A0A3B3UFQ3_9TELE Loading...

Ribosomal protein S6 kinase

AlphaFold DB , UniProt , Accession A0A3B3UFQ3, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 470 aa.

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(Predicted Aligned Error values between residue pairs)

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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	28.3	Very low	28.8	Very low	251 Å²	251	146.1 Å²	146.1	100%	1.236	82%	0.815	S	S	*	*				0	165.8	0	-75.2	177.2	172.9	0	0	108.4
2	A	24.5	Very low	29.2	Very low	109 Å²	109	148.9 Å²	148.9	90%	0.901	82%	0.818	S	S	*	*			trans	-42.4	159.1	-173.8	0	0	0	0	0	116.8
3	G	25.7	Very low	29.4	Very low	63 Å²	63	150.2 Å²	150.2	65%	0.649	82%	0.823	S	S	*	*			cis	-177	176.7	5.3	0	0	0	0	0	112.3
4	V	28.4	Very low	29.4	Very low	120 Å²	120	145.2 Å²	145.2	73%	0.727	82%	0.823	S	S	*	*				72.6	124.3	86	158.1	0	0	0	0	112.8
5	F	29.3	Very low	29.5	Very low	170 Å²	170	142.7 Å²	142.7	75%	0.746	82%	0.818	S	S	*	*			cis	-151.3	160.2	-5.6	-102.2	-47	0	0	0	110.7
6	D	27.6	Very low	29.6	Very low	119 Å²	119	144.3 Å²	144.3	64%	0.636	82%	0.824	S	S	*	*			trans	12.2	156.1	146.1	-38.2	-28	0	0	0	123.1
7	I	30.3	Very low	29.8	Very low	162 Å²	162	143.4 Å²	143.4	83%	0.831	82%	0.821	S	S	*	*				-163.6	127.4	115.2	-98.1	159	0	0	0	109.3
8	D	29.3	Very low	30.1	Very low	144 Å²	144	146.6 Å²	146.6	77%	0.77	83%	0.828	S	S	*	*			trans	-84.9	162.8	171	-62.9	-67.8	0	0	0	111.7
9	L	31.2	Very low	30.4	Very low	156 Å²	156	149.2 Å²	149.2	82%	0.817	83%	0.833	S	S	*	*			trans	-152.1	87.7	167.5	-119.4	169	0	0	0	111.2
10	E	30.4	Very low	30.5	Very low	181 Å²	181	150 Å²	150	85%	0.846	84%	0.835	S	S	*	*			trans	-83.4	144.8	162.1	-64.8	177.8	143.7	0	0	109.9
11	T	32	Very low	30.6	Very low	132 Å²	132	147.2 Å²	147.2	81%	0.81	83%	0.832	S	S	*	*			trans	-148.1	121.9	158.2	40.5	0	0	0	0	108.2
12	E	33.5	Very low	30.7	Very low	180 Å²	180	141.1 Å²	141.1	84%	0.841	81%	0.813	S	S	*	*			trans	-92.2	176.4	179	-69.4	-173.7	118.2	0	0	113
13	D	31.3	Very low	31.3	Very low	165 Å²	165	145.6 Å²	145.6	88%	0.882	82%	0.815	S	S	*	*			trans	73	132.6	162.4	-72.5	-14.3	0	0	0	121.2
14	G	29.2	Very low	31.6	Very low	81 Å²	81	147.1 Å²	147.1	84%	0.835	82%	0.821	S	S	*	*			trans	167.5	56.8	-172.2	0	0	0	0	0	109.7
15	S	31.4	Very low	31.8	Very low	107 Å²	107	147.4 Å²	147.4	75%	0.748	82%	0.823	S	S	*	*			trans	-71.6	137.6	-179.2	58.3	0	0	0	0	112.2
16	D	31.3	Very low	31.9	Very low	169 Å²	169	145.3 Å²	145.3	90%	0.904	82%	0.824	S	S	*	*			trans	-149.3	146.4	145.4	-100	-38.3	0	0	0	109.8
17	T	33	Very low	32.3	Very low	128 Å²	128	145.3 Å²	145.3	79%	0.785	83%	0.828	S	S	*	*			trans	-121.9	123.5	-174.6	51.3	0	0	0	0	110.5
18	E	35	Very low	32.7	Very low	201 Å²	201	145.1 Å²	145.1	94%	0.939	82%	0.824	S	S	*	*			trans	-129.1	127.4	157.8	-69	-164.4	142.5	0	0	109.3
19	E	36.1	Very low	33.1	Very low	197 Å²	197	143.8 Å²	143.8	92%	0.921	82%	0.823	S	S	*	*			trans	-90.2	136.9	173.4	-58.3	177.6	138.2	0	0	108.6
20	D	31.9	Very low	33.3	Very low	164 Å²	164	143.4 Å²	143.4	88%	0.877	82%	0.822	S	S	*	*			trans	-132.5	129.6	159.1	-164.6	3.6	0	0	0	109.1
21	A	32.1	Very low	33.8	Very low	92 Å²	92	140.1 Å²	140.1	76%	0.76	82%	0.819	S	S	*	*			trans	-119.7	98.2	-161.6	0	0	0	0	0	111.1
22	C	30.7	Very low	34.2	Very low	124 Å²	124	136.5 Å²	136.5	84%	0.838	81%	0.807	S	S	*	*			trans	-92.8	106.4	172.1	53.8	0	0	0	0	111.3	A24	C22-A24 PolarHBondContact O-N 3.33Å; C22-A24 VanDerWaalsContact O-N 3.17Å
23	E	37.2	Very low	34.6	Very low	203 Å²	203	137.2 Å²	137.2	95%	0.949	81%	0.811	S	S	*	*			trans	-62.3	115.2	172.6	-68.3	-174.2	118.1	0	0	110.9
24	A	32.8	Very low	34.9	Very low	94 Å²	94	135.4 Å²	135.4	78%	0.777	81%	0.806	S	S	*	*			trans	-110.6	114.1	166.1	0	0	0	0	0	108.6	C22 V26	C22-A24 PolarHBondContact O-N 3.33Å; C22-A24 VanDerWaalsContact O-N 3.17Å; A24-V26 PolarHBondContact O-N 3.17Å
