolarHBondContact OD1-N 2.8Å; D222-T225 PolarHBondContact OD1-N 2.83Å; D222-T225 VanDerWaalsContact OD1-N 3.1Å; D222-T225 WeakPolarHBondContact OD2-CB 3.15Å; D222-T225 PolarHBondContact OD2-N 2.78Å; D222-T225 PolarHBondContact OD2-OG1 2.78Å; D222-Y226 VanDerWaalsContact O-CA 3.24Å; D222-Y226 WeakPolarHBondContact O-CA 3.42Å; D222-Y226 PolarHBondContact O-N 3.31Å
223	T	86	Confident	92.8	Very high	98 Å²	98	35.3 Å²	35.3	60%	0.601	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-15	178	52.6	0	0	0	0	113.8	T220 Y226	T220-T223 HydrophobicContact CG2-CG2 3.62Å; T223-Y226 WeakPolarHBondContact O-CE2 3.48Å
224	A	86.7	Confident	92.9	Very high	73 Å²	73	37.6 Å²	37.6	60%	0.603	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-44	178.8	0	0	0	0	0	110.7	Y198 D222	Y198-A224 WeakPolarHBondContact CE2-O 3.45Å; D222-A224 WeakPolarHBondContact OD1-CA 3.45Å; D222-A224 VanDerWaalsContact OD1-CB 3.29Å; D222-A224 WeakPolarHBondContact OD1-CB 3.34Å; D222-A224 PolarHBondContact OD1-N 2.8Å
225	T	88	Confident	93.1	Very high	21 Å²	21	29 Å²	29	13%	0.129	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.7	-18.3	-179.5	79.7	0	0	0	0	114.4	R197 D222 S227	R197-T225 PolarHBondContact NH1-O 3.36Å; D222-T225 PolarHBondContact OD1-N 2.83Å; D222-T225 VanDerWaalsContact OD1-N 3.1Å; D222-T225 WeakPolarHBondContact OD2-CB 3.15Å; D222-T225 PolarHBondContact OD2-N 2.78Å; D222-T225 PolarHBondContact OD2-OG1 2.78Å; T225-S227 VanDerWaalsContact C-N 3.27Å; T225-S227 WeakPolarHBondContact CB-OG 3.23Å; T225-S227 PolarHBondContact O-N 3.43Å; T225-S227 VanDerWaalsContact OG1-CB 3.25Å; T225-S227 WeakPolarHBondContact OG1-CB 3.39Å; T225-S227 PolarHBondContact OG1-N 2.98Å; T225-S227 PolarHBondContact OG1-OG 2.9Å
226	Y	91.7	Very high	93.2	Very high	25 Å²	25	29 Å²	29	10%	0.098	17%	0.165	C	C	.	.			trans	55.5	40.5	-170.7	-69.4	-85.8	0	0	0	112.5	R197 Y198 I201 K202 F205 T220 D222 T223 F229	R197-Y226 PolarHBondContact NH1-O 3.31Å; R197-Y226 PolarHBondContact NH2-O 2.86Å; Y198-Y226 HydrophobicContact CD2-CD2 4.33Å; Y198-Y226 AromaticContact CE2-CD2 3.75Å; Y198-Y226 HydrophobicContact CE2-CD2 3.75Å; Y198-Y226 HydrophobicContact CE2-CE2 4.09Å; I201-Y226 HydrophobicContact CG2-CG 4.31Å; K202-Y226 HydrophobicContact CB-CD2 4.3Å; K202-Y226 HydrophobicContact CB-CE2 4.15Å; K202-Y226 HydrophobicContact CD-CE2 4.15Å; K202-Y226 HydrophobicContact CG-CE2 4.01Å; F205-Y226 HydrophobicContact CB-CD1 4.49Å; F205-Y226 HydrophobicContact CB-CE1 4.47Å; F205-Y226 HydrophobicContact CD1-CD1 4.26Å; F205-Y226 AromaticContact CD1-CE1 3.56Å; F205-Y226 HydrophobicContact CD1-CE1 3.56Å; F205-Y226 HydrophobicContact CE1-CE1 4.02Å; F205-Y226 HydrophobicContact CG-CD1 4.4Å; F205-Y226 HydrophobicContact CG-CE1 4.14Å; T220-Y226 HydrophobicContact CG2-CE1 4.23Å; D222-Y226 VanDerWaalsContact O-CA 3.24Å; D222-Y226 WeakPolarHBondContact O-CA 3.42Å; D222-Y226 PolarHBondContact O-N 3.31Å; T223-Y226 WeakPolarHBondContact O-CE2 3.48Å; Y226-F229 AromaticContact CD1-CE1 3.91Å; Y226-F229 HydrophobicContact CD1-CE1 3.91Å; Y226-F229 AromaticContact CD1-CZ 3.81Å; Y226-F229 HydrophobicContact CD1-CZ 3.81Å; Y226-F229 HydrophobicContact CG-CZ 4.33Å; Y226-F229 WeakPolarHBondContact O-CE2 3.38Å
227	S	90.6	Very high	93.2	Very high	16 Å²	16	32.6 Å²	32.6	11%	0.112	19%	0.189	C	C	.	.			trans	-93.9	-21.5	179.9	-60.1	0	0	0	0	114.4	R197 T225 L251 V252	R197-S227 VanDerWaalsContact NH2-CA 3.26Å; R197-S227 PolarHBondContact NH2-OG 3.31Å; R197-S227 VanDerWaalsContact NH2-OG 3.07Å; T225-S227 VanDerWaalsContact C-N 3.27Å; T225-S227 WeakPolarHBondContact CB-OG 3.23Å; T225-S227 PolarHBondContact O-N 3.43Å; T225-S227 VanDerWaalsContact OG1-CB 3.25Å; T225-S227 WeakPolarHBondContact OG1-CB 3.39Å; T225-S227 PolarHBondContact OG1-N 2.98Å; T225-S227 PolarHBondContact OG1-OG 2.9Å; S227-L251 WeakPolarHBondContact O-CA 3.37Å; S227-V252 PolarHBondContact O-N 3.44Å
228	H	90.8	Very high	93.1	Very high	26 Å²	26	37.5 Å²	37.5	12%	0.12	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	125.4	-173.6	-60.2	76.2	0	0	0	109.2	V187 T220 L221 L251	V187-H228 WeakPolarHBondContact CG2-CE1 3.43Å; V187-H228 WeakPolarHBondContact CG2-NE2 3.36Å; T220-H228 PolarHBondContact OG1-O 2.91Å; L221-H228 HydrophobicContact CB-CB 3.93Å; L221-H228 HydrophobicContact CD1-CB 4.26Å; L221-H228 PolarHBondContact N-O 3.38Å; H228-L251 WeakPolarHBondContact CD2-CD2 3.48Å
229	F	94.2	Very high	93.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	148.7	172.7	-54.6	-98	0	0	0	110.1	I201 F205 I218 I219 Y226 I250 V252 L295	I201-F229 HydrophobicContact CD1-CE2 4.18Å; I201-F229 HydrophobicContact CD1-CZ 4.29Å; I201-F229 HydrophobicContact CG1-CE2 3.8Å; I201-F229 HydrophobicContact CG1-CZ 3.7Å; F205-F229 HydrophobicContact CB-CE1 4.01Å; F205-F229 HydrophobicContact CB-CZ 4.47Å; F205-F229 AromaticContact CD2-CD1 3.79Å; F205-F229 HydrophobicContact CD2-CD1 3.79Å; F205-F229 AromaticContact CD2-CE1 3.44Å; F205-F229 HydrophobicContact CD2-CE1 3.44Å; F205-F229 VanDerWaalsContact CD2-CE1 3.44Å; F205-F229 HydrophobicContact CE2-CD1 4.12Å; F205-F229 HydrophobicContact CE2-CE1 4.07Å; F205-F229 AromaticContact CG-CE1 3.8Å; F205-F229 HydrophobicContact CG-CE1 3.8Å; I218-F229 HydrophobicContact CD1-CB 4.09Å; I218-F229 HydrophobicContact CD1-CD1 4.13Å; I218-F229 HydrophobicContact CD1-CG 4.32Å; I218-F229 HydrophobicContact CG1-CB 4.2Å; I218-F229 HydrophobicContact CG1-CD1 4.36Å; I219-F229 VanDerWaalsContact O-CA 3.31Å; I219-F229 WeakPolarHBondContact O-CA 3.49Å; I219-F229 WeakPolarHBondContact O-CB 3.42Å; Y226-F229 AromaticContact CD1-CE1 3.91Å; Y226-F229 HydrophobicContact CD1-CE1 3.91Å; Y226-F229 AromaticContact CD1-CZ 3.81Å; Y226-F229 HydrophobicContact CD1-CZ 3.81Å; Y226-F229 HydrophobicContact CG-CZ 4.33Å; Y226-F229 WeakPolarHBondContact O-CE2 3.38Å; F229-I250 HydrophobicContact CB-CB 4.16Å; F229-I250 HydrophobicContact CB-CD1 4.49Å; F229-I250 PolarHBondContact N-O 2.96Å; F229-I250 PolarHBondContact O-N 3.24Å; F229-V252 HydrophobicContact CD2-CG2 3.93Å; F229-V252 HydrophobicContact CE2-CG2 3.66Å; F229-L295 HydrophobicContact CD2-CD1 4.31Å; F229-L295 HydrophobicContact CE2-CD1 4.29Å
230	L	95.6	Very high	93.2	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	120.8	167.1	-175.9	66.7	0	0	0	107.2	P152 L153 L183 I218 I219 L221 H247 L266	P152-L230 HydrophobicContact CG-CD2 3.78Å; L153-L230 HydrophobicContact CD1-CB 4.47Å; L153-L230 HydrophobicContact CD1-CD2 4.16Å; L153-L230 HydrophobicContact CD1-CG 3.88Å; L153-L230 HydrophobicContact CG-CD2 4.13Å; L153-L230 HydrophobicContact CG-CG 4.38Å; L183-L230 HydrophobicContact CD2-CD1 4.29Å; I218-L230 WeakPolarHBondContact CA-O 3.18Å; I219-L230 HydrophobicContact CD1-CB 4.3Å; I219-L230 HydrophobicContact CD1-CD2 4.28Å; I219-L230 HydrophobicContact CG1-CB 3.88Å; I219-L230 PolarHBondContact N-O 2.94Å; I219-L230 PolarHBondContact O-N 3.13Å; L221-L230 HydrophobicContact CD1-CB 4.17Å; L221-L230 HydrophobicContact CD2-CB 4.24Å; L221-L230 HydrophobicContact CG-CB 4.33Å; L230-H247 HydrophobicContact CD1-CB 4.28Å; L230-L266 HydrophobicContact CD1-CD1 3.75Å
231	A	96.8	Very high	93.5	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	150	169.9	0	0	0	0	0	110.1	L153 K217 I218 H247 V248 I250 L299	L153-A231 VanDerWaalsContact CD1-C 3.5Å; K217-A231 CarbonylContact O-C 3.58Å; K217-A231 WeakPolarHBondContact O-CA 3.42Å; I218-A231 HydrophobicContact CG1-CB 4.4Å; A231-H247 CarbonylContact O-C 3.6Å; A231-H247 WeakPolarHBondContact O-CA 3.42Å; A231-V248 HydrophobicContact CB-CB 4.34Å; A231-V248 PolarHBondContact N-O 3.2Å; A231-V248 PolarHBondContact O-N 3.07Å; A231-I250 HydrophobicContact CB-CD1 4.11Å; A231-L299 HydrophobicContact CB-CD1 4.33Å; A231-L299 HydrophobicContact CB-CD2 3.86Å
232	G	97.3	Very high	93.8	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	125.2	170.5	0	0	0	0	0	108.4	L153 I216 K217 F246	L153-G232 VanDerWaalsContact CD1-N 3.34Å; I216-G232 WeakPolarHBondContact CA-O 3.35Å; K217-G232 PolarHBondContact N-O 3.48Å; K217-G232 PolarHBondContact O-N 2.81Å; G232-F246 CarbonylContact C-O 3.49Å; G232-F246 WeakPolarHBondContact CA-O 3.43Å
233	I	97.5	Very high	94.3	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	119.1	-179.3	-56.1	-178.6	0	0	0	108.2	G215 I216 F246 V248 L299 I302 L303 L306	G215-I233 CarbonylContact O-C 3.58Å; G215-I233 WeakPolarHBondContact O-CA 3.27Å; I216-I233 HydrophobicContact CG1-CG1 4.47Å; I233-F246 PolarHBondContact N-O 3.29Å; I233-F246 WeakPolarHBondContact O-CD2 3.4Å; I233-F246 PolarHBondContact O-N 3.35Å; I233-V248 HydrophobicContact CD1-CG2 3.9Å; I233-V248 HydrophobicContact CG1-CG2 4.26Å; I233-L299 HydrophobicContact CD1-CD2 4.1Å; I233-I302 HydrophobicContact CD1-CB 4.3Å; I233-I302 HydrophobicContact CD1-CG2 3.65Å; I233-L303 HydrophobicContact CG2-CD1 3.89Å; I233-L306 HydrophobicContact CG2-CD1 4.24Å
234	E	97.1	Very high	94.8	Very high	71 Å²	71	33.7 Å²	33.7	33%	0.332	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	129.3	170.5	-67.9	173.4	-165.9	0	0	109	G215 K217 G244 F245	G215-E234 PolarHBondContact O-N 2.98Å; K217-E234 IonicContact NZ-OE1 3.63Å; K217-E234 PolarHBondContact NZ-OE1 2.89Å; E234-G244 CarbonylContact C-O 3.6Å; E234-G244 WeakPolarHBondContact CA-O 3.19Å; E234-F245 HydrophobicContact CG-CD2 3.77Å; E234-F245 HydrophobicContact CG-CE2 4.13Å
235	G	97.3	Very high	95.3	Very high	10 Å²	10	31.1 Å²	31.1	10%	0.103	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-63.8	131.7	-178.8	0	0	0	0	0	111.4	Y241 G244	G235-Y241 WeakPolarHBondContact CA-O 3.5Å; G235-G244 PolarHBondContact N-O 3Å
236	P	96.8	Very high	95.8	Very high	11 Å²	11	30.1 Å²	30.1	7%	0.071	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-66.6	149	-169.9	21.7	-28.6	0	0	0	112	S239 L303 L306 T307	P236-S239 WeakPolarHBondContact O-CB 3.47Å; P236-S239 PolarHBondContact O-N 3.35Å; P236-S239 PolarHBondContact O-OG 3.34Å; P236-L303 HydrophobicContact CB-CD1 4.11Å; P236-L303 HydrophobicContact CG-CD1 4.08Å; P236-L306 HydrophobicContact CG-CB 3.79Å; P236-T307 HydrophobicContact CB-CG2 3.56Å; P236-T307 HydrophobicContact CG-CG2 3.44Å; P236-T307 VanDerWaalsContact CG-CG2 3.44Å
237	P	95.5	Very high	96.1	Very high	83 Å²	83	29.2 Å²	29.2	54%	0.539	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	151.9	176	29.1	-35.2	0	0	0	110.7	S239	P237-S239 PolarHBondContact O-N 3.21Å
238	Q	94	Very high	96.4	Very high	194 Å²	194	28.4 Å²	28.4	91%	0.907	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.2	17	-179.3	-52.7	175.4	-10.9	0	0	114.4
239	S	96.2	Very high	96.6	Very high	14 Å²	14	27.6 Å²	27.6	10%	0.098	15%	0.152	C	C	.	.	S	Bend	trans	-110.2	161.3	170.3	80.5	0	0	0	0	110.2	P236 P237 Y241 Q242	P236-S239 WeakPolarHBondContact O-CB 3.47Å; P236-S239 PolarHBondContact O-N 3.35Å; P236-S239 PolarHBondContact O-OG 3.34Å; P237-S239 PolarHBondContact O-N 3.21Å; S239-Y241 PolarHBondContact O-N 3.36Å; S239-Y241 VanDerWaalsContact O-N 3.1Å; S239-Y241 PolarHBondContact OG-N 2.91Å; S239-Y241 VanDerWaalsContact OG-N 3.14Å; S239-Q242 WeakPolarHBondContact O-CB 3.26Å; S239-Q242 PolarHBondContact O-N 3.37Å; S239-Q242 PolarHBondContact OG-N 2.84Å
240	P	97.6	Very high	96.6	Very high	19 Å²	19	27.6 Å²	27.6	12%	0.123	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-12.6	171.2	27.6	-35.1	0	0	0	113.2	A334 K335 T338	P240-A334 HydrophobicContact CB-CB 3.7Å; P240-A334 HydrophobicContact CG-CB 3.97Å; P240-K335 HydrophobicContact CB-CG 3.68Å; P240-K335 WeakPolarHBondContact O-CA 3.25Å; P240-K335 WeakPolarHBondContact O-CG 3.44Å; P240-T338 PolarHBondContact O-OG1 3.25Å
241	Y	98.2	Very high	96.5	Very high	2 Å²	2	30 Å²	30	1%	0.008	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-4.6	-178.7	-48.6	-65.7	0	0	0	113.4	G235 S239 G243 G244 F246 I269 L270 H271 L306 A334 T338	G235-Y241 WeakPolarHBondContact CA-O 3.5Å; S239-Y241 PolarHBondContact O-N 3.36Å; S239-Y241 VanDerWaalsContact O-N 3.1Å; S239-Y241 PolarHBondContact OG-N 2.91Å; S239-Y241 VanDerWaalsContact OG-N 3.14Å; Y241-G243 PolarHBondContact O-N 3.34Å; Y241-G244 PolarHBondContact O-N 3.01Å; Y241-F246 HydrophobicContact CD1-CZ 4.05Å; Y241-F246 HydrophobicContact CG-CZ 4.4Å; Y241-I269 HydrophobicContact CD1-CD1 3.73Å; Y241-I269 HydrophobicContact CD1-CG1 3.91Å; Y241-I269 HydrophobicContact CE1-CD1 3.75Å; Y241-I269 HydrophobicContact CE1-CG1 3.66Å; Y241-I269 HydrophobicContact CG-CD1 4.38Å; Y241-L270 VanDerWaalsContact CE1-O 3.32Å; Y241-L270 WeakPolarHBondContact CE1-O 3.31Å; Y241-L270 PolarHBondContact OH-O 3.46Å; Y241-H271 AromaticContact CE2-CD2 3.69Å; Y241-H271 AromaticContact CZ-CD2 3.57Å; Y241-H271 PolarHBondContact OH-CD2 3.3Å; Y241-L306 HydrophobicContact CD2-CB 3.85Å; Y241-L306 HydrophobicContact CD2-CD2 4.17Å; Y241-L306 HydrophobicContact CD2-CG 4.49Å; Y241-L306 WeakPolarHBondContact CD2-O 3.48Å; Y241-L306 HydrophobicContact CE2-CB 4.31Å; Y241-L306 HydrophobicContact CE2-CD2 4.26Å; Y241-L306 WeakPolarHBondContact CE2-O 3.38Å; Y241-L306 HydrophobicContact CG-CD2 4.49Å; Y241-A334 HydrophobicContact CE1-CB 4.16Å; Y241-T338 WeakPolarHBondContact CD1-OG1 3.47Å; Y241-T338 WeakPolarHBondContact O-CG2 3.45Å