25	T	31.4	Very low	35.8	Very low	127 Å²	127	139.7 Å²	139.7	78%	0.779	80%	0.804	S	S	*	*			trans	-61.1	125.7	-178.4	50.5	0	0	0	0	111.3	V27	T25-V27 PolarHBondContact O-N 3.18Å
26	V	31.8	Very low	36.6	Very low	125 Å²	125	143.6 Å²	143.6	76%	0.758	81%	0.81	S	S	*	*			trans	-61.6	118.1	171.4	-178.9	0	0	0	0	109.2	A24	A24-V26 PolarHBondContact O-N 3.17Å
27	V	35.9	Very low	37.5	Very low	119 Å²	119	139.8 Å²	139.8	72%	0.721	79%	0.793	S	S	*	*			trans	-109.4	108.2	167.1	-178.9	0	0	0	0	106.7	T25 P29	T25-V27 PolarHBondContact O-N 3.18Å; V27-P29 WeakPolarHBondContact O-CD 3.42Å
28	E	39.2	Very low	38	Very low	159 Å²	159	141 Å²	141	74%	0.743	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-56.5	121.7	174.3	-67.6	-73.6	116.4	0	0	109.9
29	P	38.3	Very low	38.5	Very low	115 Å²	115	138.4 Å²	138.4	75%	0.747	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-74.6	136.7	171	30.5	-32.1	0	0	0	110.2	V27	V27-P29 WeakPolarHBondContact O-CD 3.42Å
30	D	35.2	Very low	39.3	Very low	149 Å²	149	130.9 Å²	130.9	80%	0.797	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-58.6	152.4	176.9	-175.4	20.7	0	0	0	112.1	G32	D30-G32 PolarHBondContact O-N 2.78Å
31	S	40.8	Very low	40.3	Very low	112 Å²	112	127.1 Å²	127.1	78%	0.783	74%	0.736	S	S	*	*			trans	-70	44.7	-172.5	57.1	0	0	0	0	115.4	Q33	S31-Q33 PolarHBondContact O-N 2.98Å
32	G	39.5	Very low	41.4	Very low	55 Å²	55	130.6 Å²	130.6	57%	0.567	74%	0.736	S	S	*	*			trans	-66.8	126.1	170.3	0	0	0	0	0	111.6	D30 T34	D30-G32 PolarHBondContact O-N 2.78Å; G32-T34 PolarHBondContact O-N 3.47Å
33	Q	41.6	Very low	42.2	Very low	195 Å²	195	128.7 Å²	128.7	91%	0.911	72%	0.718	S	S	*	*			trans	-70.1	94.4	173.5	-70.6	-179.5	-30.7	0	0	110.4	S31 E35	S31-Q33 PolarHBondContact O-N 2.98Å; Q33-E35 PolarHBondContact O-N 3.28Å
34	T	39.4	Very low	42.7	Very low	127 Å²	127	122.2 Å²	122.2	78%	0.779	69%	0.692	S	S	*	*			trans	-79	99.7	169.1	51.7	0	0	0	0	109.7	G32 E36	G32-T34 PolarHBondContact O-N 3.47Å; T34-E36 PolarHBondContact O-N 3.18Å
35	E	47.8	Very low	43.4	Very low	171 Å²	171	123 Å²	123	80%	0.799	68%	0.683	S	S	*	*			trans	-67.9	109.3	167.1	-69.3	-168.3	141	0	0	109.7	Q33 V37	Q33-E35 PolarHBondContact O-N 3.28Å; E35-V37 HydrophobicContact CB-CG2 4.28Å; E35-V37 PolarHBondContact O-N 2.87Å
36	E	48.4	Very low	44.2	Very low	189 Å²	189	127.4 Å²	127.4	88%	0.883	69%	0.685	S	S	*	*			trans	-71.1	79.9	168.9	-68.2	-167.8	147.7	0	0	110	T34 E38	T34-E36 PolarHBondContact O-N 3.18Å; E36-E38 PolarHBondContact O-N 3.2Å
37	V	49.7	Very low	44.9	Very low	89 Å²	89	129.4 Å²	129.4	54%	0.539	69%	0.692	S	S	.	*			trans	-69.8	111.9	173.6	179.2	0	0	0	0	109.2	E35 L39	E35-V37 HydrophobicContact CB-CG2 4.28Å; E35-V37 PolarHBondContact O-N 2.87Å; V37-L39 PolarHBondContact O-N 3.12Å
38	E	43.4	Very low	45.7	Very low	154 Å²	154	125.9 Å²	125.9	72%	0.72	67%	0.672	S	S	*	*			trans	-54.1	127.1	172.5	-171.4	-179.3	-171.9	0	0	109.8	E36 T40 N43	E36-E38 PolarHBondContact O-N 3.2Å; E38-T40 HydrophobicContact CB-CG2 4.01Å; E38-T40 HydrophobicContact CG-CG2 3.82Å; E38-T40 PolarHBondContact O-N 3.24Å; E38-N43 PolarHBondContact O-ND2 3.19Å; E38-N43 VanDerWaalsContact O-ND2 3.12Å
39	L	44.6	Very low	46.7	Very low	147 Å²	147	123.7 Å²	123.7	77%	0.77	66%	0.662	S	S	*	*			trans	-75.9	58.2	178.8	-70.2	171.9	0	0	0	110.9	V37 V44	V37-L39 PolarHBondContact O-N 3.12Å; L39-V44 HydrophobicContact CB-CG2 4.28Å; L39-V44 HydrophobicContact CD2-CG2 3.78Å
40	T	52.6	Low	48.4	Very low	39 Å²	39	124.6 Å²	124.6	24%	0.239	65%	0.651	C	S	.	*			trans	-63.7	161.9	176.6	72.9	0	0	0	0	110.9	E38 E42 N43	E38-T40 HydrophobicContact CB-CG2 4.01Å; E38-T40 HydrophobicContact CG-CG2 3.82Å; E38-T40 PolarHBondContact O-N 3.24Å; T40-E42 PolarHBondContact O-N 3.34Å; T40-E42 PolarHBondContact OG1-N 2.79Å; T40-N43 PolarHBondContact O-N 3.33Å; T40-N43 VanDerWaalsContact OG1-CG 3.24Å; T40-N43 PolarHBondContact OG1-N 3.32Å; T40-N43 PolarHBondContact OG1-ND2 3.17Å