242	Q	97	Very high	96.3	Very high	108 Å²	108	30.4 Å²	30.4	51%	0.505	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	129.9	-177.1	-179.6	175.8	-27.9	0	0	112.1	S239 G244	S239-Q242 WeakPolarHBondContact O-CB 3.26Å; S239-Q242 PolarHBondContact O-N 3.37Å; S239-Q242 PolarHBondContact OG-N 2.84Å; Q242-G244 VanDerWaalsContact C-N 3.29Å
243	G	95	Very high	96.1	Very high	32 Å²	32	32.3 Å²	32.3	33%	0.33	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.4	-6	-180	0	0	0	0	0	114.7	Y241 C343	Y241-G243 PolarHBondContact O-N 3.34Å; G243-C343 PolarHBondContact O-SG 3.17Å
244	G	97.4	Very high	95.8	Very high	2 Å²	2	35.7 Å²	35.7	2%	0.021	20%	0.198	C	C	.	.			trans	-79.9	148.4	171.3	0	0	0	0	0	112.6	E234 G235 Y241 Q242	E234-G244 CarbonylContact C-O 3.6Å; E234-G244 WeakPolarHBondContact CA-O 3.19Å; G235-G244 PolarHBondContact N-O 3Å; Y241-G244 PolarHBondContact O-N 3.01Å; Q242-G244 VanDerWaalsContact C-N 3.29Å
245	F	97.8	Very high	95.6	Very high	18 Å²	18	34.1 Å²	34.1	8%	0.079	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	107.2	170.9	-169.7	-109.8	0	0	0	110.6	L153 K217 E234 H247 A342	L153-F245 HydrophobicContact CB-CE1 3.94Å; L153-F245 HydrophobicContact CB-CZ 4.07Å; K217-F245 HydrophobicContact CD-CE2 4.17Å; K217-F245 HydrophobicContact CD-CZ 4.2Å; E234-F245 HydrophobicContact CG-CD2 3.77Å; E234-F245 HydrophobicContact CG-CE2 4.13Å; F245-H247 AromaticContact CD1-CE1 3.57Å; F245-H247 AromaticContact CE1-CE1 3.7Å; F245-H247 AromaticContact CE1-NE2 3.67Å; F245-A342 PolarHBondContact N-O 3.48Å
246	F	98.3	Very high	95.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	119.5	-173.3	-57.9	-84.2	0	0	0	111.2	G232 I233 Y241 F265 T267 I269 T338 A342	G232-F246 CarbonylContact C-O 3.49Å; G232-F246 WeakPolarHBondContact CA-O 3.43Å; I233-F246 PolarHBondContact N-O 3.29Å; I233-F246 WeakPolarHBondContact O-CD2 3.4Å; I233-F246 PolarHBondContact O-N 3.35Å; Y241-F246 HydrophobicContact CD1-CZ 4.05Å; Y241-F246 HydrophobicContact CG-CZ 4.4Å; F246-F265 HydrophobicContact CB-CD1 4.04Å; F246-F265 HydrophobicContact CB-CE1 3.72Å; F246-F265 HydrophobicContact CD1-CD1 4.41Å; F246-F265 HydrophobicContact CD1-CE1 4.3Å; F246-F265 HydrophobicContact CG-CE1 4.09Å; F246-T267 HydrophobicContact CD1-CG2 3.86Å; F246-T267 HydrophobicContact CE1-CG2 4.45Å; F246-I269 HydrophobicContact CD1-CB 4.15Å; F246-I269 HydrophobicContact CD1-CD1 3.94Å; F246-I269 HydrophobicContact CD1-CG1 4.31Å; F246-I269 HydrophobicContact CE1-CB 3.88Å; F246-I269 HydrophobicContact CE1-CD1 3.57Å; F246-I269 HydrophobicContact CE1-CG1 3.72Å; F246-I269 HydrophobicContact CE2-CD1 4.44Å; F246-I269 HydrophobicContact CZ-CD1 3.85Å; F246-I269 HydrophobicContact CZ-CG1 4.25Å; F246-T338 HydrophobicContact CZ-CG2 4.01Å; F246-A342 HydrophobicContact CD1-CB 3.92Å; F246-A342 HydrophobicContact CE1-CB 3.53Å; F246-A342 HydrophobicContact CE2-CB 4.39Å; F246-A342 HydrophobicContact CZ-CB 3.8Å
247	H	97.6	Very high	95.3	Very high	6 Å²	6	33.7 Å²	33.7	3%	0.028	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	131.3	173.6	-67.6	82.6	0	0	0	110.1	W151 L230 A231 F245 L266 T267	W151-H247 AromaticContact CD1-CD2 3.99Å; W151-H247 AromaticContact CD1-CE1 3.7Å; W151-H247 AromaticContact CD1-ND1 3.87Å; W151-H247 AromaticContact CD1-NE2 3.76Å; L230-H247 HydrophobicContact CD1-CB 4.28Å; A231-H247 CarbonylContact O-C 3.6Å; A231-H247 WeakPolarHBondContact O-CA 3.42Å; F245-H247 AromaticContact CD1-CE1 3.57Å; F245-H247 AromaticContact CE1-CE1 3.7Å; F245-H247 AromaticContact CE1-NE2 3.67Å; H247-L266 HydrophobicContact CB-CB 4.12Å; H247-L266 PolarHBondContact O-N 3.46Å; H247-T267 PolarHBondContact N-OG1 3.19Å; H247-T267 PolarHBondContact O-N 2.92Å
248	V	97	Very high	95.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	120.9	-176.6	-179.2	0	0	0	0	109.5	A231 I233 I263 R264 F265	A231-V248 HydrophobicContact CB-CB 4.34Å; A231-V248 PolarHBondContact N-O 3.2Å; A231-V248 PolarHBondContact O-N 3.07Å; I233-V248 HydrophobicContact CD1-CG2 3.9Å; I233-V248 HydrophobicContact CG1-CG2 4.26Å; V248-I263 HydrophobicContact CG1-CG2 3.33Å; V248-R264 CarbonylContact C-O 3.6Å; V248-R264 WeakPolarHBondContact CA-O 3.34Å; V248-F265 HydrophobicContact CG2-CD1 4.03Å; V248-F265 HydrophobicContact CG2-CD2 4.16Å; V248-F265 HydrophobicContact CG2-CE1 3.96Å; V248-F265 HydrophobicContact CG2-CE2 4.07Å; V248-F265 HydrophobicContact CG2-CG 4.13Å; V248-F265 HydrophobicContact CG2-CZ 3.97Å
249	L	95.1	Very high	95.2	Very high	8 Å²	8	35.2 Å²	35.2	4%	0.042	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	131.6	172.5	177	58.2	0	0	0	109.9	C179 L183 L251 I263 R264 L266	C179-L249 HydrophobicContact CB-CD2 4.18Å; L183-L249 HydrophobicContact CD2-CD1 3.74Å; L249-L251 HydrophobicContact CD1-CD2 3.88Å; L249-L251 HydrophobicContact CD1-CG 4.46Å; L249-L251 HydrophobicContact CD2-CD1 4.49Å; L249-L251 HydrophobicContact CD2-CD2 4.24Å; L249-L251 HydrophobicContact CD2-CG 4.35Å; L249-L251 HydrophobicContact CG-CD2 4.08Å; L249-L251 HydrophobicContact CG-CG 4.16Å; L249-I263 WeakPolarHBondContact O-CA 3.48Å; L249-R264 PolarHBondContact N-O 3.21Å; L249-R264 PolarHBondContact O-N 3.47Å; L249-L266 HydrophobicContact CB-CD1 4.12Å; L249-L266 HydrophobicContact CB-CD2 4Å; L249-L266 HydrophobicContact CB-CG 3.97Å; L249-L266 HydrophobicContact CD2-CD2 4.39Å
250	I	94.6	Very high	95.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	121.5	173.3	-50.9	171.3	0	0	0	108.4	I218 F229 A231 V252 P261 V262 I263 L295 L299	I218-I250 HydrophobicContact CD1-CD1 4.21Å; F229-I250 HydrophobicContact CB-CB 4.16Å; F229-I250 HydrophobicContact CB-CD1 4.49Å; F229-I250 PolarHBondContact N-O 2.96Å; F229-I250 PolarHBondContact O-N 3.24Å; A231-I250 HydrophobicContact CB-CD1 4.11Å; I250-V252 HydrophobicContact CG2-CG2 4.23Å; I250-P261 HydrophobicContact CG2-CB 3.94Å; I250-P261 HydrophobicContact CG2-CG 4.49Å; I250-V262 WeakPolarHBondContact CA-O 3.3Å; I250-I263 HydrophobicContact CG2-CG1 4.49Å; I250-L295 HydrophobicContact CG2-CD2 3.86Å; I250-L299 HydrophobicContact CD1-CD1 4.34Å; I250-L299 HydrophobicContact CD1-CD2 4.13Å; I250-L299 HydrophobicContact CD1-CG 4.46Å
251	L	93	Very high	95.1	Very high	53 Å²	53	35.3 Å²	35.3	28%	0.277	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	121	174.7	-54.5	174.5	0	0	0	109.2	S227 H228 L249 P261 V262	S227-L251 WeakPolarHBondContact O-CA 3.37Å; H228-L251 WeakPolarHBondContact CD2-CD2 3.48Å; L249-L251 HydrophobicContact CD1-CD2 3.88Å; L249-L251 HydrophobicContact CD1-CG 4.46Å; L249-L251 HydrophobicContact CD2-CD1 4.49Å; L249-L251 HydrophobicContact CD2-CD2 4.24Å; L249-L251 HydrophobicContact CD2-CG 4.35Å; L249-L251 HydrophobicContact CG-CD2 4.08Å; L249-L251 HydrophobicContact CG-CG 4.16Å; L251-P261 CarbonylContact O-C 3.3Å; L251-P261 WeakPolarHBondContact O-CA 3.46Å; L251-P261 WeakPolarHBondContact O-CB 3.45Å; L251-V262 HydrophobicContact CB-CB 4.22Å; L251-V262 PolarHBondContact N-O 2.76Å; L251-V262 PolarHBondContact O-N 2.73Å
252	V	93.1	Very high	94.9	Very high	7 Å²	7	38.6 Å²	38.6	4%	0.042	20%	0.201	C	C	.	.			trans	-102.1	110.4	-177.3	-179.2	0	0	0	0	109.3	R197 I201 S227 F229 I250 Y256 P261	R197-V252 VanDerWaalsContact NH2-CG1 3.34Å; R197-V252 PolarHBondContact NH2-O 2.85Å; I201-V252 HydrophobicContact CD1-CG1 4.13Å; I201-V252 HydrophobicContact CD1-CG2 3.88Å; I201-V252 HydrophobicContact CG1-CG1 4.14Å; I201-V252 HydrophobicContact CG1-CG2 4.2Å; S227-V252 PolarHBondContact O-N 3.44Å; F229-V252 HydrophobicContact CD2-CG2 3.93Å; F229-V252 HydrophobicContact CE2-CG2 3.66Å; I250-V252 HydrophobicContact CG2-CG2 4.23Å; V252-Y256 HydrophobicContact CG1-CD1 3.91Å; V252-Y256 HydrophobicContact CG1-CD2 4.09Å; V252-Y256 HydrophobicContact CG1-CG 3.57Å; V252-P261 HydrophobicContact CG2-CB 4.3Å
253	P	92.3	Very high	94.8	Very high	41 Å²	41	33.9 Å²	33.9	27%	0.266	18%	0.179	S	C	.	.			trans	-69	164.2	-177.7	30.8	-36.5	0	0	0	111.8	R197 S255 Y256 R259 P260	R197-P253 PolarHBondContact NE-O 3.11Å; P253-S255 PolarHBondContact O-N 3.28Å; P253-Y256 VanDerWaalsContact O-CB 3.28Å; P253-Y256 WeakPolarHBondContact O-CB 3.16Å; P253-Y256 PolarHBondContact O-N 2.98Å; P253-Y256 VanDerWaalsContact O-N 3.12Å; P253-R259 HydrophobicContact CG-CB 4.47Å; P253-P260 WeakPolarHBondContact CG-O 3.29Å
254	D	90.9	Very high	94.8	Very high	71 Å²	71	35.5 Å²	35.5	38%	0.38	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-25.5	175.7	-64.5	-30.1	0	0	0	113	P194 Y256	P194-D254 WeakPolarHBondContact CG-O 3.26Å; D254-Y256 VanDerWaalsContact C-N 3.29Å; D254-Y256 PolarHBondContact O-N 2.97Å
255	S	92.7	Very high	94.9	Very high	37 Å²	37	35.4 Å²	35.4	26%	0.259	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	0.2	178.4	48.4	0	0	0	0	114	P253 F258 R259	P253-S255 PolarHBondContact O-N 3.28Å; S255-F258 WeakPolarHBondContact O-CA 3.47Å; S255-F258 VanDerWaalsContact O-CB 3.28Å; S255-F258 WeakPolarHBondContact O-CB 3.39Å; S255-F258 PolarHBondContact O-N 3.26Å; S255-R259 PolarHBondContact O-N 2.74Å; S255-R259 WeakPolarHBondContact OG-CB 3.47Å; S255-R259 WeakPolarHBondContact OG-CD 3.21Å
256	Y	94.1	Very high	94.8	Very high	1 Å²	1	34.7 Å²	34.7	0%	0.004	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	139.4	175.1	-167.4	-95.3	0	0	0	111	R197 R200 I201 E204 V252 P253 D254 R259 P261 W289	R197-Y256 VanDerWaalsContact CA-O 3.32Å; R197-Y256 WeakPolarHBondContact CA-O 3.46Å; R197-Y256 WeakPolarHBondContact CB-O 3.48Å; R197-Y256 WeakPolarHBondContact CG-O 3.38Å; R200-Y256 HydrophobicContact CG-CD1 4.47Å; R200-Y256 HydrophobicContact CG-CE1 4.03Å; I201-Y256 HydrophobicContact CD1-CD1 4.37Å; I201-Y256 HydrophobicContact CD1-CE1 3.99Å; E204-Y256 PolarHBondContact OE1-OH 3.1Å; E204-Y256 PolarHBondContact OE2-OH 3.22Å; E204-Y256 VanDerWaalsContact OE2-OH 3.07Å; V252-Y256 HydrophobicContact CG1-CD1 3.91Å; V252-Y256 HydrophobicContact CG1-CD2 4.09Å; V252-Y256 HydrophobicContact CG1-CG 3.57Å; P253-Y256 VanDerWaalsContact O-CB 3.28Å; P253-Y256 WeakPolarHBondContact O-CB 3.16Å; P253-Y256 PolarHBondContact O-N 2.98Å; P253-Y256 VanDerWaalsContact O-N 3.12Å; D254-Y256 VanDerWaalsContact C-N 3.29Å; D254-Y256 PolarHBondContact O-N 2.97Å; Y256-R259 VanDerWaalsContact CD2-O 3.25Å; Y256-R259 WeakPolarHBondContact CD2-O 3.47Å; Y256-P261 HydrophobicContact CE2-CG 4.32Å; Y256-W289 HydrophobicContact CD2-CZ2 4.21Å; Y256-W289 AromaticContact CE2-CH2 3.64Å; Y256-W289 HydrophobicContact CE2-CH2 3.64Å; Y256-W289 AromaticContact CE2-CZ2 3.51Å; Y256-W289 HydrophobicContact CE2-CZ2 3.51Å
257	P	94.2	Very high	94.8	Very high	11 Å²	11	35 Å²	35	7%	0.071	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	cis	-88.7	6.9	4.2	36.2	-36.4	0	0	0	114.9	R200 R259 W289 L291	R200-P257 HydrophobicContact CG-CB 4.26Å; R200-P257 HydrophobicContact CG-CG 4.14Å; P257-R259 VanDerWaalsContact C-N 3.28Å; P257-R259 PolarHBondContact O-N 3.07Å; P257-W289 PolarHBondContact O-NE1 2.89Å; P257-L291 HydrophobicContact CB-CD2 4.26Å; P257-L291 HydrophobicContact CG-CD2 4.24Å; P257-L291 WeakPolarHBondContact O-CD2 3.31Å
258	F	94	Very high	94.9	Very high	141 Å²	141	38.6 Å²	38.6	62%	0.618	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	-25.9	-179.7	-53.6	-74.6	0	0	0	113.3	S255 L291	S255-F258 WeakPolarHBondContact O-CA 3.47Å; S255-F258 VanDerWaalsContact O-CB 3.28Å; S255-F258 WeakPolarHBondContact O-CB 3.39Å; S255-F258 PolarHBondContact O-N 3.26Å; F258-L291 HydrophobicContact CD1-CD1 4.41Å; F258-L291 HydrophobicContact CD1-CD2 3.98Å; F258-L291 HydrophobicContact CE1-CD1 4.34Å
259	R	93.8	Very high	94.9	Very high	168 Å²	168	38.9 Å²	38.9	63%	0.634	19%	0.188	S	C	*	.	S	Bend	trans	-117.4	148.4	167.5	-67	-167.4	-179.9	148.3	-0.6	110.8	P253 S255 Y256 P257	P253-R259 HydrophobicContact CG-CB 4.47Å; S255-R259 PolarHBondContact O-N 2.74Å; S255-R259 WeakPolarHBondContact OG-CB 3.47Å; S255-R259 WeakPolarHBondContact OG-CD 3.21Å; Y256-R259 VanDerWaalsContact CD2-O 3.25Å; Y256-R259 WeakPolarHBondContact CD2-O 3.47Å; P257-R259 VanDerWaalsContact C-N 3.28Å; P257-R259 PolarHBondContact O-N 3.07Å
260	P	95.4	Very high	95.1	Very high	34 Å²	34	38.5 Å²	38.5	22%	0.221	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-64.8	159.2	178	27.4	-34.8	0	0	0	111.6	P253 I285 W289	P253-P260 WeakPolarHBondContact CG-O 3.29Å; P260-I285 HydrophobicContact CB-CG2 4.2Å; P260-I285 HydrophobicContact CG-CG2 4.39Å; P260-I285 WeakPolarHBondContact CG-O 3.34Å; P260-W289 HydrophobicContact CB-CB 4.42Å; P260-W289 HydrophobicContact CB-CD2 3.55Å; P260-W289 HydrophobicContact CB-CE3 3.6Å; P260-W289 HydrophobicContact CB-CG 3.91Å; P260-W289 HydrophobicContact CB-CZ3 4.16Å; P260-W289 HydrophobicContact CG-CB 4.4Å; P260-W289 HydrophobicContact CG-CD2 4.33Å; P260-W289 HydrophobicContact CG-CG 4.18Å
261	P	95.2	Very high	95.2	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-73.8	157.4	167.5	34.6	-29.1	0	0	0	109.9	I250 L251 V252 Y256 I263 L295 L298	I250-P261 HydrophobicContact CG2-CB 3.94Å; I250-P261 HydrophobicContact CG2-CG 4.49Å; L251-P261 CarbonylContact O-C 3.3Å; L251-P261 WeakPolarHBondContact O-CA 3.46Å; L251-P261 WeakPolarHBondContact O-CB 3.45Å; V252-P261 HydrophobicContact CG2-CB 4.3Å; Y256-P261 HydrophobicContact CE2-CG 4.32Å; P261-I263 HydrophobicContact CG-CG1 4.4Å; P261-L295 HydrophobicContact CB-CD2 4.27Å; P261-L295 HydrophobicContact CG-CD2 3.87Å; P261-L298 HydrophobicContact CG-CD1 3.35Å