41	S	54.6	Low	50.8	Low	85 Å²	85	118.7 Å²	118.7	59%	0.594	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.9	-27.6	168.5	49	0	0	0	0	112.5	R50	S41-R50 PolarHBondContact O-NH1 2.78Å; S41-R50 PolarHBondContact O-NH2 3.06Å
42	E	53.7	Low	53.2	Low	164 Å²	164	113.9 Å²	113.9	77%	0.766	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-24	-175.5	-62	-175.1	169.7	0	0	113	T40	T40-E42 PolarHBondContact O-N 3.34Å; T40-E42 PolarHBondContact OG1-N 2.79Å
43	N	48	Very low	55.7	Low	85 Å²	85	113.6 Å²	113.6	46%	0.455	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91	-26.8	-171.3	-65.3	-10.6	0	0	0	113.9	E38 T40	E38-N43 PolarHBondContact O-ND2 3.19Å; E38-N43 VanDerWaalsContact O-ND2 3.12Å; T40-N43 PolarHBondContact O-N 3.33Å; T40-N43 VanDerWaalsContact OG1-CG 3.24Å; T40-N43 PolarHBondContact OG1-N 3.32Å; T40-N43 PolarHBondContact OG1-ND2 3.17Å
44	V	48.6	Very low	58.1	Low	66 Å²	66	109.1 Å²	109.1	40%	0.4	56%	0.559	S	S	.	*	S	Bend	trans	-92.9	125.1	-170.9	-176.3	0	0	0	0	112.7	L39 R50	L39-V44 HydrophobicContact CB-CG2 4.28Å; L39-V44 HydrophobicContact CD2-CG2 3.78Å; V44-R50 PolarHBondContact O-NH2 3.15Å
45	N	47.6	Very low	60.7	Low	112 Å²	112	103.4 Å²	103.4	60%	0.599	52%	0.524	S	S	*	.			trans	63.8	51.8	169.7	-140.3	33.4	0	0	0	115.3	D47 S48	N45-D47 PolarHBondContact O-N 3.15Å; N45-D47 VanDerWaalsContact O-N 3.15Å; N45-S48 WeakPolarHBondContact CB-OG 3.36Å; N45-S48 WeakPolarHBondContact ND2-CB 3.41Å; N45-S48 PolarHBondContact ND2-OG 2.87Å; N45-S48 PolarHBondContact O-N 2.89Å; N45-S48 PolarHBondContact O-OG 3.12Å
46	R	46.6	Very low	63	Low	218 Å²	218	95.9 Å²	95.9	82%	0.823	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-29.8	-177.1	-65.1	-179.9	71.4	170.1	4.1	114.9
47	D	46.5	Very low	65.3	Low	167 Å²	167	91 Å²	91	89%	0.893	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-1.1	-177.9	-53.5	-56.9	0	0	0	113.7	N45	N45-D47 PolarHBondContact O-N 3.15Å; N45-D47 VanDerWaalsContact O-N 3.15Å
48	S	54	Low	67.5	Low	45 Å²	45	89.3 Å²	89.3	32%	0.315	45%	0.454	S	S	.	.	S	Bend	trans	-88.1	120.6	171.1	64.6	0	0	0	0	110.9	N45 R50	N45-S48 WeakPolarHBondContact CB-OG 3.36Å; N45-S48 WeakPolarHBondContact ND2-CB 3.41Å; N45-S48 PolarHBondContact ND2-OG 2.87Å; N45-S48 PolarHBondContact O-N 2.89Å; N45-S48 PolarHBondContact O-OG 3.12Å; S48-R50 PolarHBondContact O-N 3.35Å; S48-R50 VanDerWaalsContact O-N 3.1Å
49	E	59.4	Low	70	Confident	113 Å²	113	83.7 Å²	83.7	53%	0.528	43%	0.428	S	S	.	.			trans	-60.7	112.8	178	-171.5	-170.4	-119	0	0	110.3	V51 G78 P79	E49-V51 PolarHBondContact O-N 2.74Å; E49-G78 WeakPolarHBondContact OE1-CA 3.39Å; E49-P79 WeakPolarHBondContact OE1-CD 3.42Å; E49-P79 WeakPolarHBondContact OE2-CD 3.24Å
50	R	73.5	Confident	72.5	Confident	135 Å²	135	77.7 Å²	77.7	51%	0.509	40%	0.398	S	S	.	.			trans	-88.1	109.1	-175.2	-73.6	-168.8	173	-172.7	4.1	111.9	S41 V44 S48 G52	S41-R50 PolarHBondContact O-NH1 2.78Å; S41-R50 PolarHBondContact O-NH2 3.06Å; V44-R50 PolarHBondContact O-NH2 3.15Å; S48-R50 PolarHBondContact O-N 3.35Å; S48-R50 VanDerWaalsContact O-N 3.1Å; R50-G52 PolarHBondContact O-N 2.7Å
51	V	86.9	Confident	74.6	Confident	24 Å²	24	75.9 Å²	75.9	15%	0.145	39%	0.386	C	S	.	.			trans	-73.9	105.3	173.4	-177.6	0	0	0	0	109.9	E49 F56 Y125 F127	E49-V51 PolarHBondContact O-N 2.74Å; V51-F56 HydrophobicContact CG1-CE2 3.57Å; V51-F56 HydrophobicContact CG1-CZ 3.89Å; V51-Y125 HydrophobicContact CB-CD1 4.23Å; V51-Y125 HydrophobicContact CG1-CD1 3.87Å; V51-Y125 HydrophobicContact CG1-CE1 4.44Å; V51-Y125 HydrophobicContact CG1-CG 4.19Å; V51-Y125 HydrophobicContact CG2-CD1 3.79Å; V51-Y125 HydrophobicContact CG2-CE1 3.91Å; V51-F127 HydrophobicContact CG1-CD1 3.99Å; V51-F127 HydrophobicContact CG1-CE1 3.91Å; V51-F127 WeakPolarHBondContact O-CG 3.32Å
52	G	91.4	Very high	76.5	Confident	12 Å²	12	72.4 Å²	72.4	12%	0.124	36%	0.361	C	S	.	.			trans	-113.3	-179.3	175.1	0	0	0	0	0	113.3	R50 D54 C55 F56	R50-G52 PolarHBondContact O-N 2.7Å; G52-D54 WeakPolarHBondContact CA-OD1 3.49Å; G52-D54 PolarHBondContact O-N 3.06Å; G52-C55 WeakPolarHBondContact O-CB 3.47Å; G52-C55 PolarHBondContact O-N 3.05Å; G52-F56 WeakPolarHBondContact O-CD2 3.43Å