262	V	94.1	Very high	95.3	Very high	72 Å²	72	36 Å²	36	44%	0.436	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	124.6	169.2	-180	0	0	0	0	108.1	I250 L251	I250-V262 WeakPolarHBondContact CA-O 3.3Å; L251-V262 HydrophobicContact CB-CB 4.22Å; L251-V262 PolarHBondContact N-O 2.76Å; L251-V262 PolarHBondContact O-N 2.73Å
263	I	95.2	Very high	95.5	Very high	9 Å²	9	35.7 Å²	35.7	5%	0.046	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	129.7	178.3	-55.3	-171.7	0	0	0	109.5	V248 L249 I250 P261 V280 I285 L298 I302	V248-I263 HydrophobicContact CG1-CG2 3.33Å; L249-I263 WeakPolarHBondContact O-CA 3.48Å; I250-I263 HydrophobicContact CG2-CG1 4.49Å; P261-I263 HydrophobicContact CG-CG1 4.4Å; I263-V280 HydrophobicContact CG2-CG2 4.18Å; I263-I285 HydrophobicContact CB-CD1 4.28Å; I263-I285 HydrophobicContact CD1-CD1 3.7Å; I263-I285 HydrophobicContact CG1-CD1 3.96Å; I263-L298 HydrophobicContact CD1-CB 3.99Å; I263-L298 HydrophobicContact CD1-CD1 4Å; I263-I302 HydrophobicContact CD1-CD1 3.84Å; I263-I302 HydrophobicContact CG2-CD1 3.72Å
264	R	95.8	Very high	95.7	Very high	65 Å²	65	33.8 Å²	33.8	25%	0.245	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	128.6	179.4	-177	170.8	-70.8	140.4	-1.3	111.5	V248 L249 L266 G278 D279	V248-R264 CarbonylContact C-O 3.6Å; V248-R264 WeakPolarHBondContact CA-O 3.34Å; L249-R264 PolarHBondContact N-O 3.21Å; L249-R264 PolarHBondContact O-N 3.47Å; R264-L266 PolarHBondContact O-N 3.27Å; R264-G278 CarbonylContact C-O 3.26Å; R264-G278 WeakPolarHBondContact CA-O 3.45Å; R264-D279 IonicContact CZ-OD1 3.22Å; R264-D279 VanDerWaalsContact CZ-OD1 3.22Å; R264-D279 IonicContact NE-OD1 2.87Å; R264-D279 PolarHBondContact NE-OD1 2.97Å; R264-D279 IonicContact NH2-OD1 2.72Å; R264-D279 PolarHBondContact NH2-OD1 3.23Å
265	F	97.8	Very high	96	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	126.3	167.5	-83.7	-108.7	0	0	0	109.8	T175 F246 V248 I269 I274 G278 V280 I302	T175-F265 PolarHBondContact OG1-O 3.34Å; F246-F265 HydrophobicContact CB-CD1 4.04Å; F246-F265 HydrophobicContact CB-CE1 3.72Å; F246-F265 HydrophobicContact CD1-CD1 4.41Å; F246-F265 HydrophobicContact CD1-CE1 4.3Å; F246-F265 HydrophobicContact CG-CE1 4.09Å; V248-F265 HydrophobicContact CG2-CD1 4.03Å; V248-F265 HydrophobicContact CG2-CD2 4.16Å; V248-F265 HydrophobicContact CG2-CE1 3.96Å; V248-F265 HydrophobicContact CG2-CE2 4.07Å; V248-F265 HydrophobicContact CG2-CG 4.13Å; V248-F265 HydrophobicContact CG2-CZ 3.97Å; F265-I269 HydrophobicContact CD1-CG2 3.87Å; F265-I269 HydrophobicContact CE1-CD1 4.22Å; F265-I269 HydrophobicContact CE1-CG2 4.32Å; F265-I269 HydrophobicContact CG-CG2 4.25Å; F265-I274 HydrophobicContact CB-CG2 4.23Å; F265-I274 HydrophobicContact CD1-CD1 4.32Å; F265-I274 HydrophobicContact CD2-CD1 3.83Å; F265-I274 HydrophobicContact CD2-CG1 4.3Å; F265-I274 HydrophobicContact CD2-CG2 4.01Å; F265-I274 HydrophobicContact CE1-CD1 3.97Å; F265-I274 HydrophobicContact CE2-CD1 3.45Å; F265-I274 VanDerWaalsContact CE2-CD1 3.45Å; F265-I274 HydrophobicContact CE2-CG1 4.16Å; F265-I274 HydrophobicContact CG-CD1 4.26Å; F265-I274 HydrophobicContact CG-CG2 4.15Å; F265-I274 HydrophobicContact CZ-CD1 3.52Å; F265-G278 PolarHBondContact N-O 3.3Å; F265-G278 WeakPolarHBondContact O-CA 3.46Å; F265-V280 HydrophobicContact CD2-CG2 3.58Å; F265-V280 HydrophobicContact CE2-CG2 3.71Å; F265-I302 HydrophobicContact CE2-CG2 3.8Å; F265-I302 HydrophobicContact CZ-CG2 3.66Å
266	L	97.3	Very high	96.1	Very high	3 Å²	3	32 Å²	32	2%	0.016	14%	0.144	C	C	.	.	S	Bend	trans	-88.2	-33.9	169	-62	179.1	0	0	0	110.9	V174 T175 C179 L183 L230 H247 L249 R264	V174-L266 CarbonylContact C-O 3.57Å; V174-L266 VanDerWaalsContact CA-O 3.26Å; V174-L266 WeakPolarHBondContact CA-O 3.41Å; T175-L266 PolarHBondContact N-O 3.22Å; T175-L266 WeakPolarHBondContact OG1-CA 3.5Å; T175-L266 PolarHBondContact OG1-O 2.91Å; C179-L266 HydrophobicContact CB-CD2 3.63Å; L183-L266 HydrophobicContact CD1-CD1 3.94Å; L183-L266 HydrophobicContact CD2-CD1 3.96Å; L183-L266 HydrophobicContact CG-CD1 4.33Å; L230-L266 HydrophobicContact CD1-CD1 3.75Å; H247-L266 HydrophobicContact CB-CB 4.12Å; H247-L266 PolarHBondContact O-N 3.46Å; L249-L266 HydrophobicContact CB-CD1 4.12Å; L249-L266 HydrophobicContact CB-CD2 4Å; L249-L266 HydrophobicContact CB-CG 3.97Å; L249-L266 HydrophobicContact CD2-CD2 4.39Å; R264-L266 PolarHBondContact O-N 3.27Å
267	T	98.3	Very high	96.2	Very high	7 Å²	7	38 Å²	38	4%	0.043	17%	0.171	C	C	.	.	B	Isolated β-bridge	trans	-79.7	130.5	173	-58.9	0	0	0	0	110.2	S173 F246 H247 I269 F341 A342	S173-T267 CarbonylContact O-C 3.51Å; S173-T267 WeakPolarHBondContact O-CA 3.33Å; F246-T267 HydrophobicContact CD1-CG2 3.86Å; F246-T267 HydrophobicContact CE1-CG2 4.45Å; H247-T267 PolarHBondContact N-OG1 3.19Å; H247-T267 PolarHBondContact O-N 2.92Å; T267-I269 PolarHBondContact O-N 2.7Å; T267-F341 HydrophobicContact CG2-CB 4.46Å; T267-F341 VanDerWaalsContact CG2-O 3.25Å; T267-F341 WeakPolarHBondContact CG2-O 3.49Å; T267-A342 HydrophobicContact CG2-CB 3.89Å
268	R	98.2	Very high	96.3	Very high	82 Å²	82	37.4 Å²	37.4	31%	0.309	17%	0.168	S	C	.	.			trans	-60.1	134.9	173.8	-72.2	177.5	72.4	178.8	2.9	110.5	E172 S173 T175 W337 F341	E172-R268 WeakPolarHBondContact O-CD 3.47Å; S173-R268 WeakPolarHBondContact O-CG 3.45Å; S173-R268 PolarHBondContact O-N 3.17Å; T175-R268 HydrophobicContact CG2-CB 4.39Å; T175-R268 HydrophobicContact CG2-CG 3.86Å; R268-W337 HydrophobicContact CB-CE3 4.36Å; R268-W337 HydrophobicContact CB-CZ3 4.14Å; R268-F341 HydrophobicContact CB-CB 4.08Å; R268-F341 HydrophobicContact CB-CD1 4.45Å; R268-F341 HydrophobicContact CB-CD2 3.85Å; R268-F341 HydrophobicContact CB-CE2 4.39Å; R268-F341 HydrophobicContact CB-CG 3.88Å
269	I	98.2	Very high	96.4	Very high	5 Å²	5	33 Å²	33	3%	0.026	15%	0.151	C	C	.	.			trans	-145.6	140.3	179.7	-172.8	173.3	0	0	0	109.4	Y241 F246 F265 T267 H271 I274 L306	Y241-I269 HydrophobicContact CD1-CD1 3.73Å; Y241-I269 HydrophobicContact CD1-CG1 3.91Å; Y241-I269 HydrophobicContact CE1-CD1 3.75Å; Y241-I269 HydrophobicContact CE1-CG1 3.66Å; Y241-I269 HydrophobicContact CG-CD1 4.38Å; F246-I269 HydrophobicContact CD1-CB 4.15Å; F246-I269 HydrophobicContact CD1-CD1 3.94Å; F246-I269 HydrophobicContact CD1-CG1 4.31Å; F246-I269 HydrophobicContact CE1-CB 3.88Å; F246-I269 HydrophobicContact CE1-CD1 3.57Å; F246-I269 HydrophobicContact CE1-CG1 3.72Å; F246-I269 HydrophobicContact CE2-CD1 4.44Å; F246-I269 HydrophobicContact CZ-CD1 3.85Å; F246-I269 HydrophobicContact CZ-CG1 4.25Å; F265-I269 HydrophobicContact CD1-CG2 3.87Å; F265-I269 HydrophobicContact CE1-CD1 4.22Å; F265-I269 HydrophobicContact CE1-CG2 4.32Å; F265-I269 HydrophobicContact CG-CG2 4.25Å; T267-I269 PolarHBondContact O-N 2.7Å; I269-H271 HydrophobicContact CD1-CB 4.36Å; I269-H271 HydrophobicContact CG1-CB 4.24Å; I269-I274 HydrophobicContact CD1-CD1 4.1Å; I269-I274 HydrophobicContact CG2-CB 4.04Å; I269-I274 HydrophobicContact CG2-CD1 3.69Å; I269-I274 HydrophobicContact CG2-CG1 4.47Å; I269-I274 HydrophobicContact CG2-CG2 3.7Å; I269-L306 HydrophobicContact CD1-CD2 3.55Å
270	L	97.8	Very high	96.5	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.124	C	C	.	.			trans	-93.1	102.8	171.2	-170	88	0	0	0	108.6	Y241 F276 I319 F330 L333 A334 W337 I361	Y241-L270 VanDerWaalsContact CE1-O 3.32Å; Y241-L270 WeakPolarHBondContact CE1-O 3.31Å; Y241-L270 PolarHBondContact OH-O 3.46Å; L270-F276 HydrophobicContact CD1-CE1 4.5Å; L270-I319 HydrophobicContact CD1-CD1 3.89Å; L270-I319 HydrophobicContact CD1-CG1 4.11Å; L270-I319 HydrophobicContact CG-CD1 4.45Å; L270-F330 HydrophobicContact CD2-CD2 4.03Å; L270-F330 HydrophobicContact CD2-CE2 3.92Å; L270-F330 HydrophobicContact CG-CE2 4.21Å; L270-L333 HydrophobicContact CD1-CD2 4.24Å; L270-L333 HydrophobicContact CD2-CB 4Å; L270-L333 HydrophobicContact CD2-CD2 3.7Å; L270-L333 HydrophobicContact CD2-CG 3.76Å; L270-A334 HydrophobicContact CB-CB 4.45Å; L270-A334 HydrophobicContact CD2-CB 4.1Å; L270-W337 HydrophobicContact CB-CB 4.2Å; L270-W337 HydrophobicContact CB-CD2 3.86Å; L270-W337 HydrophobicContact CB-CE3 4Å; L270-W337 HydrophobicContact CB-CG 3.96Å; L270-W337 HydrophobicContact CD1-CD2 4.41Å; L270-W337 HydrophobicContact CD1-CZ2 4.24Å; L270-I361 HydrophobicContact CD1-CD1 3.65Å; L270-I361 HydrophobicContact CD1-CG1 4.3Å
271	H	97.4	Very high	96.4	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.115	C	C	.	.	B	Isolated β-bridge	trans	-149.8	137.1	-176.5	-173.8	-83.8	0	0	0	111	Y241 I269 N273 I274 L305	Y241-H271 AromaticContact CE2-CD2 3.69Å; Y241-H271 AromaticContact CZ-CD2 3.57Å; Y241-H271 PolarHBondContact OH-CD2 3.3Å; I269-H271 HydrophobicContact CD1-CB 4.36Å; I269-H271 HydrophobicContact CG1-CB 4.24Å; H271-N273 VanDerWaalsContact C-N 3.26Å; H271-N273 PolarHBondContact CE1-OD1 3.41Å; H271-N273 PolarHBondContact ND1-N 3.4Å; H271-N273 PolarHBondContact O-N 2.86Å; H271-I274 HydrophobicContact CB-CB 4.11Å; H271-I274 HydrophobicContact CB-CD1 3.92Å; H271-I274 HydrophobicContact CB-CG1 4.12Å; H271-I274 PolarHBondContact O-N 3.42Å; H271-I274 VanDerWaalsContact O-N 3.1Å; H271-L305 PolarHBondContact NE2-O 2.98Å
272	P	96.3	Very high	96.2	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.006	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-39	-177.9	-27.9	36	0	0	0	113.2	P309 C314 M315 I319 Y323 F330	P272-P309 HydrophobicContact CB-CB 4.17Å; P272-P309 HydrophobicContact CG-CB 3.76Å; P272-P309 HydrophobicContact CG-CG 4.31Å; P272-C314 CarbonylContact O-C 3.51Å; P272-C314 VanDerWaalsContact O-CA 3.25Å; P272-C314 WeakPolarHBondContact O-CA 3.49Å; P272-C314 PolarHBondContact O-SG 3.18Å; P272-M315 PolarHBondContact O-N 2.92Å; P272-I319 HydrophobicContact CG-CG2 4.37Å; P272-Y323 HydrophobicContact CG-CD2 3.92Å; P272-Y323 HydrophobicContact CG-CG 4.17Å; P272-F330 HydrophobicContact CG-CE2 4.23Å; P272-F330 HydrophobicContact CG-CZ 4.14Å
273	N	96.6	Very high	96	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	11.1	-179.4	-49.5	104.8	0	0	0	115.2	H271 G281 L305 P309 H310 V313 M315	H271-N273 VanDerWaalsContact C-N 3.26Å; H271-N273 PolarHBondContact CE1-OD1 3.41Å; H271-N273 PolarHBondContact ND1-N 3.4Å; H271-N273 PolarHBondContact O-N 2.86Å; N273-G281 PolarHBondContact O-N 2.92Å; N273-L305 HydrophobicContact CB-CD1 4.34Å; N273-L305 HydrophobicContact CB-CD2 4.49Å; N273-P309 WeakPolarHBondContact OD1-CA 3.45Å; N273-H310 PolarHBondContact ND2-O 2.98Å; N273-H310 PolarHBondContact OD1-N 3.47Å; N273-V313 PolarHBondContact ND2-O 3.2Å; N273-M315 VanDerWaalsContact O-CG 3.3Å; N273-M315 WeakPolarHBondContact O-CG 3.46Å
274	I	97.1	Very high	95.5	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.01	12%	0.121	C	C	.	.	B	Isolated β-bridge	trans	-129.9	127.3	178.3	-55.5	167.4	0	0	0	108.9	F265 I269 H271 D279 L306	F265-I274 HydrophobicContact CB-CG2 4.23Å; F265-I274 HydrophobicContact CD1-CD1 4.32Å; F265-I274 HydrophobicContact CD2-CD1 3.83Å; F265-I274 HydrophobicContact CD2-CG1 4.3Å; F265-I274 HydrophobicContact CD2-CG2 4.01Å; F265-I274 HydrophobicContact CE1-CD1 3.97Å; F265-I274 HydrophobicContact CE2-CD1 3.45Å; F265-I274 VanDerWaalsContact CE2-CD1 3.45Å; F265-I274 HydrophobicContact CE2-CG1 4.16Å; F265-I274 HydrophobicContact CG-CD1 4.26Å; F265-I274 HydrophobicContact CG-CG2 4.15Å; F265-I274 HydrophobicContact CZ-CD1 3.52Å; I269-I274 HydrophobicContact CD1-CD1 4.1Å; I269-I274 HydrophobicContact CG2-CB 4.04Å; I269-I274 HydrophobicContact CG2-CD1 3.69Å; I269-I274 HydrophobicContact CG2-CG1 4.47Å; I269-I274 HydrophobicContact CG2-CG2 3.7Å; H271-I274 HydrophobicContact CB-CB 4.11Å; H271-I274 HydrophobicContact CB-CD1 3.92Å; H271-I274 HydrophobicContact CB-CG1 4.12Å; H271-I274 PolarHBondContact O-N 3.42Å; H271-I274 VanDerWaalsContact O-N 3.1Å; I274-D279 WeakPolarHBondContact CA-O 3.5Å; I274-L306 HydrophobicContact CD1-CD2 4.24Å
275	S	96.2	Very high	95.1	Very high	7 Å²	7	23.6 Å²	23.6	5%	0.049	12%	0.117	C	C	.	.			trans	-71.6	164.4	-179.7	74.4	0	0	0	0	112.1	H277 G278 D279 E316	S275-H277 PolarHBondContact O-N 2.93Å; S275-H277 VanDerWaalsContact O-N 3.16Å; S275-H277 PolarHBondContact OG-N 2.89Å; S275-G278 WeakPolarHBondContact O-CA 3.44Å; S275-G278 PolarHBondContact O-N 3.25Å; S275-G278 PolarHBondContact OG-N 3.16Å; S275-D279 PolarHBondContact N-O 3.41Å; S275-D279 WeakPolarHBondContact OG-CB 3.41Å; S275-D279 PolarHBondContact OG-N 3.31Å; S275-D279 PolarHBondContact OG-OD2 2.97Å; S275-E316 WeakPolarHBondContact CA-OE1 3.18Å; S275-E316 WeakPolarHBondContact CB-OE1 3.5Å
276	F	96.1	Very high	94.5	Very high	64 Å²	64	28.8 Å²	28.8	28%	0.281	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-22.8	171.9	-68	-57.8	0	0	0	112.9	L270 G278 E316 V318 I319 W337 I361	L270-F276 HydrophobicContact CD1-CE1 4.5Å; F276-G278 VanDerWaalsContact C-N 3.32Å; F276-E316 HydrophobicContact CD2-CG 3.68Å; F276-E316 WeakPolarHBondContact CD2-OE1 3.46Å; F276-E316 HydrophobicContact CE2-CB 4.13Å; F276-E316 HydrophobicContact CE2-CG 3.76Å; F276-E316 HydrophobicContact CG-CG 4.25Å; F276-E316 HydrophobicContact CZ-CG 4.4Å; F276-E316 PolarHBondContact N-OE1 3.3Å; F276-V318 HydrophobicContact CE2-CG1 4.12Å; F276-V318 HydrophobicContact CZ-CG1 4.22Å; F276-I319 HydrophobicContact CD1-CD1 4.46Å; F276-I319 HydrophobicContact CE1-CD1 3.76Å; F276-I319 HydrophobicContact CE1-CG1 4.36Å; F276-I319 HydrophobicContact CE2-CD1 4.44Å; F276-I319 HydrophobicContact CZ-CD1 3.74Å; F276-I319 HydrophobicContact CZ-CG1 3.91Å; F276-W337 AromaticContact CD1-CH2 3.88Å; F276-W337 HydrophobicContact CD1-CH2 3.88Å; F276-W337 HydrophobicContact CD1-CZ3 4.48Å; F276-W337 AromaticContact CE1-CH2 3.8Å; F276-W337 HydrophobicContact CE1-CH2 3.8Å; F276-W337 HydrophobicContact CE1-CZ2 4.36Å; F276-I361 HydrophobicContact CE1-CD1 4.15Å; F276-I361 HydrophobicContact CZ-CD1 4.19Å; F276-I361 HydrophobicContact CZ-CG2 4.26Å
277	H	95.7	Very high	93.9	Very high	125 Å²	125	35.7 Å²	35.7	58%	0.579	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-2.2	174.2	-59.6	-57.2	0	0	0	113.6	S275	S275-H277 PolarHBondContact O-N 2.93Å; S275-H277 VanDerWaalsContact O-N 3.16Å; S275-H277 PolarHBondContact OG-N 2.89Å
278	G	96.8	Very high	93.6	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.191	C	C	.	.			trans	89.7	4.2	177	0	0	0	0	0	115.1	R264 F265 S275 F276	R264-G278 CarbonylContact C-O 3.26Å; R264-G278 WeakPolarHBondContact CA-O 3.45Å; F265-G278 PolarHBondContact N-O 3.3Å; F265-G278 WeakPolarHBondContact O-CA 3.46Å; S275-G278 WeakPolarHBondContact O-CA 3.44Å; S275-G278 PolarHBondContact O-N 3.25Å; S275-G278 PolarHBondContact OG-N 3.16Å; F276-G278 VanDerWaalsContact C-N 3.32Å
279	D	95.5	Very high	93.5	Very high	48 Å²	48	38.3 Å²	38.3	26%	0.257	18%	0.184	S	C	.	.	B	Isolated β-bridge	trans	-70.4	135.1	179.1	-55.8	-58.8	0	0	0	110.8	R264 I274 S275 M315	R264-D279 IonicContact CZ-OD1 3.22Å; R264-D279 VanDerWaalsContact CZ-OD1 3.22Å; R264-D279 IonicContact NE-OD1 2.87Å; R264-D279 PolarHBondContact NE-OD1 2.97Å; R264-D279 IonicContact NH2-OD1 2.72Å; R264-D279 PolarHBondContact NH2-OD1 3.23Å; I274-D279 WeakPolarHBondContact CA-O 3.5Å; S275-D279 PolarHBondContact N-O 3.41Å; S275-D279 WeakPolarHBondContact OG-CB 3.41Å; S275-D279 PolarHBondContact OG-N 3.31Å; S275-D279 PolarHBondContact OG-OD2 2.97Å; D279-M315 HydrophobicContact CB-CE 4.11Å
280	V	95.3	Very high	93.3	Very high	11 Å²	11	41 Å²	41	7%	0.067	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-94.5	127	-176.1	-172.9	0	0	0	0	111.1	I263 F265 L282 I302 L305	I263-V280 HydrophobicContact CG2-CG2 4.18Å; F265-V280 HydrophobicContact CD2-CG2 3.58Å; F265-V280 HydrophobicContact CE2-CG2 3.71Å; V280-L282 HydrophobicContact CG1-CB 4Å; V280-L282 PolarHBondContact O-N 3.49Å; V280-I302 HydrophobicContact CG1-CG1 4.39Å; V280-L305 HydrophobicContact CG1-CD1 4.42Å
281	G	93.7	Very high	93.2	Very high	3 Å²	3	45.2 Å²	45.2	3%	0.031	23%	0.225	C	C	.	.			trans	-85.2	73.6	168.7	0	0	0	0	0	112	N273	N273-G281 PolarHBondContact O-N 2.92Å
282	L	91.1	Very high	93	Very high	13 Å²	13	48.2 Å²	48.2	7%	0.068	25%	0.25	C	S	.	.			trans	-110.1	124.3	176.3	-176.6	65.1	0	0	0	110.7	V280 S284 I285 R286 L298 I302 L305	V280-L282 HydrophobicContact CG1-CB 4Å; V280-L282 PolarHBondContact O-N 3.49Å; L282-S284 VanDerWaalsContact C-N 3.31Å; L282-S284 PolarHBondContact O-N 2.76Å; L282-I285 HydrophobicContact CB-CB 4.47Å; L282-I285 HydrophobicContact CB-CD1 4.12Å; L282-I285 HydrophobicContact CB-CG1 4.31Å; L282-I285 HydrophobicContact CD2-CD1 3.88Å; L282-I285 HydrophobicContact CD2-CG1 4.05Å; L282-I285 HydrophobicContact CG-CD1 4.49Å; L282-I285 HydrophobicContact CG-CG1 4.44Å; L282-I285 PolarHBondContact O-N 3.39Å; L282-R286 PolarHBondContact O-N 3.42Å; L282-R286 VanDerWaalsContact O-N 3.12Å; L282-L298 HydrophobicContact CD2-CD2 3.98Å; L282-I302 HydrophobicContact CD2-CG1 4.43Å; L282-L305 HydrophobicContact CB-CD1 4.41Å; L282-L305 HydrophobicContact CD1-CD1 3.72Å; L282-L305 HydrophobicContact CD1-CG 4.34Å
283	D	88.8	Confident	93	Very high	67 Å²	67	49.3 Å²	49.3	36%	0.358	26%	0.256	S	S	.	.	H	α-helix	trans	-58.7	-40.6	-175.9	-177.9	41.4	0	0	0	113	I285 R286 H287 N288	D283-I285 PolarHBondContact O-N 3.46Å; D283-I285 VanDerWaalsContact O-N 3.14Å; D283-R286 PolarHBondContact O-N 2.91Å; D283-R286 VanDerWaalsContact O-N 3.07Å; D283-H287 PolarHBondContact O-N 2.67Å; D283-H287 IonicContact OD1-CD2 3.72Å; D283-N288 VanDerWaalsContact CG-ND2 3.33Å; D283-N288 PolarHBondContact O-N 2.89Å; D283-N288 PolarHBondContact OD1-ND2 2.97Å; D283-N288 PolarHBondContact OD2-ND2 3.42Å
284	S	86.3	Confident	92.9	Very high	28 Å²	28	50 Å²	50	20%	0.196	26%	0.26	C	S	.	.	H	α-helix	trans	-60.7	-22.3	175.1	-50	0	0	0	0	113.9	L282 N288 W289	L282-S284 VanDerWaalsContact C-N 3.31Å; L282-S284 PolarHBondContact O-N 2.76Å; S284-N288 CarbonylContact O-C 3.55Å; S284-W289 WeakPolarHBondContact O-CA 3.36Å; S284-W289 WeakPolarHBondContact O-CB 3.45Å; S284-W289 PolarHBondContact O-N 3.33Å
285	I	86.9	Confident	92.8	Very high	30 Å²	30	49.9 Å²	49.9	15%	0.154	26%	0.26	C	S	.	.	H	α-helix	trans	-92.1	-30.8	175.9	-65.6	174.8	0	0	0	110.9	P260 I263 L282 D283 L298	P260-I285 HydrophobicContact CB-CG2 4.2Å; P260-I285 HydrophobicContact CG-CG2 4.39Å; P260-I285 WeakPolarHBondContact CG-O 3.34Å; I263-I285 HydrophobicContact CB-CD1 4.28Å; I263-I285 HydrophobicContact CD1-CD1 3.7Å; I263-I285 HydrophobicContact CG1-CD1 3.96Å; L282-I285 HydrophobicContact CB-CB 4.47Å; L282-I285 HydrophobicContact CB-CD1 4.12Å; L282-I285 HydrophobicContact CB-CG1 4.31Å; L282-I285 HydrophobicContact CD2-CD1 3.88Å; L282-I285 HydrophobicContact CD2-CG1 4.05Å; L282-I285 HydrophobicContact CG-CD1 4.49Å; L282-I285 HydrophobicContact CG-CG1 4.44Å; L282-I285 PolarHBondContact O-N 3.39Å; D283-I285 PolarHBondContact O-N 3.46Å; D283-I285 VanDerWaalsContact O-N 3.14Å; I285-L298 HydrophobicContact CD1-CD2 4.21Å; I285-L298 HydrophobicContact CG1-CD2 3.83Å
286	R	84.9	Confident	92.8	Very high	108 Å²	108	52.8 Å²	52.8	41%	0.408	27%	0.273	S	S	.	.	H	α-helix	trans	-89.6	-48.2	-172.1	-69.2	-177.3	173.9	-160.1	-9.6	114.2	L282 D283 M315	L282-R286 PolarHBondContact O-N 3.42Å; L282-R286 VanDerWaalsContact O-N 3.12Å; D283-R286 PolarHBondContact O-N 2.91Å; D283-R286 VanDerWaalsContact O-N 3.07Å; R286-M315 VanDerWaalsContact CZ-SD 3.59Å; R286-M315 PolarHBondContact NH2-SD 3.44Å
287	H	85.6	Confident	92.7	Very high	148 Å²	148	54.5 Å²	54.5	69%	0.685	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.6	-32.8	-167.4	-55	-54.3	0	0	0	112.2	D283	D283-H287 PolarHBondContact O-N 2.67Å; D283-H287 IonicContact OD1-CD2 3.72Å
288	N	91.7	Very high	92.8	Very high	99 Å²	99	48.6 Å²	48.6	53%	0.529	25%	0.253	S	S	.	.			trans	-114.7	39.9	-170.8	-69.3	-36.9	0	0	0	112.6	D283 S284	D283-N288 VanDerWaalsContact CG-ND2 3.33Å; D283-N288 PolarHBondContact O-N 2.89Å; D283-N288 PolarHBondContact OD1-ND2 2.97Å; D283-N288 PolarHBondContact OD2-ND2 3.42Å; S284-N288 CarbonylContact O-C 3.55Å
289	W	95.2	Very high	92.7	Very high	45 Å²	45	48.6 Å²	48.6	17%	0.17	25%	0.253	C	S	.	.			trans	-71.6	129.7	173.8	179.6	-106.1	0	0	0	110.7	Y256 P257 P260 S284 L293 L298	Y256-W289 HydrophobicContact CD2-CZ2 4.21Å; Y256-W289 AromaticContact CE2-CH2 3.64Å; Y256-W289 HydrophobicContact CE2-CH2 3.64Å; Y256-W289 AromaticContact CE2-CZ2 3.51Å; Y256-W289 HydrophobicContact CE2-CZ2 3.51Å; P257-W289 PolarHBondContact O-NE1 2.89Å; P260-W289 HydrophobicContact CB-CB 4.42Å; P260-W289 HydrophobicContact CB-CD2 3.55Å; P260-W289 HydrophobicContact CB-CE3 3.6Å; P260-W289 HydrophobicContact CB-CG 3.91Å; P260-W289 HydrophobicContact CB-CZ3 4.16Å; P260-W289 HydrophobicContact CG-CB 4.4Å; P260-W289 HydrophobicContact CG-CD2 4.33Å; P260-W289 HydrophobicContact CG-CG 4.18Å; S284-W289 WeakPolarHBondContact O-CA 3.36Å; S284-W289 WeakPolarHBondContact O-CB 3.45Å; S284-W289 PolarHBondContact O-N 3.33Å; W289-L293 HydrophobicContact CD2-CD1 4.36Å; W289-L293 HydrophobicContact CE3-CB 4.1Å; W289-L293 HydrophobicContact CE3-CD1 3.56Å; W289-L293 HydrophobicContact CE3-CG 4.48Å; W289-L293 HydrophobicContact CH2-CB 3.88Å; W289-L293 HydrophobicContact CZ3-CB 3.55Å; W289-L293 HydrophobicContact CZ3-CD1 3.8Å; W289-L293 HydrophobicContact CZ3-CG 4.34Å; W289-L298 HydrophobicContact CH2-CD1 4.21Å; W289-L298 HydrophobicContact CZ3-CD1 3.78Å; W289-L298 HydrophobicContact CZ3-CD2 4.04Å; W289-L298 HydrophobicContact CZ3-CG 4.17Å
290	C	94.3	Very high	92.7	Very high	62 Å²	62	49.8 Å²	49.8	42%	0.419	26%	0.259	S	S	.	.			trans	-139	155.9	175	76.6	0	0	0	0	111.4	A292 L293	C290-A292 PolarHBondContact O-N 2.97Å; C290-L293 WeakPolarHBondContact O-CB 3.21Å; C290-L293 PolarHBondContact O-N 2.96Å
291	L	94.9	Very high	92.7	Very high	88 Å²	88	51.1 Å²	51.1	46%	0.461	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-12.6	-175.5	-54.8	-177.6	0	0	0	114.1	R200 P257 F258 L293	R200-L291 PolarHBondContact NH2-O 3.1Å; P257-L291 HydrophobicContact CB-CD2 4.26Å; P257-L291 HydrophobicContact CG-CD2 4.24Å; P257-L291 WeakPolarHBondContact O-CD2 3.31Å; F258-L291 HydrophobicContact CD1-CD1 4.41Å; F258-L291 HydrophobicContact CD1-CD2 3.98Å; F258-L291 HydrophobicContact CE1-CD1 4.34Å; L291-L293 VanDerWaalsContact C-N 3.33Å
292	A	94.6	Very high	92.8	Very high	64 Å²	64	51 Å²	51	53%	0.529	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-12.8	175.4	0	0	0	0	0	113.2	C290 K297	C290-A292 PolarHBondContact O-N 2.97Å; A292-K297 PolarHBondContact O-NZ 2.89Å
293	L	95.6	Very high	93	Very high	23 Å²	23	52 Å²	52	12%	0.12	27%	0.272	C	S	.	.			trans	-76.1	149	172.6	-64.7	171.1	0	0	0	110.5	R200 W289 C290 L291 K297	R200-L293 PolarHBondContact NH2-O 3.41Å; W289-L293 HydrophobicContact CD2-CD1 4.36Å; W289-L293 HydrophobicContact CE3-CB 4.1Å; W289-L293 HydrophobicContact CE3-CD1 3.56Å; W289-L293 HydrophobicContact CE3-CG 4.48Å; W289-L293 HydrophobicContact CH2-CB 3.88Å; W289-L293 HydrophobicContact CZ3-CB 3.55Å; W289-L293 HydrophobicContact CZ3-CD1 3.8Å; W289-L293 HydrophobicContact CZ3-CG 4.34Å; C290-L293 WeakPolarHBondContact O-CB 3.21Å; C290-L293 PolarHBondContact O-N 2.96Å; L291-L293 VanDerWaalsContact C-N 3.33Å; L293-K297 HydrophobicContact CD2-CB 4.35Å; L293-K297 HydrophobicContact CD2-CD 4.37Å
294	S	94.6	Very high	93.3	Very high	14 Å²	14	51.3 Å²	51.3	10%	0.098	28%	0.275	C	S	.	.			trans	-133.1	166.1	177.7	59.5	0	0	0	0	109.5	E204 E296 K297 L298	E204-S294 VanDerWaalsContact CD-CB 3.47Å; E204-S294 VanDerWaalsContact OE2-CA 3.25Å; E204-S294 WeakPolarHBondContact OE2-CA 3.41Å; E204-S294 WeakPolarHBondContact OE2-CB 2.86Å; S294-E296 PolarHBondContact O-N 3.01Å; S294-K297 PolarHBondContact O-N 3.42Å; S294-K297 PolarHBondContact OG-N 3.19Å; S294-L298 WeakPolarHBondContact O-CG 3.41Å; S294-L298 PolarHBondContact O-N 3.1Å
295	L	95.6	Very high	93.6	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-53.3	-40.1	171.3	-71.3	-164.8	0	0	0	112.2	I201 E204 L208 I218 F229 I250 P261 L298 L299	I201-L295 HydrophobicContact CD1-CD1 3.58Å; I201-L295 HydrophobicContact CD1-CD2 4.45Å; I201-L295 HydrophobicContact CD1-CG 3.81Å; E204-L295 PolarHBondContact OE2-N 3.43Å; L208-L295 HydrophobicContact CD1-CB 3.72Å; I218-L295 HydrophobicContact CD1-CD1 4.41Å; F229-L295 HydrophobicContact CD2-CD1 4.31Å; F229-L295 HydrophobicContact CE2-CD1 4.29Å; I250-L295 HydrophobicContact CG2-CD2 3.86Å; P261-L295 HydrophobicContact CB-CD2 4.27Å; P261-L295 HydrophobicContact CG-CD2 3.87Å; L295-L298 HydrophobicContact CD2-CD1 4.47Å; L295-L298 PolarHBondContact O-N 3.44Å; L295-L299 WeakPolarHBondContact O-CG 3.24Å; L295-L299 PolarHBondContact O-N 2.52Å
296	E	95.4	Very high	94.1	Very high	68 Å²	68	49.6 Å²	49.6	32%	0.318	26%	0.264	S	S	.	.	H	α-helix	trans	-58.2	-52.5	176.2	-174.1	-164.5	157.9	0	0	111.9	L208 P213 S294 L298 L299 I300	L208-E296 HydrophobicContact CD1-CB 4.43Å; L208-E296 HydrophobicContact CD2-CB 3.62Å; L208-E296 HydrophobicContact CD2-CG 3.77Å; L208-E296 HydrophobicContact CG-CB 3.97Å; P213-E296 HydrophobicContact CG-CG 3.87Å; S294-E296 PolarHBondContact O-N 3.01Å; E296-L298 VanDerWaalsContact C-N 3.28Å; E296-L298 PolarHBondContact O-N 2.77Å; E296-L299 PolarHBondContact O-N 3.21Å; E296-I300 HydrophobicContact CG-CD1 3.97Å; E296-I300 WeakPolarHBondContact O-CG1 3.25Å; E296-I300 PolarHBondContact O-N 2.9Å
297	K	95.3	Very high	94.4	Very high	99 Å²	99	48.4 Å²	48.4	43%	0.43	27%	0.269	S	S	.	.	H	α-helix	trans	-61.7	-37.4	178.5	-69.3	175.6	-176.7	175.9	0	111.7	A292 L293 S294 S301	A292-K297 PolarHBondContact O-NZ 2.89Å; L293-K297 HydrophobicContact CD2-CB 4.35Å; L293-K297 HydrophobicContact CD2-CD 4.37Å; S294-K297 PolarHBondContact O-N 3.42Å; S294-K297 PolarHBondContact OG-N 3.19Å; K297-S301 WeakPolarHBondContact O-CB 3.43Å; K297-S301 PolarHBondContact O-N 3.26Å; K297-S301 PolarHBondContact O-OG 2.95Å