53	P	91.3	Very high	78.3	Confident	48 Å²	48	65.2 Å²	65.2	31%	0.312	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-59.7	-33.5	176.1	-18	28.5	0	0	0	113.1	C55 F56 F127 T129 Y134	P53-C55 PolarHBondContact O-N 3.2Å; P53-F56 PolarHBondContact O-N 2.67Å; P53-F56 VanDerWaalsContact O-N 3.14Å; P53-F127 HydrophobicContact CB-CE2 4.36Å; P53-F127 HydrophobicContact CG-CE2 3.9Å; P53-T129 HydrophobicContact CG-CG2 3.82Å; P53-Y134 HydrophobicContact CG-CE2 4.24Å
54	D	92.1	Very high	80.3	Confident	101 Å²	101	67.8 Å²	67.8	54%	0.54	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-67.1	-16.5	178.3	63.8	-65.6	0	0	0	113.8	G52 F56 Q77	G52-D54 WeakPolarHBondContact CA-OD1 3.49Å; G52-D54 PolarHBondContact O-N 3.06Å; D54-F56 PolarHBondContact O-N 2.93Å; D54-Q77 PolarHBondContact O-NE2 2.99Å; D54-Q77 PolarHBondContact OD2-NE2 3.26Å
55	C	93.3	Very high	81.8	Confident	8 Å²	8	67 Å²	67	5%	0.054	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-72.9	-4.7	171.2	-66.4	0	0	0	0	112.9	G52 P53 K75 V76 Q77	G52-C55 WeakPolarHBondContact O-CB 3.47Å; G52-C55 PolarHBondContact O-N 3.05Å; P53-C55 PolarHBondContact O-N 3.2Å; C55-K75 CarbonylContact O-C 3.56Å; C55-K75 WeakPolarHBondContact O-CA 3.38Å; C55-V76 WeakPolarHBondContact O-CG2 3.24Å; C55-V76 PolarHBondContact O-N 3.17Å; C55-Q77 HydrophobicContact CB-CB 4.39Å
56	F	96	Very high	83.3	Confident	13 Å²	13	65 Å²	65	6%	0.057	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	128.1	-172.7	-59.2	-86.3	0	0	0	113.5	V51 G52 P53 D54 V73 R74 K75 F85 M87 Y125 F127 I136	V51-F56 HydrophobicContact CG1-CE2 3.57Å; V51-F56 HydrophobicContact CG1-CZ 3.89Å; G52-F56 WeakPolarHBondContact O-CD2 3.43Å; P53-F56 PolarHBondContact O-N 2.67Å; P53-F56 VanDerWaalsContact O-N 3.14Å; D54-F56 PolarHBondContact O-N 2.93Å; F56-V73 HydrophobicContact CB-CB 4.21Å; F56-V73 HydrophobicContact CB-CG2 4.26Å; F56-V73 HydrophobicContact CD1-CB 4.48Å; F56-V73 HydrophobicContact CD1-CG2 3.72Å; F56-V73 HydrophobicContact CE1-CG2 4.48Å; F56-V73 HydrophobicContact CG-CG2 4.28Å; F56-R74 CarbonylContact C-O 3.55Å; F56-R74 VanDerWaalsContact CA-O 3.31Å; F56-R74 WeakPolarHBondContact CA-O 3.32Å; F56-K75 HydrophobicContact CD1-CB 3.99Å; F56-K75 HydrophobicContact CD1-CG 4.18Å; F56-K75 HydrophobicContact CE1-CB 3.87Å; F56-K75 HydrophobicContact CE1-CD 3.84Å; F56-K75 HydrophobicContact CE1-CG 3.81Å; F56-K75 HydrophobicContact CZ-CD 4.08Å; F56-K75 HydrophobicContact CZ-CG 4.31Å; F56-F85 HydrophobicContact CE1-CD2 4.28Å; F56-M87 HydrophobicContact CB-CE 3.62Å; F56-M87 HydrophobicContact CD2-CE 3.86Å; F56-M87 HydrophobicContact CG-CE 3.78Å; F56-Y125 HydrophobicContact CZ-CD2 4.34Å; F56-F127 HydrophobicContact CD2-CE1 4.32Å; F56-F127 HydrophobicContact CD2-CZ 4.1Å; F56-F127 AromaticContact CE2-CE1 3.67Å; F56-F127 HydrophobicContact CE2-CE1 3.67Å; F56-F127 AromaticContact CE2-CZ 3.91Å; F56-F127 HydrophobicContact CE2-CZ 3.91Å; F56-F127 HydrophobicContact CZ-CE1 4.46Å; F56-I136 HydrophobicContact CD2-CD1 4.45Å; F56-I136 HydrophobicContact CE1-CD1 4.34Å; F56-I136 HydrophobicContact CE1-CG1 4.37Å; F56-I136 HydrophobicContact CE1-CG2 3.94Å; F56-I136 HydrophobicContact CE2-CD1 4.14Å; F56-I136 HydrophobicContact CE2-CG1 4.17Å; F56-I136 HydrophobicContact CZ-CD1 4.07Å; F56-I136 HydrophobicContact CZ-CG1 3.84Å; F56-I136 HydrophobicContact CZ-CG2 4.11Å
57	E	96.7	Very high	85	Confident	87 Å²	87	58.5 Å²	58.5	41%	0.407	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	128.7	168.4	174.8	-176.1	-134.8	0	0	109.9	L59 V73 R74 V76	E57-L59 HydrophobicContact CG-CD2 3.89Å; E57-L59 WeakPolarHBondContact OE2-CD2 3.48Å; E57-V73 CarbonylContact O-C 3.59Å; E57-V73 WeakPolarHBondContact O-CA 3.47Å; E57-V73 VanDerWaalsContact O-CB 3.31Å; E57-V73 WeakPolarHBondContact O-CB 3.44Å; E57-R74 HydrophobicContact CB-CB 4.23Å; E57-R74 PolarHBondContact N-O 3.36Å; E57-R74 PolarHBondContact O-N 3.43Å; E57-R74 IonicContact OE2-CZ 3.9Å; E57-R74 IonicContact OE2-NE 3.31Å; E57-R74 PolarHBondContact OE2-NE 3.15Å; E57-R74 IonicContact OE2-NH2 3.13Å; E57-V76 HydrophobicContact CB-CG1 3.82Å