298	L	96	Very high	94.7	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-65.1	-44.2	176.2	-70	177.1	0	0	0	112.1	P261 I263 L282 I285 W289 S294 L295 E296 S301 I302	P261-L298 HydrophobicContact CG-CD1 3.35Å; I263-L298 HydrophobicContact CD1-CB 3.99Å; I263-L298 HydrophobicContact CD1-CD1 4Å; L282-L298 HydrophobicContact CD2-CD2 3.98Å; I285-L298 HydrophobicContact CD1-CD2 4.21Å; I285-L298 HydrophobicContact CG1-CD2 3.83Å; W289-L298 HydrophobicContact CH2-CD1 4.21Å; W289-L298 HydrophobicContact CZ3-CD1 3.78Å; W289-L298 HydrophobicContact CZ3-CD2 4.04Å; W289-L298 HydrophobicContact CZ3-CG 4.17Å; S294-L298 WeakPolarHBondContact O-CG 3.41Å; S294-L298 PolarHBondContact O-N 3.1Å; L295-L298 HydrophobicContact CD2-CD1 4.47Å; L295-L298 PolarHBondContact O-N 3.44Å; E296-L298 VanDerWaalsContact C-N 3.28Å; E296-L298 PolarHBondContact O-N 2.77Å; L298-S301 PolarHBondContact O-N 2.83Å; L298-I302 WeakPolarHBondContact O-CG1 3.39Å; L298-I302 PolarHBondContact O-N 2.86Å
299	L	96.4	Very high	94.8	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-66.5	-40.5	178.6	-71.4	169.8	0	0	0	111.9	I216 I218 A231 I233 I250 L295 E296 I302 L303	I216-L299 HydrophobicContact CD1-CB 3.85Å; I216-L299 HydrophobicContact CG2-CB 4.39Å; I216-L299 HydrophobicContact CG2-CD1 3.91Å; I218-L299 HydrophobicContact CD1-CD1 4.3Å; A231-L299 HydrophobicContact CB-CD1 4.33Å; A231-L299 HydrophobicContact CB-CD2 3.86Å; I233-L299 HydrophobicContact CD1-CD2 4.1Å; I250-L299 HydrophobicContact CD1-CD1 4.34Å; I250-L299 HydrophobicContact CD1-CD2 4.13Å; I250-L299 HydrophobicContact CD1-CG 4.46Å; L295-L299 WeakPolarHBondContact O-CG 3.24Å; L295-L299 PolarHBondContact O-N 2.52Å; E296-L299 PolarHBondContact O-N 3.21Å; L299-I302 PolarHBondContact O-N 3.12Å; L299-L303 PolarHBondContact O-N 3.48Å
300	I	95.5	Very high	94.4	Very high	74 Å²	74	45.4 Å²	45.4	38%	0.379	26%	0.259	S	S	.	.	H	α-helix	trans	-62.4	-43.3	173.1	-67.3	169	0	0	0	110.7	P213 E296 I302 L303 A304	P213-I300 HydrophobicContact CB-CD1 4.33Å; P213-I300 HydrophobicContact CB-CG1 4.08Å; P213-I300 HydrophobicContact CG-CD1 4Å; P213-I300 HydrophobicContact CG-CG1 4.02Å; E296-I300 HydrophobicContact CG-CD1 3.97Å; E296-I300 WeakPolarHBondContact O-CG1 3.25Å; E296-I300 PolarHBondContact O-N 2.9Å; I300-I302 VanDerWaalsContact C-N 3.3Å; I300-I302 PolarHBondContact O-N 3.2Å; I300-L303 WeakPolarHBondContact O-CB 3.37Å; I300-L303 PolarHBondContact O-N 3.19Å; I300-A304 PolarHBondContact O-N 2.95Å
301	S	95.1	Very high	93.8	Very high	38 Å²	38	45.6 Å²	45.6	27%	0.266	26%	0.259	S	S	.	.	H	α-helix	trans	-61.4	-37.1	175.5	-68.9	0	0	0	0	112.5	K297 L298 A304 L305	K297-S301 WeakPolarHBondContact O-CB 3.43Å; K297-S301 PolarHBondContact O-N 3.26Å; K297-S301 PolarHBondContact O-OG 2.95Å; L298-S301 PolarHBondContact O-N 2.83Å; S301-A304 PolarHBondContact O-N 3.44Å; S301-L305 WeakPolarHBondContact O-CG 3.44Å; S301-L305 PolarHBondContact O-N 2.9Å
302	I	95.8	Very high	93.3	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-66.4	-43.3	174.4	-69.2	165	0	0	0	110.9	I233 I263 F265 V280 L282 L298 L299 I300 A304 L305 L306	I233-I302 HydrophobicContact CD1-CB 4.3Å; I233-I302 HydrophobicContact CD1-CG2 3.65Å; I263-I302 HydrophobicContact CD1-CD1 3.84Å; I263-I302 HydrophobicContact CG2-CD1 3.72Å; F265-I302 HydrophobicContact CE2-CG2 3.8Å; F265-I302 HydrophobicContact CZ-CG2 3.66Å; V280-I302 HydrophobicContact CG1-CG1 4.39Å; L282-I302 HydrophobicContact CD2-CG1 4.43Å; L298-I302 WeakPolarHBondContact O-CG1 3.39Å; L298-I302 PolarHBondContact O-N 2.86Å; L299-I302 PolarHBondContact O-N 3.12Å; I300-I302 VanDerWaalsContact C-N 3.3Å; I300-I302 PolarHBondContact O-N 3.2Å; I302-A304 VanDerWaalsContact C-N 3.29Å; I302-A304 PolarHBondContact O-N 3.26Å; I302-L305 WeakPolarHBondContact O-CB 3.43Å; I302-L305 PolarHBondContact O-N 3.44Å; I302-L306 PolarHBondContact O-N 3.25Å
303	L	94.9	Very high	92.9	Very high	35 Å²	35	50.8 Å²	50.8	18%	0.183	26%	0.263	C	S	.	.	H	α-helix	trans	-60.4	-40.4	175.8	-176.7	63.1	0	0	0	111.6	I216 I233 P236 L299 I300 L306	I216-L303 HydrophobicContact CD1-CD2 4.42Å; I233-L303 HydrophobicContact CG2-CD1 3.89Å; P236-L303 HydrophobicContact CB-CD1 4.11Å; P236-L303 HydrophobicContact CG-CD1 4.08Å; L299-L303 PolarHBondContact O-N 3.48Å; I300-L303 WeakPolarHBondContact O-CB 3.37Å; I300-L303 PolarHBondContact O-N 3.19Å; L303-L306 WeakPolarHBondContact O-CB 3.29Å; L303-L306 PolarHBondContact O-N 2.92Å
304	A	94	Very high	92.8	Very high	51 Å²	51	51.7 Å²	51.7	42%	0.421	27%	0.27	S	S	.	.	H	α-helix	trans	-64.7	-38.5	175.2	0	0	0	0	0	112.5	I300 S301 I302 L306 T307 D308	I300-A304 PolarHBondContact O-N 2.95Å; S301-A304 PolarHBondContact O-N 3.44Å; I302-A304 VanDerWaalsContact C-N 3.29Å; I302-A304 PolarHBondContact O-N 3.26Å; A304-L306 VanDerWaalsContact C-N 3.26Å; A304-L306 PolarHBondContact O-N 2.94Å; A304-T307 PolarHBondContact O-N 3.5Å; A304-T307 PolarHBondContact O-OG1 3.48Å; A304-D308 PolarHBondContact O-N 3.22Å
305	L	93.9	Very high	92.8	Very high	20 Å²	20	52.9 Å²	52.9	11%	0.105	28%	0.275	C	S	.	.	H	α-helix	trans	-58.3	-39.2	174.2	-78	175.8	0	0	0	111.7	H271 N273 V280 L282 S301 I302 T307 D308 H310	H271-L305 PolarHBondContact NE2-O 2.98Å; N273-L305 HydrophobicContact CB-CD1 4.34Å; N273-L305 HydrophobicContact CB-CD2 4.49Å; V280-L305 HydrophobicContact CG1-CD1 4.42Å; L282-L305 HydrophobicContact CB-CD1 4.41Å; L282-L305 HydrophobicContact CD1-CD1 3.72Å; L282-L305 HydrophobicContact CD1-CG 4.34Å; S301-L305 WeakPolarHBondContact O-CG 3.44Å; S301-L305 PolarHBondContact O-N 2.9Å; I302-L305 WeakPolarHBondContact O-CB 3.43Å; I302-L305 PolarHBondContact O-N 3.44Å; L305-T307 PolarHBondContact O-N 2.93Å; L305-D308 CarbonylContact O-C 3.45Å; L305-D308 VanDerWaalsContact O-C 3.3Å; L305-D308 PolarHBondContact O-N 3.47Å; L305-H310 HydrophobicContact CD2-CB 4.19Å
306	L	96	Very high	92.8	Very high	3 Å²	3	54.7 Å²	54.7	2%	0.016	28%	0.283	C	S	.	.	H	α-helix	trans	-63.3	-22.9	178.1	-62	-175	0	0	0	113.2	I233 P236 Y241 I269 I274 I302 L303 A304	I233-L306 HydrophobicContact CG2-CD1 4.24Å; P236-L306 HydrophobicContact CG-CB 3.79Å; Y241-L306 HydrophobicContact CD2-CB 3.85Å; Y241-L306 HydrophobicContact CD2-CD2 4.17Å; Y241-L306 HydrophobicContact CD2-CG 4.49Å; Y241-L306 WeakPolarHBondContact CD2-O 3.48Å; Y241-L306 HydrophobicContact CE2-CB 4.31Å; Y241-L306 HydrophobicContact CE2-CD2 4.26Å; Y241-L306 WeakPolarHBondContact CE2-O 3.38Å; Y241-L306 HydrophobicContact CG-CD2 4.49Å; I269-L306 HydrophobicContact CD1-CD2 3.55Å; I274-L306 HydrophobicContact CD1-CD2 4.24Å; I302-L306 PolarHBondContact O-N 3.25Å; L303-L306 WeakPolarHBondContact O-CB 3.29Å; L303-L306 PolarHBondContact O-N 2.92Å; A304-L306 VanDerWaalsContact C-N 3.26Å; A304-L306 PolarHBondContact O-N 2.94Å
307	T	92.7	Very high	92.7	Very high	83 Å²	83	56.1 Å²	56.1	51%	0.509	30%	0.298	S	S	.	.	H	α-helix	trans	-90.6	-37.9	173	50.5	0	0	0	0	113.3	P236 A304 L305	P236-T307 HydrophobicContact CB-CG2 3.56Å; P236-T307 HydrophobicContact CG-CG2 3.44Å; P236-T307 VanDerWaalsContact CG-CG2 3.44Å; A304-T307 PolarHBondContact O-N 3.5Å; A304-T307 PolarHBondContact O-OG1 3.48Å; L305-T307 PolarHBondContact O-N 2.93Å
308	D	92.3	Very high	92.6	Very high	123 Å²	123	52 Å²	52	66%	0.658	28%	0.282	S	S	*	.	S	Bend	trans	-134.6	88.5	-174.8	-172	30.7	0	0	0	110.4	A304 L305 H310	A304-D308 PolarHBondContact O-N 3.22Å; L305-D308 CarbonylContact O-C 3.45Å; L305-D308 VanDerWaalsContact O-C 3.3Å; L305-D308 PolarHBondContact O-N 3.47Å; D308-H310 PolarHBondContact O-N 3.32Å
309	P	92.3	Very high	92.6	Very high	15 Å²	15	52.1 Å²	52.1	10%	0.097	28%	0.282	C	S	.	.			trans	-64	132.5	-179.2	-22.8	33.5	0	0	0	112.1	P272 N273 T311 Y323	P272-P309 HydrophobicContact CB-CB 4.17Å; P272-P309 HydrophobicContact CG-CB 3.76Å; P272-P309 HydrophobicContact CG-CG 4.31Å; N273-P309 WeakPolarHBondContact OD1-CA 3.45Å; P309-T311 PolarHBondContact O-N 3.07Å; P309-T311 VanDerWaalsContact O-N 3.12Å; P309-Y323 HydrophobicContact CG-CE2 4.22Å
310	H	88	Confident	92.5	Very high	91 Å²	91	52.6 Å²	52.6	42%	0.421	29%	0.287	S	S	.	.			trans	-84.6	86.6	176.3	-168.1	66.5	0	0	0	111.1	N273 L305 D308 R312 V313	N273-H310 PolarHBondContact ND2-O 2.98Å; N273-H310 PolarHBondContact OD1-N 3.47Å; L305-H310 HydrophobicContact CD2-CB 4.19Å; D308-H310 PolarHBondContact O-N 3.32Å; H310-R312 PolarHBondContact O-N 3.31Å; H310-V313 PolarHBondContact O-N 3.46Å
311	T	80.4	Confident	92.4	Very high	66 Å²	66	49.5 Å²	49.5	41%	0.405	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-57.3	-22.3	-170.5	56.6	0	0	0	0	115.6	P309 V313 Y323	P309-T311 PolarHBondContact O-N 3.07Å; P309-T311 VanDerWaalsContact O-N 3.12Å; T311-V313 PolarHBondContact O-N 3Å; T311-Y323 HydrophobicContact CG2-CD1 3.56Å; T311-Y323 HydrophobicContact CG2-CE1 3.39Å
312	R	84.7	Confident	92.4	Very high	224 Å²	224	47.9 Å²	47.9	85%	0.845	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-66.9	-23.7	175.5	-60	-177.3	178.9	-174.9	-0.4	113.6	H310	H310-R312 PolarHBondContact O-N 3.31Å
313	V	86.8	Confident	92.4	Very high	37 Å²	37	49.5 Å²	49.5	22%	0.224	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-113.9	63.6	179.5	-176.1	0	0	0	0	108.5	N273 H310 T311	N273-V313 PolarHBondContact ND2-O 3.2Å; H310-V313 PolarHBondContact O-N 3.46Å; T311-V313 PolarHBondContact O-N 3Å
314	C	92.4	Very high	92.3	Very high	42 Å²	42	53.1 Å²	53.1	28%	0.284	29%	0.287	S	S	.	.			trans	-79.1	130.3	175	-165.4	0	0	0	0	110.9	P272 E316 G320	P272-C314 CarbonylContact O-C 3.51Å; P272-C314 VanDerWaalsContact O-CA 3.25Å; P272-C314 WeakPolarHBondContact O-CA 3.49Å; P272-C314 PolarHBondContact O-SG 3.18Å; C314-E316 PolarHBondContact SG-O 2.85Å; C314-G320 WeakPolarHBondContact SG-CA 3.46Å; C314-G320 PolarHBondContact SG-N 3.07Å
315	M	95.1	Very high	92.3	Very high	39 Å²	39	55.1 Å²	55.1	19%	0.192	28%	0.284	C	S	.	.	S	Bend	trans	-80	-32.8	178.5	-69.4	-54.8	-65.3	0	0	112.8	P272 N273 D279 R286	P272-M315 PolarHBondContact O-N 2.92Å; N273-M315 VanDerWaalsContact O-CG 3.3Å; N273-M315 WeakPolarHBondContact O-CG 3.46Å; D279-M315 HydrophobicContact CB-CE 4.11Å; R286-M315 VanDerWaalsContact CZ-SD 3.59Å; R286-M315 PolarHBondContact NH2-SD 3.44Å
316	E	94.9	Very high	92.3	Very high	38 Å²	38	56.7 Å²	56.7	18%	0.178	29%	0.292	C	S	.	.	S	Bend	trans	-127.2	108.9	-177.5	-61.7	-64	170.7	0	0	108.6	S275 F276 C314 V318 I319 G320	S275-E316 WeakPolarHBondContact CA-OE1 3.18Å; S275-E316 WeakPolarHBondContact CB-OE1 3.5Å; F276-E316 HydrophobicContact CD2-CG 3.68Å; F276-E316 WeakPolarHBondContact CD2-OE1 3.46Å; F276-E316 HydrophobicContact CE2-CB 4.13Å; F276-E316 HydrophobicContact CE2-CG 3.76Å; F276-E316 HydrophobicContact CG-CG 4.25Å; F276-E316 HydrophobicContact CZ-CG 4.4Å; F276-E316 PolarHBondContact N-OE1 3.3Å; C314-E316 PolarHBondContact SG-O 2.85Å; E316-V318 HydrophobicContact CB-CG1 4.42Å; E316-V318 PolarHBondContact O-N 3.19Å; E316-I319 HydrophobicContact CB-CB 4.07Å; E316-I319 HydrophobicContact CB-CD1 3.76Å; E316-I319 HydrophobicContact CB-CG1 3.73Å; E316-I319 HydrophobicContact CG-CD1 3.89Å; E316-I319 HydrophobicContact CG-CG1 4.4Å; E316-I319 PolarHBondContact O-N 3.09Å; E316-G320 PolarHBondContact O-N 2.89Å; E316-G320 VanDerWaalsContact O-N 3.09Å
317	P	93.1	Very high	92.3	Very high	98 Å²	98	61.5 Å²	61.5	64%	0.636	31%	0.313	S	S	*	.	H	α-helix	trans	-53	-33.1	-176.8	-28.8	35.1	0	0	0	113.8	A321	P317-A321 WeakPolarHBondContact O-CB 3.36Å; P317-A321 PolarHBondContact O-N 3.49Å
318	V	94.8	Very high	92.4	Very high	14 Å²	14	65.4 Å²	65.4	9%	0.085	32%	0.319	C	S	.	.	H	α-helix	trans	-67.1	-38.6	176.3	68.3	0	0	0	0	112.9	F276 E316 L322 I361 T364 H365 L368	F276-V318 HydrophobicContact CE2-CG1 4.12Å; F276-V318 HydrophobicContact CZ-CG1 4.22Å; E316-V318 HydrophobicContact CB-CG1 4.42Å; E316-V318 PolarHBondContact O-N 3.19Å; V318-L322 WeakPolarHBondContact O-CB 3.35Å; V318-L322 PolarHBondContact O-N 3Å; V318-I361 HydrophobicContact CG1-CG2 4.02Å; V318-I361 HydrophobicContact CG2-CG2 3.98Å; V318-I361 WeakPolarHBondContact CG2-O 3.1Å; V318-T364 HydrophobicContact CG2-CG2 3.83Å; V318-T364 WeakPolarHBondContact O-CG2 3.28Å; V318-H365 HydrophobicContact CG2-CB 3.94Å; V318-L368 HydrophobicContact CB-CD1 4.24Å; V318-L368 HydrophobicContact CG2-CD1 4.43Å
319	I	95.5	Very high	92.6	Very high	2 Å²	2	61.6 Å²	61.6	1%	0.01	30%	0.297	C	S	.	.	H	α-helix	trans	-70.7	-41.7	177.5	-60.1	-178.9	0	0	0	109.6	L270 P272 F276 E316 A321 L322 Y323 F330	L270-I319 HydrophobicContact CD1-CD1 3.89Å; L270-I319 HydrophobicContact CD1-CG1 4.11Å; L270-I319 HydrophobicContact CG-CD1 4.45Å; P272-I319 HydrophobicContact CG-CG2 4.37Å; F276-I319 HydrophobicContact CD1-CD1 4.46Å; F276-I319 HydrophobicContact CE1-CD1 3.76Å; F276-I319 HydrophobicContact CE1-CG1 4.36Å; F276-I319 HydrophobicContact CE2-CD1 4.44Å; F276-I319 HydrophobicContact CZ-CD1 3.74Å; F276-I319 HydrophobicContact CZ-CG1 3.91Å; E316-I319 HydrophobicContact CB-CB 4.07Å; E316-I319 HydrophobicContact CB-CD1 3.76Å; E316-I319 HydrophobicContact CB-CG1 3.73Å; E316-I319 HydrophobicContact CG-CD1 3.89Å; E316-I319 HydrophobicContact CG-CG1 4.4Å; E316-I319 PolarHBondContact O-N 3.09Å; I319-A321 PolarHBondContact O-N 3.06Å; I319-L322 PolarHBondContact O-N 2.94Å; I319-Y323 WeakPolarHBondContact O-CB 3.3Å; I319-Y323 PolarHBondContact O-N 3.32Å; I319-F330 HydrophobicContact CG2-CD2 4.27Å; I319-F330 HydrophobicContact CG2-CE2 3.78Å
320	G	93.9	Very high	92.9	Very high	10 Å²	10	61 Å²	61	10%	0.103	29%	0.294	C	S	.	.	H	α-helix	trans	-59.1	-46.4	174.7	0	0	0	0	0	111.9	C314 E316 L322 Y323 D324	C314-G320 WeakPolarHBondContact SG-CA 3.46Å; C314-G320 PolarHBondContact SG-N 3.07Å; E316-G320 PolarHBondContact O-N 2.89Å; E316-G320 VanDerWaalsContact O-N 3.09Å; G320-L322 PolarHBondContact O-N 3.03Å; G320-Y323 WeakPolarHBondContact O-CB 3.39Å; G320-Y323 PolarHBondContact O-N 2.98Å; G320-D324 WeakPolarHBondContact O-CB 3.43Å; G320-D324 PolarHBondContact O-N 3.25Å
321	A	94	Very high	93.3	Very high	10 Å²	10	59.7 Å²	59.7	8%	0.083	29%	0.287	C	S	.	.	H	α-helix	trans	-61.9	-40.7	175.4	0	0	0	0	0	112.7	P317 I319 D324 W325 T364 L368	P317-A321 WeakPolarHBondContact O-CB 3.36Å; P317-A321 PolarHBondContact O-N 3.49Å; I319-A321 PolarHBondContact O-N 3.06Å; A321-D324 PolarHBondContact O-N 3.1Å; A321-W325 HydrophobicContact CB-CD2 4.2Å; A321-W325 HydrophobicContact CB-CE3 4.28Å; A321-W325 HydrophobicContact CB-CH2 4.12Å; A321-W325 HydrophobicContact CB-CZ2 3.98Å; A321-W325 HydrophobicContact CB-CZ3 4.24Å; A321-W325 WeakPolarHBondContact O-CB 3.41Å; A321-W325 PolarHBondContact O-N 2.97Å; A321-T364 HydrophobicContact CB-CG2 3.83Å; A321-L368 HydrophobicContact CB-CD1 3.84Å; A321-L368 HydrophobicContact CB-CD2 3.87Å; A321-L368 HydrophobicContact CB-CG 4.09Å
322	L	95.2	Very high	94.1	Very high	3 Å²	3	59.7 Å²	59.7	2%	0.016	28%	0.283	C	S	.	.	H	α-helix	trans	-62.9	-44.9	175.7	179.7	59.2	0	0	0	111.1	V318 I319 G320 D324 D326 Q329 F330 L333 T364	V318-L322 WeakPolarHBondContact O-CB 3.35Å; V318-L322 PolarHBondContact O-N 3Å; I319-L322 PolarHBondContact O-N 2.94Å; G320-L322 PolarHBondContact O-N 3.03Å; L322-D324 PolarHBondContact O-N 2.77Å; L322-D326 CarbonylContact O-C 3.55Å; L322-D326 VanDerWaalsContact O-C 3.26Å; L322-D326 PolarHBondContact O-N 3.2Å; L322-D326 VanDerWaalsContact O-O 3.13Å; L322-Q329 HydrophobicContact CD1-CB 4.12Å; L322-F330 HydrophobicContact CG-CB 4.09Å; L322-L333 HydrophobicContact CD2-CD2 4.08Å; L322-T364 HydrophobicContact CB-CG2 4.13Å
323	Y	94.9	Very high	94.7	Very high	36 Å²	36	49.1 Å²	49.1	14%	0.141	24%	0.243	C	C	.	.	H	α-helix	trans	-60	-44.6	176.8	-172.9	-88.2	0	0	0	112.2	P272 P309 T311 I319 G320 K327 F330	P272-Y323 HydrophobicContact CG-CD2 3.92Å; P272-Y323 HydrophobicContact CG-CG 4.17Å; P309-Y323 HydrophobicContact CG-CE2 4.22Å; T311-Y323 HydrophobicContact CG2-CD1 3.56Å; T311-Y323 HydrophobicContact CG2-CE1 3.39Å; I319-Y323 WeakPolarHBondContact O-CB 3.3Å; I319-Y323 PolarHBondContact O-N 3.32Å; G320-Y323 WeakPolarHBondContact O-CB 3.39Å; G320-Y323 PolarHBondContact O-N 2.98Å; Y323-K327 HydrophobicContact CE2-CG 4.38Å; Y323-K327 PolarHBondContact O-N 3.21Å; Y323-K327 WeakPolarHBondContact OH-CE 3.39Å; Y323-F330 AromaticContact CD2-CD1 3.43Å; Y323-F330 HydrophobicContact CD2-CD1 3.43Å; Y323-F330 VanDerWaalsContact CD2-CD1 3.43Å; Y323-F330 HydrophobicContact CD2-CD2 4.14Å; Y323-F330 AromaticContact CD2-CE1 3.56Å; Y323-F330 HydrophobicContact CD2-CE1 3.56Å; Y323-F330 HydrophobicContact CD2-CE2 4.25Å; Y323-F330 AromaticContact CD2-CG 3.75Å; Y323-F330 HydrophobicContact CD2-CG 3.75Å; Y323-F330 AromaticContact CD2-CZ 4Å; Y323-F330 HydrophobicContact CD2-CZ 4Å; Y323-F330 AromaticContact CE2-CD1 3.92Å; Y323-F330 HydrophobicContact CE2-CD1 3.92Å; Y323-F330 AromaticContact CE2-CE1 3.87Å; Y323-F330 HydrophobicContact CE2-CE1 3.87Å; Y323-F330 HydrophobicContact CG-CG 4.48Å
324	D	93	Very high	95.3	Very high	111 Å²	111	47.3 Å²	47.3	59%	0.594	23%	0.232	S	C	*	.	H	α-helix	trans	-76	-35.9	-177.4	-71.1	-18.2	0	0	0	113	G320 A321 L322	G320-D324 WeakPolarHBondContact O-CB 3.43Å; G320-D324 PolarHBondContact O-N 3.25Å; A321-D324 PolarHBondContact O-N 3.1Å; L322-D324 PolarHBondContact O-N 2.77Å
325	W	94.1	Very high	95.5	Very high	93 Å²	93	49.7 Å²	49.7	35%	0.352	24%	0.238	S	C	.	.	H	α-helix	trans	-83.1	-39.1	-177.4	-63.5	-10	0	0	0	113	A321 T364 R367 L368 K371	A321-W325 HydrophobicContact CB-CD2 4.2Å; A321-W325 HydrophobicContact CB-CE3 4.28Å; A321-W325 HydrophobicContact CB-CH2 4.12Å; A321-W325 HydrophobicContact CB-CZ2 3.98Å; A321-W325 HydrophobicContact CB-CZ3 4.24Å; A321-W325 WeakPolarHBondContact O-CB 3.41Å; A321-W325 PolarHBondContact O-N 2.97Å; W325-T364 HydrophobicContact CE3-CG2 3.83Å; W325-T364 HydrophobicContact CH2-CG2 4.48Å; W325-T364 HydrophobicContact CZ3-CG2 3.59Å; W325-R367 HydrophobicContact CH2-CB 3.95Å; W325-R367 HydrophobicContact CZ3-CB 3.59Å; W325-L368 HydrophobicContact CH2-CB 4.41Å; W325-L368 HydrophobicContact CH2-CD2 3.41Å; W325-L368 VanDerWaalsContact CH2-CD2 3.41Å; W325-L368 HydrophobicContact CH2-CG 3.54Å; W325-L368 HydrophobicContact CZ2-CD2 3.54Å; W325-L368 HydrophobicContact CZ2-CG 4.2Å; W325-L368 HydrophobicContact CZ3-CD2 4.48Å; W325-L368 HydrophobicContact CZ3-CG 4.26Å; W325-K371 HydrophobicContact CH2-CD 4.44Å; W325-K371 HydrophobicContact CZ2-CD 4.15Å; W325-K371 VanDerWaalsContact CZ2-NZ 3.33Å
326	D	94.6	Very high	95.7	Very high	52 Å²	52	49.7 Å²	49.7	28%	0.278	24%	0.238	S	C	.	.			trans	-150.7	83	-177.4	-165.9	-27.1	0	0	0	110.6	L322 Y328 Q329 F330	L322-D326 CarbonylContact O-C 3.55Å; L322-D326 VanDerWaalsContact O-C 3.26Å; L322-D326 PolarHBondContact O-N 3.2Å; L322-D326 VanDerWaalsContact O-O 3.13Å; D326-Y328 PolarHBondContact O-N 3.3Å; D326-Y328 WeakPolarHBondContact OD1-CB 3.3Å; D326-Y328 PolarHBondContact OD1-N 3Å; D326-Y328 VanDerWaalsContact OD1-N 3.17Å; D326-Q329 HydrophobicContact CB-CB 4.05Å; D326-Q329 HydrophobicContact CB-CG 4.29Å; D326-Q329 PolarHBondContact O-N 2.92Å; D326-Q329 PolarHBondContact OD1-N 2.78Å; D326-Q329 VanDerWaalsContact OD2-CG 3.26Å; D326-Q329 WeakPolarHBondContact OD2-CG 3.33Å; D326-Q329 PolarHBondContact OD2-NE2 2.94Å; D326-F330 PolarHBondContact O-N 2.78Å
327	K	94.7	Very high	95.8	Very high	104 Å²	104	48.4 Å²	48.4	45%	0.452	23%	0.232	S	C	.	.	H	α-helix	trans	-56.7	-32.3	177.5	-168.1	-178.7	-175.7	-165	0	112.4	Y323 F330 E331	Y323-K327 HydrophobicContact CE2-CG 4.38Å; Y323-K327 PolarHBondContact O-N 3.21Å; Y323-K327 WeakPolarHBondContact OH-CE 3.39Å; K327-F330 PolarHBondContact O-N 2.93Å; K327-E331 WeakPolarHBondContact CE-OE1 3.44Å; K327-E331 HydrophobicContact CG-CG 4.45Å; K327-E331 IonicContact NZ-OE1 2.76Å; K327-E331 WeakPolarHBondContact O-CB 3.46Å; K327-E331 WeakPolarHBondContact O-CG 3.39Å; K327-E331 PolarHBondContact O-N 3.34Å
328	Y	96.5	Very high	96.1	Very high	165 Å²	165	43.8 Å²	43.8	65%	0.647	20%	0.202	S	C	*	.	H	α-helix	trans	-66.9	-49.6	178.8	175.7	-88.5	0	0	0	110.9	D326 F330 E331 E332	D326-Y328 PolarHBondContact O-N 3.3Å; D326-Y328 WeakPolarHBondContact OD1-CB 3.3Å; D326-Y328 PolarHBondContact OD1-N 3Å; D326-Y328 VanDerWaalsContact OD1-N 3.17Å; Y328-F330 VanDerWaalsContact C-N 3.3Å; Y328-F330 PolarHBondContact O-N 3.21Å; Y328-E331 PolarHBondContact O-N 3.31Å; Y328-E332 WeakPolarHBondContact CE1-OE2 3.42Å; Y328-E332 WeakPolarHBondContact O-CB 3.39Å; Y328-E332 PolarHBondContact O-N 2.92Å
329	Q	96.1	Very high	96.2	Very high	43 Å²	43	48.8 Å²	48.8	20%	0.201	22%	0.219	C	C	.	.	H	α-helix	trans	-61.9	-38.5	175	-77.1	-177.6	33.7	0	0	112.3	L322 D326 L333 Y360	L322-Q329 HydrophobicContact CD1-CB 4.12Å; D326-Q329 HydrophobicContact CB-CB 4.05Å; D326-Q329 HydrophobicContact CB-CG 4.29Å; D326-Q329 PolarHBondContact O-N 2.92Å; D326-Q329 PolarHBondContact OD1-N 2.78Å; D326-Q329 VanDerWaalsContact OD2-CG 3.26Å; D326-Q329 WeakPolarHBondContact OD2-CG 3.33Å; D326-Q329 PolarHBondContact OD2-NE2 2.94Å; Q329-L333 WeakPolarHBondContact O-CB 3.34Å; Q329-L333 PolarHBondContact O-N 2.78Å; Q329-Y360 HydrophobicContact CB-CD2 3.98Å; Q329-Y360 HydrophobicContact CB-CE2 4.17Å; Q329-Y360 HydrophobicContact CG-CD2 4.31Å; Q329-Y360 HydrophobicContact CG-CE2 4.15Å
330	F	97.1	Very high	96.3	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.018	23%	0.227	C	C	.	.	H	α-helix	trans	-57.6	-52.7	172.8	170.1	-93	0	0	0	111.3	L270 P272 I319 L322 Y323 D326 K327 Y328 E332 L333 A334	L270-F330 HydrophobicContact CD2-CD2 4.03Å; L270-F330 HydrophobicContact CD2-CE2 3.92Å; L270-F330 HydrophobicContact CG-CE2 4.21Å; P272-F330 HydrophobicContact CG-CE2 4.23Å; P272-F330 HydrophobicContact CG-CZ 4.14Å; I319-F330 HydrophobicContact CG2-CD2 4.27Å; I319-F330 HydrophobicContact CG2-CE2 3.78Å; L322-F330 HydrophobicContact CG-CB 4.09Å; Y323-F330 AromaticContact CD2-CD1 3.43Å; Y323-F330 HydrophobicContact CD2-CD1 3.43Å; Y323-F330 VanDerWaalsContact CD2-CD1 3.43Å; Y323-F330 HydrophobicContact CD2-CD2 4.14Å; Y323-F330 AromaticContact CD2-CE1 3.56Å; Y323-F330 HydrophobicContact CD2-CE1 3.56Å; Y323-F330 HydrophobicContact CD2-CE2 4.25Å; Y323-F330 AromaticContact CD2-CG 3.75Å; Y323-F330 HydrophobicContact CD2-CG 3.75Å; Y323-F330 AromaticContact CD2-CZ 4Å; Y323-F330 HydrophobicContact CD2-CZ 4Å; Y323-F330 AromaticContact CE2-CD1 3.92Å; Y323-F330 HydrophobicContact CE2-CD1 3.92Å; Y323-F330 AromaticContact CE2-CE1 3.87Å; Y323-F330 HydrophobicContact CE2-CE1 3.87Å; Y323-F330 HydrophobicContact CG-CG 4.48Å; D326-F330 PolarHBondContact O-N 2.78Å; K327-F330 PolarHBondContact O-N 2.93Å; Y328-F330 VanDerWaalsContact C-N 3.3Å; Y328-F330 PolarHBondContact O-N 3.21Å; F330-E332 VanDerWaalsContact C-N 3.35Å; F330-E332 PolarHBondContact O-N 3.3Å; F330-L333 PolarHBondContact O-N 3.29Å; F330-A334 HydrophobicContact CE1-CB 4.33Å; F330-A334 HydrophobicContact CZ-CB 4.28Å; F330-A334 VanDerWaalsContact O-CB 3.27Å; F330-A334 WeakPolarHBondContact O-CB 3.37Å; F330-A334 PolarHBondContact O-N 3.29Å
331	E	97	Very high	96.5	Very high	62 Å²	62	50.3 Å²	50.3	29%	0.29	22%	0.223	S	C	.	.	H	α-helix	trans	-64.9	-38.1	-177.5	-76.5	-177	-169	0	0	112.2	K327 Y328 K335	K327-E331 WeakPolarHBondContact CE-OE1 3.44Å; K327-E331 HydrophobicContact CG-CG 4.45Å; K327-E331 IonicContact NZ-OE1 2.76Å; K327-E331 WeakPolarHBondContact O-CB 3.46Å; K327-E331 WeakPolarHBondContact O-CG 3.39Å; K327-E331 PolarHBondContact O-N 3.34Å; Y328-E331 PolarHBondContact O-N 3.31Å; E331-K335 VanDerWaalsContact O-CG 3.27Å; E331-K335 WeakPolarHBondContact O-CG 3.32Å; E331-K335 PolarHBondContact O-N 3.03Å
332	E	97.4	Very high	96.7	Very high	67 Å²	67	50 Å²	50	31%	0.313	22%	0.22	S	C	.	.	H	α-helix	trans	-61.6	-50.9	174	-176.4	176.3	178.3	0	0	111.1	Y328 F330 A334 K335 L336	Y328-E332 WeakPolarHBondContact CE1-OE2 3.42Å; Y328-E332 WeakPolarHBondContact O-CB 3.39Å; Y328-E332 PolarHBondContact O-N 2.92Å; F330-E332 VanDerWaalsContact C-N 3.35Å; F330-E332 PolarHBondContact O-N 3.3Å; E332-A334 VanDerWaalsContact C-N 3.35Å; E332-A334 PolarHBondContact O-N 3.48Å; E332-K335 WeakPolarHBondContact O-CB 3.31Å; E332-K335 PolarHBondContact O-N 3.37Å; E332-L336 WeakPolarHBondContact O-CG 3.42Å; E332-L336 PolarHBondContact O-N 3.07Å; E332-L336 VanDerWaalsContact O-N 3.09Å
333	L	97.9	Very high	96.8	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-65.2	-38.5	179.2	-177.5	66.4	0	0	0	112.1	L270 L322 Q329 F330 K335 L336 W337 P358 Y360 I361	L270-L333 HydrophobicContact CD1-CD2 4.24Å; L270-L333 HydrophobicContact CD2-CB 4Å; L270-L333 HydrophobicContact CD2-CD2 3.7Å; L270-L333 HydrophobicContact CD2-CG 3.76Å; L322-L333 HydrophobicContact CD2-CD2 4.08Å; Q329-L333 WeakPolarHBondContact O-CB 3.34Å; Q329-L333 PolarHBondContact O-N 2.78Å; F330-L333 PolarHBondContact O-N 3.29Å; L333-K335 VanDerWaalsContact C-N 3.32Å; L333-K335 PolarHBondContact O-N 2.72Å; L333-L336 PolarHBondContact O-N 2.97Å; L333-W337 PolarHBondContact O-N 3.5Å; L333-P358 HydrophobicContact CD1-CG 3.86Å; L333-Y360 HydrophobicContact CB-CD2 4.03Å; L333-I361 HydrophobicContact CD2-CD1 4.08Å; L333-I361 HydrophobicContact CD2-CG1 3.7Å
334	A	98.1	Very high	96.9	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.5	-37.9	176.5	0	0	0	0	0	112	P240 Y241 L270 F330 E332 T338	P240-A334 HydrophobicContact CB-CB 3.7Å; P240-A334 HydrophobicContact CG-CB 3.97Å; Y241-A334 HydrophobicContact CE1-CB 4.16Å; L270-A334 HydrophobicContact CB-CB 4.45Å; L270-A334 HydrophobicContact CD2-CB 4.1Å; F330-A334 HydrophobicContact CE1-CB 4.33Å; F330-A334 HydrophobicContact CZ-CB 4.28Å; F330-A334 VanDerWaalsContact O-CB 3.27Å; F330-A334 WeakPolarHBondContact O-CB 3.37Å; F330-A334 PolarHBondContact O-N 3.29Å; E332-A334 VanDerWaalsContact C-N 3.35Å; E332-A334 PolarHBondContact O-N 3.48Å; A334-T338 WeakPolarHBondContact O-CB 3.4Å; A334-T338 PolarHBondContact O-N 2.87Å; A334-T338 PolarHBondContact O-OG1 2.86Å
335	K	97.9	Very high	96.9	Very high	91 Å²	91	44.6 Å²	44.6	40%	0.396	19%	0.194	S	C	.	.	H	α-helix	trans	-63.2	-46.8	172.2	-73.5	165.8	-173.3	165.1	0	111.6	P240 E331 E332 L333 W337 T338 W339	P240-K335 HydrophobicContact CB-CG 3.68Å; P240-K335 WeakPolarHBondContact O-CA 3.25Å; P240-K335 WeakPolarHBondContact O-CG 3.44Å; E331-K335 VanDerWaalsContact O-CG 3.27Å; E331-K335 WeakPolarHBondContact O-CG 3.32Å; E331-K335 PolarHBondContact O-N 3.03Å; E332-K335 WeakPolarHBondContact O-CB 3.31Å; E332-K335 PolarHBondContact O-N 3.37Å; L333-K335 VanDerWaalsContact C-N 3.32Å; L333-K335 PolarHBondContact O-N 2.72Å; K335-W337 PolarHBondContact O-N 3.1Å; K335-T338 WeakPolarHBondContact O-CB 3.45Å; K335-T338 PolarHBondContact O-N 3.34Å; K335-W339 PolarHBondContact O-N 3.37Å