58	L	96.8	Very high	87	Confident	53 Å²	53	51.3 Å²	51.3	28%	0.277	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	112.5	176.4	-59.5	176.9	0	0	0	110.5	F71 V73 M87 P356 D358	L58-F71 HydrophobicContact CD2-CB 4.19Å; L58-F71 HydrophobicContact CD2-CD1 4.32Å; L58-F71 HydrophobicContact CD2-CD2 4.47Å; L58-F71 HydrophobicContact CD2-CG 4.12Å; L58-V73 HydrophobicContact CD2-CG1 3.68Å; L58-M87 HydrophobicContact CD2-SD 3.94Å; L58-P356 HydrophobicContact CB-CB 4.22Å; L58-P356 WeakPolarHBondContact CB-O 3.43Å; L58-P356 VanDerWaalsContact CD1-O 3.26Å; L58-P356 WeakPolarHBondContact CD1-O 3.4Å; L58-D358 HydrophobicContact CD1-CB 3.75Å
59	L	96.6	Very high	88.9	Confident	35 Å²	35	51.5 Å²	51.5	18%	0.183	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-55.9	-177.1	-59.4	-178.9	0	0	0	113	E57 Q72 R74 I84 E342 P356	E57-L59 HydrophobicContact CG-CD2 3.89Å; E57-L59 WeakPolarHBondContact OE2-CD2 3.48Å; L59-Q72 HydrophobicContact CB-CB 4.41Å; L59-Q72 HydrophobicContact CB-CG 4.36Å; L59-Q72 HydrophobicContact CD1-CG 4.28Å; L59-Q72 PolarHBondContact N-O 2.96Å; L59-R74 HydrophobicContact CD1-CB 4.21Å; L59-R74 HydrophobicContact CG-CB 4.47Å; L59-I84 HydrophobicContact CD1-CD1 3.78Å; L59-E342 HydrophobicContact CD1-CG 4Å; L59-P356 WeakPolarHBondContact O-CB 3.25Å; L59-P356 WeakPolarHBondContact O-CG 3.39Å
60	T	96.4	Very high	90.6	Very high	22 Å²	22	48 Å²	48	14%	0.135	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	148.2	-170.8	-56	0	0	0	0	111	F71 Q72 V344 T352	T60-F71 CarbonylContact O-C 3.48Å; T60-F71 WeakPolarHBondContact O-CA 3.32Å; T60-Q72 PolarHBondContact N-O 3.33Å; T60-Q72 PolarHBondContact O-N 3.45Å; T60-Q72 PolarHBondContact OG1-OE1 3.1Å; T60-V344 HydrophobicContact CG2-CB 4.5Å; T60-V344 HydrophobicContact CG2-CG1 4.14Å; T60-V344 HydrophobicContact CG2-CG2 4.21Å; T60-T352 HydrophobicContact CG2-CG2 3.92Å
61	V	96.6	Very high	91.8	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	113.6	165.6	-174.3	0	0	0	0	109.3	K69 F71 F351 T352 Q354	V61-K69 HydrophobicContact CG1-CD 4.41Å; V61-F71 HydrophobicContact CG2-CD1 3.97Å; V61-F71 HydrophobicContact CG2-CE1 3.9Å; V61-F351 HydrophobicContact CG1-CB 4.46Å; V61-F351 CarbonylContact O-C 3.11Å; V61-F351 WeakPolarHBondContact O-CB 3.18Å; V61-T352 WeakPolarHBondContact O-CA 3.49Å; V61-T352 PolarHBondContact O-N 3.44Å; V61-Q354 HydrophobicContact CB-CB 4.24Å; V61-Q354 HydrophobicContact CG2-CB 4.01Å
62	L	94.4	Very high	92.3	Very high	13 Å²	13	40.6 Å²	40.6	7%	0.068	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	-34.6	178	-63	178.8	0	0	0	112.3	V70 Q72 A86 V344 F347 F351	L62-V70 HydrophobicContact CB-CB 4.48Å; L62-V70 HydrophobicContact CB-CG1 4.27Å; L62-V70 HydrophobicContact CD1-CG1 4.41Å; L62-V70 PolarHBondContact N-O 2.97Å; L62-Q72 HydrophobicContact CD1-CB 3.94Å; L62-Q72 HydrophobicContact CD2-CB 3.98Å; L62-Q72 HydrophobicContact CG-CB 3.88Å; L62-A86 HydrophobicContact CD1-CB 4.39Å; L62-V344 HydrophobicContact CD2-CB 4.41Å; L62-V344 HydrophobicContact CD2-CG1 3.68Å; L62-F347 HydrophobicContact CB-CD1 4.03Å; L62-F347 HydrophobicContact CB-CE1 4.02Å; L62-F347 HydrophobicContact CD1-CE1 4.1Å; L62-F347 HydrophobicContact CD1-CZ 4.07Å; L62-F347 HydrophobicContact CD2-CD1 3.88Å; L62-F347 HydrophobicContact CD2-CD2 3.84Å; L62-F347 HydrophobicContact CD2-CE1 3.9Å; L62-F347 HydrophobicContact CD2-CE2 3.85Å; L62-F347 HydrophobicContact CD2-CG 3.85Å; L62-F347 HydrophobicContact CD2-CZ 3.89Å; L62-F347 HydrophobicContact CG-CD1 4.43Å; L62-F347 HydrophobicContact CG-CE1 4.22Å; L62-F347 HydrophobicContact CG-CZ 4.44Å; L62-F351 WeakPolarHBondContact O-CD2 3.47Å