336	L	98.1	Very high	96.8	Very high	39 Å²	39	47 Å²	47	20%	0.204	20%	0.203	C	C	.	.	H	α-helix	trans	-64	-40.6	178.8	-66.4	174.4	0	0	0	112.2	E332 L333 T338 W339 K340 L357 P358	E332-L336 WeakPolarHBondContact O-CG 3.42Å; E332-L336 PolarHBondContact O-N 3.07Å; E332-L336 VanDerWaalsContact O-N 3.09Å; L333-L336 PolarHBondContact O-N 2.97Å; L336-T338 VanDerWaalsContact C-N 3.34Å; L336-W339 HydrophobicContact CD2-CE3 4.31Å; L336-W339 PolarHBondContact O-N 2.99Å; L336-K340 WeakPolarHBondContact O-CB 3.35Å; L336-K340 PolarHBondContact O-N 3.5Å; L336-L357 HydrophobicContact CB-CD2 3.67Å; L336-P358 HydrophobicContact CD1-CG 3.91Å
337	W	98.3	Very high	96.7	Very high	12 Å²	12	46.5 Å²	46.5	5%	0.045	20%	0.201	C	C	.	.	H	α-helix	trans	-60.9	-43.3	172.2	-90.8	58.1	0	0	0	111.9	R268 L270 F276 L333 K335 K340 F341 L357 I361	R268-W337 HydrophobicContact CB-CE3 4.36Å; R268-W337 HydrophobicContact CB-CZ3 4.14Å; L270-W337 HydrophobicContact CB-CB 4.2Å; L270-W337 HydrophobicContact CB-CD2 3.86Å; L270-W337 HydrophobicContact CB-CE3 4Å; L270-W337 HydrophobicContact CB-CG 3.96Å; L270-W337 HydrophobicContact CD1-CD2 4.41Å; L270-W337 HydrophobicContact CD1-CZ2 4.24Å; F276-W337 AromaticContact CD1-CH2 3.88Å; F276-W337 HydrophobicContact CD1-CH2 3.88Å; F276-W337 HydrophobicContact CD1-CZ3 4.48Å; F276-W337 AromaticContact CE1-CH2 3.8Å; F276-W337 HydrophobicContact CE1-CH2 3.8Å; F276-W337 HydrophobicContact CE1-CZ2 4.36Å; L333-W337 PolarHBondContact O-N 3.5Å; K335-W337 PolarHBondContact O-N 3.1Å; W337-K340 PolarHBondContact O-N 2.98Å; W337-F341 HydrophobicContact CB-CD2 4.19Å; W337-F341 HydrophobicContact CB-CE2 4.49Å; W337-F341 AromaticContact CD2-CD2 3.95Å; W337-F341 HydrophobicContact CD2-CD2 3.95Å; W337-F341 AromaticContact CD2-CE2 3.65Å; W337-F341 HydrophobicContact CD2-CE2 3.65Å; W337-F341 AromaticContact CE3-CD2 3.77Å; W337-F341 HydrophobicContact CE3-CD2 3.77Å; W337-F341 AromaticContact CE3-CE2 3.73Å; W337-F341 HydrophobicContact CE3-CE2 3.73Å; W337-F341 HydrophobicContact CG-CD2 4.16Å; W337-F341 HydrophobicContact CG-CE2 4Å; W337-F341 HydrophobicContact CZ3-CE2 4.27Å; W337-F341 WeakPolarHBondContact O-CB 3.48Å; W337-F341 VanDerWaalsContact O-CD2 3.32Å; W337-F341 WeakPolarHBondContact O-CD2 3.5Å; W337-F341 PolarHBondContact O-N 3.43Å; W337-L357 HydrophobicContact CG-CD1 4.39Å; W337-I361 HydrophobicContact CZ2-CD1 3.77Å
338	T	98.5	Very high	96.7	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.006	20%	0.198	C	C	.	.	H	α-helix	trans	-60.4	-47.2	177.4	-60.7	0	0	0	0	110.7	P240 Y241 F246 A334 K335 L336 K340 A342 C343	P240-T338 PolarHBondContact O-OG1 3.25Å; Y241-T338 WeakPolarHBondContact CD1-OG1 3.47Å; Y241-T338 WeakPolarHBondContact O-CG2 3.45Å; F246-T338 HydrophobicContact CZ-CG2 4.01Å; A334-T338 WeakPolarHBondContact O-CB 3.4Å; A334-T338 PolarHBondContact O-N 2.87Å; A334-T338 PolarHBondContact O-OG1 2.86Å; K335-T338 WeakPolarHBondContact O-CB 3.45Å; K335-T338 PolarHBondContact O-N 3.34Å; L336-T338 VanDerWaalsContact C-N 3.34Å; T338-K340 PolarHBondContact O-N 2.9Å; T338-A342 HydrophobicContact CG2-CB 4.32Å; T338-A342 CarbonylContact O-C 3.52Å; T338-A342 WeakPolarHBondContact O-CA 3.18Å; T338-A342 WeakPolarHBondContact O-CB 3.25Å; T338-A342 PolarHBondContact O-N 2.86Å; T338-C343 PolarHBondContact O-N 3.07Å; T338-C343 VanDerWaalsContact O-N 3.12Å
339	W	97.8	Very high	96.6	Very high	119 Å²	119	37 Å²	37	45%	0.451	17%	0.173	S	C	.	.	H	α-helix	trans	-61.2	-45.7	176.2	-69.7	0.1	0	0	0	112.2	K335 L336 L347 M355	K335-W339 PolarHBondContact O-N 3.37Å; L336-W339 HydrophobicContact CD2-CE3 4.31Å; L336-W339 PolarHBondContact O-N 2.99Å; W339-L347 HydrophobicContact CB-CD1 3.76Å; W339-L347 HydrophobicContact CG-CD1 4.21Å; W339-L347 WeakPolarHBondContact O-CD1 3.41Å; W339-M355 HydrophobicContact CB-CE 3.86Å; W339-M355 HydrophobicContact CB-SD 4.22Å; W339-M355 HydrophobicContact CE3-CE 4.23Å
340	K	97.8	Very high	96.5	Very high	38 Å²	38	39.5 Å²	39.5	17%	0.165	19%	0.187	C	C	.	.	H	α-helix	trans	-67.3	-40.7	-177.7	-170.4	164.8	-177.2	155.9	0	113.3	L336 W337 T338 H344 V352 M355 L357	L336-K340 WeakPolarHBondContact O-CB 3.35Å; L336-K340 PolarHBondContact O-N 3.5Å; W337-K340 PolarHBondContact O-N 2.98Å; T338-K340 PolarHBondContact O-N 2.9Å; K340-H344 PolarHBondContact O-CE1 3.43Å; K340-H344 VanDerWaalsContact O-CE1 3.26Å; K340-V352 HydrophobicContact CG-CG1 4.42Å; K340-V352 VanDerWaalsContact O-CG1 3.27Å; K340-V352 WeakPolarHBondContact O-CG1 3.48Å; K340-M355 HydrophobicContact CB-SD 3.75Å; K340-M355 HydrophobicContact CG-SD 4.44Å; K340-M355 PolarHBondContact NZ-O 3.01Å; K340-L357 HydrophobicContact CB-CD2 4.41Å; K340-L357 HydrophobicContact CD-CD1 3.77Å; K340-L357 HydrophobicContact CD-CD2 4.16Å; K340-L357 HydrophobicContact CD-CG 3.8Å
341	F	98.2	Very high	96.4	Very high	6 Å²	6	44 Å²	44	3%	0.026	21%	0.207	C	C	.	.	H	α-helix	trans	-110.8	-20	-166.6	-58	-54	0	0	0	114.6	S173 T267 R268 W337 H344 L357	S173-F341 WeakPolarHBondContact CB-O 3.18Å; S173-F341 WeakPolarHBondContact OG-CA 3.25Å; S173-F341 PolarHBondContact OG-O 2.87Å; T267-F341 HydrophobicContact CG2-CB 4.46Å; T267-F341 VanDerWaalsContact CG2-O 3.25Å; T267-F341 WeakPolarHBondContact CG2-O 3.49Å; R268-F341 HydrophobicContact CB-CB 4.08Å; R268-F341 HydrophobicContact CB-CD1 4.45Å; R268-F341 HydrophobicContact CB-CD2 3.85Å; R268-F341 HydrophobicContact CB-CE2 4.39Å; R268-F341 HydrophobicContact CB-CG 3.88Å; W337-F341 HydrophobicContact CB-CD2 4.19Å; W337-F341 HydrophobicContact CB-CE2 4.49Å; W337-F341 AromaticContact CD2-CD2 3.95Å; W337-F341 HydrophobicContact CD2-CD2 3.95Å; W337-F341 AromaticContact CD2-CE2 3.65Å; W337-F341 HydrophobicContact CD2-CE2 3.65Å; W337-F341 AromaticContact CE3-CD2 3.77Å; W337-F341 HydrophobicContact CE3-CD2 3.77Å; W337-F341 AromaticContact CE3-CE2 3.73Å; W337-F341 HydrophobicContact CE3-CE2 3.73Å; W337-F341 HydrophobicContact CG-CD2 4.16Å; W337-F341 HydrophobicContact CG-CE2 4Å; W337-F341 HydrophobicContact CZ3-CE2 4.27Å; W337-F341 WeakPolarHBondContact O-CB 3.48Å; W337-F341 VanDerWaalsContact O-CD2 3.32Å; W337-F341 WeakPolarHBondContact O-CD2 3.5Å; W337-F341 PolarHBondContact O-N 3.43Å; F341-H344 PolarHBondContact O-CD2 2.61Å; F341-H344 PolarHBondContact O-NE2 2.88Å; F341-H344 VanDerWaalsContact O-NE2 3.07Å; F341-L357 HydrophobicContact CE2-CD1 3.86Å; F341-L357 HydrophobicContact CZ-CD1 3.98Å
342	A	98.1	Very high	96.4	Very high	3 Å²	3	41.1 Å²	41.1	3%	0.025	19%	0.194	C	C	.	.	H	α-helix	trans	-125	-13.6	-171.3	0	0	0	0	0	114.7	F245 F246 T267 T338	F245-A342 PolarHBondContact N-O 3.48Å; F246-A342 HydrophobicContact CD1-CB 3.92Å; F246-A342 HydrophobicContact CE1-CB 3.53Å; F246-A342 HydrophobicContact CE2-CB 4.39Å; F246-A342 HydrophobicContact CZ-CB 3.8Å; T267-A342 HydrophobicContact CG2-CB 3.89Å; T338-A342 HydrophobicContact CG2-CB 4.32Å; T338-A342 CarbonylContact O-C 3.52Å; T338-A342 WeakPolarHBondContact O-CA 3.18Å; T338-A342 WeakPolarHBondContact O-CB 3.25Å; T338-A342 PolarHBondContact O-N 2.86Å
343	C	97.1	Very high	96.3	Very high	5 Å²	5	40.4 Å²	40.4	3%	0.034	20%	0.196	C	C	.	.			trans	-99.2	32	-178.4	-65	0	0	0	0	114.2	G243 T338 D345 Y346 L347	G243-C343 PolarHBondContact O-SG 3.17Å; T338-C343 PolarHBondContact O-N 3.07Å; T338-C343 VanDerWaalsContact O-N 3.12Å; C343-D345 PolarHBondContact O-N 2.95Å; C343-Y346 PolarHBondContact O-N 2.92Å; C343-L347 HydrophobicContact CB-CD1 3.73Å; C343-L347 HydrophobicContact CB-CG 3.96Å; C343-L347 WeakPolarHBondContact O-CB 3.43Å; C343-L347 PolarHBondContact O-N 3.35Å
344	H	96.4	Very high	96.2	Very high	15 Å²	15	44 Å²	44	7%	0.069	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-17.2	-179	-63.9	-58	0	0	0	114.1	F154 L166 M170 S173 K340 F341	F154-H344 HydrophobicContact CE2-CB 3.86Å; F154-H344 HydrophobicContact CZ-CB 4.38Å; L166-H344 HydrophobicContact CD1-CB 3.89Å; M170-H344 HydrophobicContact CG-CB 4.38Å; S173-H344 PolarHBondContact OG-CE1 3.34Å; S173-H344 PolarHBondContact OG-NE2 2.68Å; K340-H344 PolarHBondContact O-CE1 3.43Å; K340-H344 VanDerWaalsContact O-CE1 3.26Å; F341-H344 PolarHBondContact O-CD2 2.61Å; F341-H344 PolarHBondContact O-NE2 2.88Å; F341-H344 VanDerWaalsContact O-NE2 3.07Å
345	D	93.5	Very high	96.1	Very high	17 Å²	17	45 Å²	45	9%	0.091	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-18.2	178.5	60	-32.8	0	0	0	113.2	F154 N157 C158 C343	F154-D345 HydrophobicContact CE2-CB 3.89Å; N157-D345 WeakPolarHBondContact CA-O 3.25Å; N157-D345 WeakPolarHBondContact CB-O 3.29Å; N157-D345 PolarHBondContact N-O 3.46Å; N157-D345 PolarHBondContact ND2-OD2 3.44Å; C158-D345 PolarHBondContact N-O 2.74Å; C343-D345 PolarHBondContact O-N 2.95Å
346	Y	91.6	Very high	96	Very high	142 Å²	142	46.8 Å²	46.8	56%	0.557	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.6	-33.8	-179.1	-71.2	-77.8	0	0	0	114.1	N157 C343	N157-Y346 HydrophobicContact CB-CD1 4.17Å; N157-Y346 HydrophobicContact CB-CE1 3.94Å; N157-Y346 WeakPolarHBondContact ND2-CE2 3.35Å; N157-Y346 PolarHBondContact ND2-OH 2.83Å; C343-Y346 PolarHBondContact O-N 2.92Å
347	L	93.1	Very high	95.9	Very high	43 Å²	43	46.9 Å²	46.9	23%	0.225	25%	0.25	C	C	.	.	S	Bend	trans	-94.3	143.8	-176.4	-61.1	177.4	0	0	0	111	W339 C343 F351 V352	W339-L347 HydrophobicContact CB-CD1 3.76Å; W339-L347 HydrophobicContact CG-CD1 4.21Å; W339-L347 WeakPolarHBondContact O-CD1 3.41Å; C343-L347 HydrophobicContact CB-CD1 3.73Å; C343-L347 HydrophobicContact CB-CG 3.96Å; C343-L347 WeakPolarHBondContact O-CB 3.43Å; C343-L347 PolarHBondContact O-N 3.35Å; L347-F351 HydrophobicContact CB-CD1 4.22Å; L347-F351 HydrophobicContact CD1-CD1 4.09Å; L347-F351 HydrophobicContact CD1-CE1 3.98Å; L347-F351 HydrophobicContact CD2-CD1 4.14Å; L347-F351 HydrophobicContact CD2-CE1 4.11Å; L347-F351 HydrophobicContact CG-CD1 4.39Å; L347-V352 HydrophobicContact CB-CG2 3.73Å; L347-V352 HydrophobicContact CD1-CG2 4.21Å
348	S	93.8	Very high	95.8	Very high	55 Å²	55	48.1 Å²	48.1	39%	0.385	26%	0.259	S	S	.	.			trans	-66.8	146.5	175.3	68.5	0	0	0	0	111	D350 F351 V352	S348-D350 VanDerWaalsContact C-N 3.26Å; S348-D350 PolarHBondContact O-N 3.29Å; S348-F351 PolarHBondContact O-N 3.39Å; S348-F351 VanDerWaalsContact O-N 3.17Å; S348-F351 VanDerWaalsContact OG-CB 3.29Å; S348-F351 WeakPolarHBondContact OG-CB 3.29Å; S348-F351 PolarHBondContact OG-N 2.7Å; S348-V352 PolarHBondContact O-N 2.99Å; S348-V352 VanDerWaalsContact O-N 3.11Å
349	A	94.8	Very high	95.7	Very high	15 Å²	15	52 Å²	52	12%	0.124	28%	0.28	C	S	.	.	H	α-helix	trans	-58.6	-39.8	179.9	0	0	0	0	0	111.8	L165 L166 N169 F351 V352 S353	L165-A349 HydrophobicContact CB-CB 3.94Å; L165-A349 HydrophobicContact CD2-CB 3.88Å; L165-A349 HydrophobicContact CG-CB 3.89Å; L166-A349 HydrophobicContact CB-CB 4.33Å; N169-A349 PolarHBondContact ND2-O 3.13Å; A349-F351 PolarHBondContact O-N 3.5Å; A349-V352 PolarHBondContact O-N 2.77Å; A349-S353 WeakPolarHBondContact O-CB 3.25Å; A349-S353 PolarHBondContact O-N 3.15Å; A349-S353 PolarHBondContact O-OG 3.44Å
350	D	94.8	Very high	95.5	Very high	94 Å²	94	48.4 Å²	48.4	50%	0.503	27%	0.267	S	S	.	.	H	α-helix	trans	-61.8	-43	176.9	-71.3	-28.6	0	0	0	112.6	L165 S348 S353 A354	L165-D350 HydrophobicContact CD2-CB 4.48Å; L165-D350 WeakPolarHBondContact CD2-OD1 3.28Å; S348-D350 VanDerWaalsContact C-N 3.26Å; S348-D350 PolarHBondContact O-N 3.29Å; D350-S353 PolarHBondContact O-N 3.18Å; D350-A354 WeakPolarHBondContact O-CB 3.45Å; D350-A354 PolarHBondContact O-N 3.29Å
351	F	95.3	Very high	95.3	Very high	98 Å²	98	48 Å²	48	43%	0.43	27%	0.266	S	S	.	.	H	α-helix	trans	-62.9	-45.4	178.4	176	-97.9	0	0	0	111.3	L347 S348 A349 A354 M355	L347-F351 HydrophobicContact CB-CD1 4.22Å; L347-F351 HydrophobicContact CD1-CD1 4.09Å; L347-F351 HydrophobicContact CD1-CE1 3.98Å; L347-F351 HydrophobicContact CD2-CD1 4.14Å; L347-F351 HydrophobicContact CD2-CE1 4.11Å; L347-F351 HydrophobicContact CG-CD1 4.39Å; S348-F351 PolarHBondContact O-N 3.39Å; S348-F351 VanDerWaalsContact O-N 3.17Å; S348-F351 VanDerWaalsContact OG-CB 3.29Å; S348-F351 WeakPolarHBondContact OG-CB 3.29Å; S348-F351 PolarHBondContact OG-N 2.7Å; A349-F351 PolarHBondContact O-N 3.5Å; F351-A354 PolarHBondContact O-N 3.34Å; F351-M355 HydrophobicContact CD1-CE 4.02Å; F351-M355 HydrophobicContact CE1-CE 3.27Å; F351-M355 HydrophobicContact CZ-CE 3.82Å; F351-M355 PolarHBondContact O-N 2.97Å
352	V	95.8	Very high	95.1	Very high	3 Å²	3	53 Å²	53	2%	0.018	29%	0.289	C	S	.	.	H	α-helix	trans	-63.4	-43.5	178.2	173.5	0	0	0	0	111.2	N169 K340 L347 S348 A349 A354 M355	N169-V352 HydrophobicContact CB-CG1 4.07Å; K340-V352 HydrophobicContact CG-CG1 4.42Å; K340-V352 VanDerWaalsContact O-CG1 3.27Å; K340-V352 WeakPolarHBondContact O-CG1 3.48Å; L347-V352 HydrophobicContact CB-CG2 3.73Å; L347-V352 HydrophobicContact CD1-CG2 4.21Å; S348-V352 PolarHBondContact O-N 2.99Å; S348-V352 VanDerWaalsContact O-N 3.11Å; A349-V352 PolarHBondContact O-N 2.77Å; V352-A354 VanDerWaalsContact C-N 3.29Å; V352-A354 PolarHBondContact O-N 3.21Å; V352-M355 WeakPolarHBondContact O-CB 3.32Å; V352-M355 PolarHBondContact O-N 2.8Å; V352-M355 VanDerWaalsContact O-N 3.15Å