63	G	92.1	Very high	92.6	Very high	12 Å²	12	40 Å²	40	12%	0.124	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165	170.8	-174.6	0	0	0	0	0	114.6	K69 V70	G63-K69 WeakPolarHBondContact O-CA 3.46Å; G63-V70 PolarHBondContact N-O 3.13Å; G63-V70 PolarHBondContact O-N 3.43Å
64	K	89.2	Confident	92.9	Very high	139 Å²	139	40.5 Å²	40.5	60%	0.604	22%	0.224	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-146.4	113.6	-179.6	-177.6	-176.6	174.7	-175.5	0	111.6	F351	K64-F351 HydrophobicContact CB-CD1 4.22Å; K64-F351 HydrophobicContact CB-CE1 3.81Å
65	G	81.2	Confident	93	Very high	50 Å²	50	35.7 Å²	35.7	52%	0.515	20%	0.199	S	C	.	.			trans	-95.5	-174.3	174.6	0	0	0	0	0	113.2	Y67 G68	G65-Y67 PolarHBondContact O-N 2.84Å; G65-G68 PolarHBondContact N-O 3.39Å
66	A	77.7	Confident	93.1	Very high	70 Å²	70	38.2 Å²	38.2	58%	0.579	21%	0.214	S	C	*	.	S	Bend	trans	-61.4	-44.5	177.3	0	0	0	0	0	112.5	K94	A66-K94 PolarHBondContact O-NZ 3.15Å
67	Y	82.6	Confident	92.9	Very high	82 Å²	82	42 Å²	42	32%	0.322	23%	0.231	S	C	.	.	S	Bend	trans	-94	-12.2	-171.8	-47.9	-62.1	0	0	0	114.3	G65 K91 K94 I95 D101	G65-Y67 PolarHBondContact O-N 2.84Å; Y67-K91 PolarHBondContact O-N 2.73Å; Y67-K94 HydrophobicContact CD1-CB 4.28Å; Y67-I95 HydrophobicContact CD1-CG1 4.41Å; Y67-I95 HydrophobicContact CG-CG1 4.28Å; Y67-D101 HydrophobicContact CE1-CB 4.3Å; Y67-D101 PolarHBondContact OH-OD1 2.89Å; Y67-D101 VanDerWaalsContact OH-OD1 3.14Å; Y67-D101 PolarHBondContact OH-OD2 3.33Å; Y67-D101 VanDerWaalsContact OH-OD2 3.11Å
68	G	88.9	Confident	92.3	Very high	15 Å²	15	39.3 Å²	39.3	16%	0.155	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.6	-170.9	-163.9	0	0	0	0	0	116.7	G65 V89	G65-G68 PolarHBondContact N-O 3.39Å; G68-V89 CarbonylContact C-O 3.55Å; G68-V89 WeakPolarHBondContact CA-O 3.05Å
69	K	94.1	Very high	91.6	Very high	49 Å²	49	37.9 Å²	37.9	21%	0.213	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	157.5	172.6	-77.8	-178.7	174.2	-174.3	0	109.6	V61 G63 F71 V89 V357	V61-K69 HydrophobicContact CG1-CD 4.41Å; G63-K69 WeakPolarHBondContact O-CA 3.46Å; K69-F71 HydrophobicContact CB-CD2 4.12Å; K69-F71 HydrophobicContact CB-CE2 3.6Å; K69-F71 HydrophobicContact CB-CZ 3.97Å; K69-F71 HydrophobicContact CD-CE1 3.87Å; K69-F71 HydrophobicContact CD-CE2 3.88Å; K69-F71 HydrophobicContact CD-CZ 3.32Å; K69-F71 HydrophobicContact CG-CE2 4.43Å; K69-F71 HydrophobicContact CG-CZ 4.33Å; K69-V89 PolarHBondContact N-O 2.7Å; K69-V89 PolarHBondContact O-N 2.66Å; K69-V357 PolarHBondContact NZ-O 3.43Å
70	V	95.4	Very high	91	Very high	41 Å²	41	38.7 Å²	38.7	25%	0.248	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	129.8	162.6	-174.4	0	0	0	0	108	L62 G63 A86 M87 K88	L62-V70 HydrophobicContact CB-CB 4.48Å; L62-V70 HydrophobicContact CB-CG1 4.27Å; L62-V70 HydrophobicContact CD1-CG1 4.41Å; L62-V70 PolarHBondContact N-O 2.97Å; G63-V70 PolarHBondContact N-O 3.13Å; G63-V70 PolarHBondContact O-N 3.43Å; V70-A86 HydrophobicContact CG1-CB 4.28Å; V70-M87 CarbonylContact C-O 3.53Å; V70-M87 WeakPolarHBondContact CA-O 3.39Å; V70-K88 HydrophobicContact CG2-CB 4.36Å; V70-K88 HydrophobicContact CG2-CG 4.19Å
71	F	97.3	Very high	90.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	146.2	177	-58.7	-97.2	0	0	0	110.7	L58 T60 V61 K69 V73 A86 M87 V89 D358	L58-F71 HydrophobicContact CD2-CB 4.19Å; L58-F71 HydrophobicContact CD2-CD1 4.32Å; L58-F71 HydrophobicContact CD2-CD2 4.47Å; L58-F71 HydrophobicContact CD2-CG 4.12Å; T60-F71 CarbonylContact O-C 3.48Å; T60-F71 WeakPolarHBondContact O-CA 3.32Å; V61-F71 HydrophobicContact CG2-CD1 3.97Å; V61-F71 HydrophobicContact CG2-CE1 3.9Å; K69-F71 HydrophobicContact CB-CD2 4.12Å; K69-F71 HydrophobicContact CB-CE2 3.6Å; K69-F71 HydrophobicContact CB-CZ 3.97Å; K69-F71 HydrophobicContact CD-CE1 3.87Å; K69-F71 HydrophobicContact CD-CE2 3.88Å; K69-F71 HydrophobicContact CD-CZ 3.32Å; K69-F71 HydrophobicContact CG-CE2 4.43Å; K69-F71 HydrophobicContact CG-CZ 4.33Å; F71-V73 HydrophobicContact CB-CG1 3.91Å; F71-A86 CarbonylContact O-C 3.53Å; F71-A86 WeakPolarHBondContact O-CA 3.41Å; F71-M87 PolarHBondContact N-O 2.62Å; F71-M87 PolarHBondContact O-N 2.83Å; F71-V89 HydrophobicContact CD2-CG2 3.76Å; F71-V89 HydrophobicContact CE2-CB 4.16Å; F71-V89 HydrophobicContact CE2-CG2 3.74Å; F71-D358 HydrophobicContact CE2-CB 4.26Å; F71-D358 HydrophobicContact CZ-CB 3.99Å