353	S	94.9	Very high	94.9	Very high	52 Å²	52	55.6 Å²	55.6	36%	0.364	30%	0.301	S	S	.	.	H	α-helix	trans	-64.8	-32.7	178.6	-58.6	0	0	0	0	112.9	L165 N169 A349 D350 M355	L165-S353 VanDerWaalsContact CD1-OG 3.27Å; L165-S353 WeakPolarHBondContact CD1-OG 3.38Å; L165-S353 WeakPolarHBondContact CG-OG 3.3Å; N169-S353 VanDerWaalsContact CG-OG 3.28Å; N169-S353 PolarHBondContact ND2-OG 3.44Å; N169-S353 VanDerWaalsContact ND2-OG 3.07Å; N169-S353 PolarHBondContact OD1-OG 2.73Å; A349-S353 WeakPolarHBondContact O-CB 3.25Å; A349-S353 PolarHBondContact O-N 3.15Å; A349-S353 PolarHBondContact O-OG 3.44Å; D350-S353 PolarHBondContact O-N 3.18Å; S353-M355 VanDerWaalsContact C-N 3.31Å
354	A	96.4	Very high	94.7	Very high	77 Å²	77	55.6 Å²	55.6	64%	0.636	30%	0.301	S	S	*	.	H	α-helix	trans	-79	-11.7	176.8	0	0	0	0	0	113.7	D350 F351 V352 V356	D350-A354 WeakPolarHBondContact O-CB 3.45Å; D350-A354 PolarHBondContact O-N 3.29Å; F351-A354 PolarHBondContact O-N 3.34Å; V352-A354 VanDerWaalsContact C-N 3.29Å; V352-A354 PolarHBondContact O-N 3.21Å; A354-V356 PolarHBondContact O-N 3.46Å
355	M	96.4	Very high	94.6	Very high	21 Å²	21	59.5 Å²	59.5	10%	0.103	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-71.4	121.8	-174.3	-171.1	177.1	-64.3	0	0	112.3	W339 K340 F351 V352 S353	W339-M355 HydrophobicContact CB-CE 3.86Å; W339-M355 HydrophobicContact CB-SD 4.22Å; W339-M355 HydrophobicContact CE3-CE 4.23Å; K340-M355 HydrophobicContact CB-SD 3.75Å; K340-M355 HydrophobicContact CG-SD 4.44Å; K340-M355 PolarHBondContact NZ-O 3.01Å; F351-M355 HydrophobicContact CD1-CE 4.02Å; F351-M355 HydrophobicContact CE1-CE 3.27Å; F351-M355 HydrophobicContact CZ-CE 3.82Å; F351-M355 PolarHBondContact O-N 2.97Å; V352-M355 WeakPolarHBondContact O-CB 3.32Å; V352-M355 PolarHBondContact O-N 2.8Å; V352-M355 VanDerWaalsContact O-N 3.15Å; S353-M355 VanDerWaalsContact C-N 3.31Å
356	V	95.6	Very high	94.5	Very high	128 Å²	128	64.6 Å²	64.6	78%	0.776	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-101.3	129.4	173	-176.1	0	0	0	0	109.1	A354	A354-V356 PolarHBondContact O-N 3.46Å
357	L	96.4	Very high	94.6	Very high	41 Å²	41	64 Å²	64	22%	0.215	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-91.2	141.8	177.2	-63.5	175.5	0	0	0	110	L336 W337 K340 F341	L336-L357 HydrophobicContact CB-CD2 3.67Å; W337-L357 HydrophobicContact CG-CD1 4.39Å; K340-L357 HydrophobicContact CB-CD2 4.41Å; K340-L357 HydrophobicContact CD-CD1 3.77Å; K340-L357 HydrophobicContact CD-CD2 4.16Å; K340-L357 HydrophobicContact CD-CG 3.8Å; F341-L357 HydrophobicContact CE2-CD1 3.86Å; F341-L357 HydrophobicContact CZ-CD1 3.98Å
358	P	96.6	Very high	94.4	Very high	38 Å²	38	63.8 Å²	63.8	25%	0.247	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-70.2	154.8	174.1	26.9	-29.4	0	0	0	111.5	L333 L336 Y360	L333-P358 HydrophobicContact CD1-CG 3.86Å; L336-P358 HydrophobicContact CD1-CG 3.91Å; P358-Y360 VanDerWaalsContact C-N 3.27Å; P358-Y360 HydrophobicContact CB-CD1 3.98Å; P358-Y360 HydrophobicContact CB-CD2 4.37Å; P358-Y360 HydrophobicContact CB-CE1 3.68Å; P358-Y360 HydrophobicContact CB-CE2 4.08Å; P358-Y360 HydrophobicContact CB-CG 4.31Å; P358-Y360 HydrophobicContact CG-CD2 4.08Å; P358-Y360 HydrophobicContact CG-CE1 4.29Å; P358-Y360 HydrophobicContact CG-CE2 3.75Å; P358-Y360 HydrophobicContact CG-CG 4.46Å; P358-Y360 PolarHBondContact O-N 3.14Å
359	D	94.5	Very high	94.1	Very high	82 Å²	82	64.1 Å²	64.1	44%	0.439	34%	0.335	S	S	.	.			trans	-87.6	28.4	-172.1	67.2	-30.1	0	0	0	113.7	I361 E362 Q363	D359-I361 PolarHBondContact O-N 2.97Å; D359-I361 VanDerWaalsContact O-N 3.15Å; D359-E362 WeakPolarHBondContact CA-OE2 3.14Å; D359-E362 WeakPolarHBondContact CB-OE2 3.39Å; D359-E362 PolarHBondContact O-N 3.12Å; D359-E362 VanDerWaalsContact O-N 3.09Å; D359-Q363 WeakPolarHBondContact O-CG 3.46Å; D359-Q363 PolarHBondContact O-N 3.32Å; D359-Q363 PolarHBondContact OD1-NE2 2.94Å; D359-Q363 PolarHBondContact OD2-NE2 3.38Å
360	Y	94.7	Very high	93.6	Very high	43 Å²	43	67.3 Å²	67.3	17%	0.169	36%	0.356	C	S	.	.	H	α-helix	trans	-61.4	-27.9	-174.7	-56	-23.3	0	0	0	112.8	Q329 L333 P358 T364	Q329-Y360 HydrophobicContact CB-CD2 3.98Å; Q329-Y360 HydrophobicContact CB-CE2 4.17Å; Q329-Y360 HydrophobicContact CG-CD2 4.31Å; Q329-Y360 HydrophobicContact CG-CE2 4.15Å; L333-Y360 HydrophobicContact CB-CD2 4.03Å; P358-Y360 VanDerWaalsContact C-N 3.27Å; P358-Y360 HydrophobicContact CB-CD1 3.98Å; P358-Y360 HydrophobicContact CB-CD2 4.37Å; P358-Y360 HydrophobicContact CB-CE1 3.68Å; P358-Y360 HydrophobicContact CB-CE2 4.08Å; P358-Y360 HydrophobicContact CB-CG 4.31Å; P358-Y360 HydrophobicContact CG-CD2 4.08Å; P358-Y360 HydrophobicContact CG-CE1 4.29Å; P358-Y360 HydrophobicContact CG-CE2 3.75Å; P358-Y360 HydrophobicContact CG-CG 4.46Å; P358-Y360 PolarHBondContact O-N 3.14Å; Y360-T364 VanDerWaalsContact O-CB 3.3Å; Y360-T364 WeakPolarHBondContact O-CB 3.15Å; Y360-T364 PolarHBondContact O-N 2.95Å; Y360-T364 PolarHBondContact O-OG1 3.21Å
361	I	93.4	Very high	92.6	Very high	31 Å²	31	68.8 Å²	68.8	16%	0.159	36%	0.358	C	S	.	.	H	α-helix	trans	-68	-49.2	174.9	-58.3	175.9	0	0	0	109.9	L270 F276 V318 L333 W337 D359 Q363 T364 H365	L270-I361 HydrophobicContact CD1-CD1 3.65Å; L270-I361 HydrophobicContact CD1-CG1 4.3Å; F276-I361 HydrophobicContact CE1-CD1 4.15Å; F276-I361 HydrophobicContact CZ-CD1 4.19Å; F276-I361 HydrophobicContact CZ-CG2 4.26Å; V318-I361 HydrophobicContact CG1-CG2 4.02Å; V318-I361 HydrophobicContact CG2-CG2 3.98Å; V318-I361 WeakPolarHBondContact CG2-O 3.1Å; L333-I361 HydrophobicContact CD2-CD1 4.08Å; L333-I361 HydrophobicContact CD2-CG1 3.7Å; W337-I361 HydrophobicContact CZ2-CD1 3.77Å; D359-I361 PolarHBondContact O-N 2.97Å; D359-I361 VanDerWaalsContact O-N 3.15Å; I361-Q363 VanDerWaalsContact C-N 3.34Å; I361-Q363 PolarHBondContact O-N 3.2Å; I361-T364 PolarHBondContact O-N 3.46Å; I361-H365 WeakPolarHBondContact O-CB 3.03Å; I361-H365 PolarHBondContact O-N 3.27Å
362	E	94	Very high	91.1	Very high	109 Å²	109	71.5 Å²	71.5	51%	0.509	37%	0.372	S	S	.	.	H	α-helix	trans	-61.1	-43.4	177.2	-68.9	90.5	175.2	0	0	111.5	D359 T364 H365 Q366	D359-E362 WeakPolarHBondContact CA-OE2 3.14Å; D359-E362 WeakPolarHBondContact CB-OE2 3.39Å; D359-E362 PolarHBondContact O-N 3.12Å; D359-E362 VanDerWaalsContact O-N 3.09Å; E362-T364 VanDerWaalsContact C-N 3.34Å; E362-T364 PolarHBondContact O-N 2.99Å; E362-H365 PolarHBondContact O-N 2.89Å; E362-Q366 VanDerWaalsContact O-CG 3.29Å; E362-Q366 WeakPolarHBondContact O-CG 3.31Å; E362-Q366 PolarHBondContact O-N 3.07Å
363	Q	94	Very high	89.5	Confident	59 Å²	59	78.4 Å²	78.4	28%	0.276	41%	0.407	S	S	.	.	H	α-helix	trans	-60.5	-43	176.9	-66.1	-179.8	23.5	0	0	111.9	D359 I361 Q366 R367	D359-Q363 WeakPolarHBondContact O-CG 3.46Å; D359-Q363 PolarHBondContact O-N 3.32Å; D359-Q363 PolarHBondContact OD1-NE2 2.94Å; D359-Q363 PolarHBondContact OD2-NE2 3.38Å; I361-Q363 VanDerWaalsContact C-N 3.34Å; I361-Q363 PolarHBondContact O-N 3.2Å; Q363-Q366 PolarHBondContact O-N 2.66Å; Q363-R367 WeakPolarHBondContact O-CG 3.37Å; Q363-R367 PolarHBondContact O-N 3.19Å
364	T	93	Very high	87.2	Confident	4 Å²	4	89.2 Å²	89.2	3%	0.025	44%	0.44	C	S	.	.	H	α-helix	trans	-67.2	-42.1	177.9	-59.4	0	0	0	0	111.2	V318 A321 L322 W325 Y360 I361 E362 Q366 R367 L368	V318-T364 HydrophobicContact CG2-CG2 3.83Å; V318-T364 WeakPolarHBondContact O-CG2 3.28Å; A321-T364 HydrophobicContact CB-CG2 3.83Å; L322-T364 HydrophobicContact CB-CG2 4.13Å; W325-T364 HydrophobicContact CE3-CG2 3.83Å; W325-T364 HydrophobicContact CH2-CG2 4.48Å; W325-T364 HydrophobicContact CZ3-CG2 3.59Å; Y360-T364 VanDerWaalsContact O-CB 3.3Å; Y360-T364 WeakPolarHBondContact O-CB 3.15Å; Y360-T364 PolarHBondContact O-N 2.95Å; Y360-T364 PolarHBondContact O-OG1 3.21Å; I361-T364 PolarHBondContact O-N 3.46Å; E362-T364 VanDerWaalsContact C-N 3.34Å; E362-T364 PolarHBondContact O-N 2.99Å; T364-Q366 PolarHBondContact O-N 2.9Å; T364-R367 PolarHBondContact O-N 2.98Å; T364-L368 PolarHBondContact O-N 3.18Å
365	H	93.1	Very high	86.8	Confident	98 Å²	98	89.8 Å²	89.8	45%	0.454	43%	0.43	S	S	.	.	H	α-helix	trans	-60.2	-44.7	176	-176.1	-101.5	0	0	0	111.7	V318 I361 E362 R367 L368 N369	V318-H365 HydrophobicContact CG2-CB 3.94Å; I361-H365 WeakPolarHBondContact O-CB 3.03Å; I361-H365 PolarHBondContact O-N 3.27Å; E362-H365 PolarHBondContact O-N 2.89Å; H365-R367 PolarHBondContact O-N 3.33Å; H365-L368 PolarHBondContact O-N 2.71Å; H365-N369 PolarHBondContact CE1-ND2 3.07Å; H365-N369 PolarHBondContact ND1-ND2 2.93Å; H365-N369 PolarHBondContact O-N 3.12Å; H365-N369 PolarHBondContact O-ND2 3.13Å
366	Q	93.2	Very high	86.3	Confident	124 Å²	124	93.4 Å²	93.4	58%	0.579	45%	0.447	S	S	*	.	H	α-helix	trans	-60.3	-44.2	174.7	-71.3	171.3	9.5	0	0	111.8	E362 Q363 T364 L368 N369 C370	E362-Q366 VanDerWaalsContact O-CG 3.29Å; E362-Q366 WeakPolarHBondContact O-CG 3.31Å; E362-Q366 PolarHBondContact O-N 3.07Å; Q363-Q366 PolarHBondContact O-N 2.66Å; T364-Q366 PolarHBondContact O-N 2.9Å; Q366-L368 PolarHBondContact O-N 3.38Å; Q366-N369 PolarHBondContact O-N 2.91Å; Q366-C370 PolarHBondContact O-N 3.48Å; Q366-C370 PolarHBondContact O-SG 3.42Å
367	R	92.2	Very high	85.8	Confident	130 Å²	130	91.5 Å²	91.5	49%	0.491	43%	0.429	S	S	.	.	H	α-helix	trans	-62.7	-38.6	176.8	-74	176.5	-174.4	-175.6	5.4	112.7	W325 Q363 T364 H365 C370 K371	W325-R367 HydrophobicContact CH2-CB 3.95Å; W325-R367 HydrophobicContact CZ3-CB 3.59Å; Q363-R367 WeakPolarHBondContact O-CG 3.37Å; Q363-R367 PolarHBondContact O-N 3.19Å; T364-R367 PolarHBondContact O-N 2.98Å; H365-R367 PolarHBondContact O-N 3.33Å; R367-C370 PolarHBondContact O-N 3.05Å; R367-K371 WeakPolarHBondContact O-CG 3.49Å; R367-K371 PolarHBondContact O-N 2.77Å
368	L	89.7	Confident	85.1	Confident	38 Å²	38	94.5 Å²	94.5	20%	0.199	44%	0.441	C	S	.	.	H	α-helix	trans	-63.1	-46.2	175.1	-77.2	172.8	0	0	0	111.4	V318 A321 W325 T364 H365 Q366 C370 K371 Q372	V318-L368 HydrophobicContact CB-CD1 4.24Å; V318-L368 HydrophobicContact CG2-CD1 4.43Å; A321-L368 HydrophobicContact CB-CD1 3.84Å; A321-L368 HydrophobicContact CB-CD2 3.87Å; A321-L368 HydrophobicContact CB-CG 4.09Å; W325-L368 HydrophobicContact CH2-CB 4.41Å; W325-L368 HydrophobicContact CH2-CD2 3.41Å; W325-L368 VanDerWaalsContact CH2-CD2 3.41Å; W325-L368 HydrophobicContact CH2-CG 3.54Å; W325-L368 HydrophobicContact CZ2-CD2 3.54Å; W325-L368 HydrophobicContact CZ2-CG 4.2Å; W325-L368 HydrophobicContact CZ3-CD2 4.48Å; W325-L368 HydrophobicContact CZ3-CG 4.26Å; T364-L368 PolarHBondContact O-N 3.18Å; H365-L368 PolarHBondContact O-N 2.71Å; Q366-L368 PolarHBondContact O-N 3.38Å; L368-C370 VanDerWaalsContact C-N 3.35Å; L368-C370 PolarHBondContact O-N 3.32Å; L368-K371 PolarHBondContact O-N 3.22Å; L368-K371 VanDerWaalsContact O-N 3.15Å; L368-Q372 PolarHBondContact O-N 3.02Å; L368-Q372 VanDerWaalsContact O-N 3.13Å
369	N	88.3	Confident	84.4	Confident	62 Å²	62	98 Å²	98	33%	0.332	45%	0.454	S	S	.	.	H	α-helix	trans	-64.3	-38.5	178.6	-67.7	-17.2	0	0	0	112	H365 Q366 K371 Q372 I373	H365-N369 PolarHBondContact CE1-ND2 3.07Å; H365-N369 PolarHBondContact ND1-ND2 2.93Å; H365-N369 PolarHBondContact O-N 3.12Å; H365-N369 PolarHBondContact O-ND2 3.13Å; Q366-N369 PolarHBondContact O-N 2.91Å; N369-K371 VanDerWaalsContact C-N 3.29Å; N369-K371 PolarHBondContact O-N 3.43Å; N369-Q372 PolarHBondContact O-N 3.18Å; N369-I373 WeakPolarHBondContact O-CD1 3.46Å; N369-I373 WeakPolarHBondContact O-CG1 3.42Å; N369-I373 PolarHBondContact O-N 2.82Å
370	C	83.4	Confident	83.8	Confident	81 Å²	81	99.1 Å²	99.1	55%	0.547	46%	0.455	S	S	.	.	H	α-helix	trans	-65.2	-30.5	174.8	-69.3	0	0	0	0	113.4	Q366 R367 L368	Q366-C370 PolarHBondContact O-N 3.48Å; Q366-C370 PolarHBondContact O-SG 3.42Å; R367-C370 PolarHBondContact O-N 3.05Å; L368-C370 VanDerWaalsContact C-N 3.35Å; L368-C370 PolarHBondContact O-N 3.32Å
371	K	73.7	Confident	83	Confident	126 Å²	126	103.1 Å²	103.1	55%	0.548	48%	0.475	S	S	.	.	H	α-helix	trans	-76.4	-30.4	176.3	-76.2	-179.5	178.7	176.9	0	112.7	W325 R367 L368 N369 I373	W325-K371 HydrophobicContact CH2-CD 4.44Å; W325-K371 HydrophobicContact CZ2-CD 4.15Å; W325-K371 VanDerWaalsContact CZ2-NZ 3.33Å; R367-K371 WeakPolarHBondContact O-CG 3.49Å; R367-K371 PolarHBondContact O-N 2.77Å; L368-K371 PolarHBondContact O-N 3.22Å; L368-K371 VanDerWaalsContact O-N 3.15Å; N369-K371 VanDerWaalsContact C-N 3.29Å; N369-K371 PolarHBondContact O-N 3.43Å; K371-I373 VanDerWaalsContact C-N 3.28Å; K371-I373 PolarHBondContact O-N 3.46Å
372	Q	64	Low	82.2	Confident	155 Å²	155	108.6 Å²	108.6	72%	0.724	50%	0.499	S	S	*	.	H	α-helix	trans	-74.4	-17.6	177.4	-72.2	178.6	-10	0	0	113.5	L368 N369	L368-Q372 PolarHBondContact O-N 3.02Å; L368-Q372 VanDerWaalsContact O-N 3.13Å; N369-Q372 PolarHBondContact O-N 3.18Å
373	I	61.6	Low	81.2	Confident	148 Å²	148	108.6 Å²	108.6	76%	0.759	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-11	179.1	-63.3	165.8	0	0	0	111.9	N369 K371	N369-I373 WeakPolarHBondContact O-CD1 3.46Å; N369-I373 WeakPolarHBondContact O-CG1 3.42Å; N369-I373 PolarHBondContact O-N 2.82Å; K371-I373 VanDerWaalsContact C-N 3.28Å; K371-I373 PolarHBondContact O-N 3.46Å
374	R	48	Very low	80	Confident	278 Å²	278	113.1 Å²	113.1	100%	1.049	52%	0.519	S	S	*	.			trans	-102.5	0	174.6	-68.8	-175.6	-179.8	-173.6	0.4	110.5

Retrieved 374 of 374 residues in 99.2 ms (Link to these results)

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