72	Q	97.5	Very high	90.7	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.009	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	130.8	158.8	-173.6	-172.1	41.9	0	0	107.3	L59 T60 L62 I84 E342 V344	L59-Q72 HydrophobicContact CB-CB 4.41Å; L59-Q72 HydrophobicContact CB-CG 4.36Å; L59-Q72 HydrophobicContact CD1-CG 4.28Å; L59-Q72 PolarHBondContact N-O 2.96Å; T60-Q72 PolarHBondContact N-O 3.33Å; T60-Q72 PolarHBondContact O-N 3.45Å; T60-Q72 PolarHBondContact OG1-OE1 3.1Å; L62-Q72 HydrophobicContact CD1-CB 3.94Å; L62-Q72 HydrophobicContact CD2-CB 3.98Å; L62-Q72 HydrophobicContact CG-CB 3.88Å; Q72-I84 HydrophobicContact CG-CG2 3.66Å; Q72-E342 VanDerWaalsContact NE2-C 3.26Å; Q72-E342 PolarHBondContact NE2-O 2.96Å; Q72-V344 VanDerWaalsContact NE2-CG1 3.35Å
73	V	97.8	Very high	90.7	Very high	0 Å²	0	47 Å²	47	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	146.7	-177.2	-53	0	0	0	0	112.1	F56 E57 L58 F71 I84 F85 M87	F56-V73 HydrophobicContact CB-CB 4.21Å; F56-V73 HydrophobicContact CB-CG2 4.26Å; F56-V73 HydrophobicContact CD1-CB 4.48Å; F56-V73 HydrophobicContact CD1-CG2 3.72Å; F56-V73 HydrophobicContact CE1-CG2 4.48Å; F56-V73 HydrophobicContact CG-CG2 4.28Å; E57-V73 CarbonylContact O-C 3.59Å; E57-V73 WeakPolarHBondContact O-CA 3.47Å; E57-V73 VanDerWaalsContact O-CB 3.31Å; E57-V73 WeakPolarHBondContact O-CB 3.44Å; L58-V73 HydrophobicContact CD2-CG1 3.68Å; F71-V73 HydrophobicContact CB-CG1 3.91Å; V73-I84 CarbonylContact O-C 3.56Å; V73-I84 WeakPolarHBondContact O-CA 3.39Å; V73-F85 HydrophobicContact CG2-CB 3.86Å; V73-F85 PolarHBondContact N-O 2.8Å; V73-F85 PolarHBondContact O-N 3.49Å; V73-M87 HydrophobicContact CB-CB 4.5Å; V73-M87 HydrophobicContact CG1-CB 3.6Å; V73-M87 HydrophobicContact CG1-CE 4.08Å; V73-M87 HydrophobicContact CG1-CG 4.46Å; V73-M87 HydrophobicContact CG1-SD 4.11Å; V73-M87 HydrophobicContact CG2-CB 4Å; V73-M87 HydrophobicContact CG2-CE 4.41Å
74	R	97.3	Very high	90.9	Very high	58 Å²	58	46.9 Å²	46.9	22%	0.219	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	130.1	169.5	-163.6	-164.8	-47	-78.3	-5.3	108.8	F56 E57 L59 V76 G82 K83 I84 E342	F56-R74 CarbonylContact C-O 3.55Å; F56-R74 VanDerWaalsContact CA-O 3.31Å; F56-R74 WeakPolarHBondContact CA-O 3.32Å; E57-R74 HydrophobicContact CB-CB 4.23Å; E57-R74 PolarHBondContact N-O 3.36Å; E57-R74 PolarHBondContact O-N 3.43Å; E57-R74 IonicContact OE2-CZ 3.9Å; E57-R74 IonicContact OE2-NE 3.31Å; E57-R74 PolarHBondContact OE2-NE 3.15Å; E57-R74 IonicContact OE2-NH2 3.13Å; L59-R74 HydrophobicContact CD1-CB 4.21Å; L59-R74 HydrophobicContact CG-CB 4.47Å; R74-V76 PolarHBondContact O-N 3.43Å; R74-G82 WeakPolarHBondContact CG-O 3.3Å; R74-K83 WeakPolarHBondContact CA-O 3.17Å; R74-I84 HydrophobicContact CB-CD1 4.11Å; R74-I84 HydrophobicContact CG-CD1 4.04Å; R74-E342 IonicContact CZ-OE1 2.87Å; R74-E342 IonicContact CZ-OE2 2.66Å; R74-E342 VanDerWaalsContact NH1-CD 3.32Å; R74-E342 IonicContact NH1-OE1 2.74Å; R74-E342 PolarHBondContact NH1-OE1 3.33Å; R74-E342 IonicContact NH1-OE2 2.78Å; R74-E342 VanDerWaalsContact NH2-CD 3.28Å; R74-E342 IonicContact NH2-OE1 2.73Å; R74-E342 PolarHBondContact NH2-OE1 2.81Å; R74-E342 IonicContact NH2-OE2 3.56Å; R74-E342 PolarHBondContact NH2-OE2 3.01Å
75	K	95.3	Very high	91.3	Very high	1 Å²	1	40.3 Å²	40.3	0%	0.004	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	127.4	170.1	-166.1	164.2	-171.7	-74.1	0	108.9	C55 F56 Q77 P79 T81 G82 K83 F85 Y125	C55-K75 CarbonylContact O-C 3.56Å; C55-K75 WeakPolarHBondContact O-CA 3.38Å; F56-K75 HydrophobicContact CD1-CB 3.99Å; F56-K75 HydrophobicContact CD1-CG 4.18Å; F56-K75 HydrophobicContact CE1-CB 3.87Å; F56-K75 HydrophobicContact CE1-CD 3.84Å; F56-K75 HydrophobicContact CE1-CG 3.81Å; F56-K75 HydrophobicContact CZ-CD 4.08Å; F56-K75 HydrophobicContact CZ-CG 4.31Å; K75-Q77 PolarHBondContact NZ-O 3.32Å; K75-P79 WeakPolarHBondContact CD-O 3.43Å; K75-P79 WeakPolarHBondContact CE-O 3.23Å; K75-P79 PolarHBondContact NZ-O 2.8Å; K75-T81 CarbonylContact O-C 3.55Å; K75-T81 WeakPolarHBondContact O-CA 3.31Å; K75-G82 PolarHBondContact O-N 2.88Å; K75-K83 PolarHBondContact N-O 2.99Å; K75-F85 HydrophobicContact CB-CD2 4.16Å; K75-F85 HydrophobicContact CB-CE2 3.68Å; K75-F85 HydrophobicContact CD-CE2 4.19Å; K75-Y125 HydrophobicContact CD-CE2 4.29Å; K75-Y125 WeakPolarHBondContact CE-OH 3.31Å
76	V	95.6	Very high	92	Very high	61 Å²	61	38.3 Å²	38.3	37%	0.37	22%	0.222	S	C	.	.			trans	-117.7	-6.9	-172.2	-69.8	0	0	0	0	114.1	C55 E57 R74	C55-V76 WeakPolarHBondContact O-CG2 3.24Å; C55-V76 PolarHBondContact O-N 3.17Å; E57-V76 HydrophobicContact CB-CG1 3.82Å; R74-V76 PolarHBondContact O-N 3.43Å
77	Q	90.3	Very high	93	Very high	91 Å²	91	35.1 Å²	35.1	43%	0.425	20%	0.195	S	C	.	.	S	Bend	trans	-131.8	146.8	175.1	-59.8	-173.1	69.5	0	0	110.5	D54 C55 K75 T81	D54-Q77 PolarHBondContact O-NE2 2.99Å; D54-Q77 PolarHBondContact OD2-NE2 3.26Å; C55-Q77 HydrophobicContact CB-CB 4.39Å; K75-Q77 PolarHBondContact NZ-O 3.32Å; Q77-T81 PolarHBondContact N-OG1 3.14Å; Q77-T81 PolarHBondContact O-OG1 3.16Å
78	G	85	Confident	93.6	Very high	31 Å²	31	32.6 Å²	32.6	32%	0.32	19%	0.186	S	C	.	.	S	Bend	trans	73	-159.9	173	0	0	0	0	0	116.3	E49 T81	E49-G78 WeakPolarHBondContact OE1-CA 3.39Å; G78-T81 PolarHBondContact N-OG1 3.35Å; G78-T81 WeakPolarHBondContact O-CB 3.24Å; G78-T81 PolarHBondContact O-N 3.07Å; G78-T81 PolarHBondContact O-OG1 2.96Å
79	P	81.6	Confident	93.9	Very high	24 Å²	24	32.1 Å²	32.1	16%	0.156	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	148.5	177.8	-26.1	35.2	0	0	0	112.2	E49 K75 T81 L387	E49-P79 WeakPolarHBondContact OE1-CD 3.42Å; E49-P79 WeakPolarHBondContact OE2-CD 3.24Å; K75-P79 WeakPolarHBondContact CD-O 3.43Å; K75-P79 WeakPolarHBondContact CE-O 3.23Å; K75-P79 PolarHBondContact NZ-O 2.8Å; P79-T81 PolarHBondContact O-N 3.01Å; P79-L387 HydrophobicContact CB-CG 4.26Å; P79-L387 HydrophobicContact CG-CD1 3.94Å; P79-L387 HydrophobicContact CG-CD2 3.54Å; P79-L387 HydrophobicContact CG-CG 3.54Å
80	Q	85.1	Confident	93.9	Very high	51 Å²	51	30.4 Å²	30.4	24%	0.238	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	22.6	180	-50.2	172.1	-13.9	0	0	113.5	G82 K83 F85 Y125	Q80-G82 PolarHBondContact O-N 3Å; Q80-K83 HydrophobicContact CB-CB 4.33Å; Q80-K83 HydrophobicContact CB-CD 4.39Å; Q80-K83 WeakPolarHBondContact O-CB 3.3Å; Q80-K83 PolarHBondContact O-N 2.94Å; Q80-K83 VanDerWaalsContact O-N 3.1Å; Q80-F85 HydrophobicContact CB-CZ 4.22Å; Q80-Y125 PolarHBondContact OE1-OH 3.35Å
81	T	92	Very high	93.8	Very high	80 Å²	80	31.2 Å²	31.2	49%	0.491	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	138	170.4	-73.7	0	0	0	0	110.8	K75 Q77 G78 P79 K83	K75-T81 CarbonylContact O-C 3.55Å; K75-T81 WeakPolarHBondContact O-CA 3.31Å; Q77-T81 PolarHBondContact N-OG1 3.14Å; Q77-T81 PolarHBondContact O-OG1 3.16Å; G78-T81 PolarHBondContact N-OG1 3.35Å; G78-T81 WeakPolarHBondContact O-CB 3.24Å; G78-T81 PolarHBondContact O-N 3.07Å; G78-T81 PolarHBondContact O-OG1 2.96Å; P79-T81 PolarHBondContact O-N 3.01Å; T81-K83 VanDerWaalsContact C-N 3.34Å
82	G	93.4	Very high	93.6	Very high	38 Å²	38	31.5 Å²	31.5	39%	0.392	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.9	-25.8	-172.1	0	0	0	0	0	114.2	R74 K75 Q80	R74-G82 WeakPolarHBondContact CG-O 3.3Å; K75-G82 PolarHBondContact O-N 2.88Å; Q80-G82 PolarHBondContact O-N 3Å
83	K	94.7	Very high	93.2	Very high	92 Å²	92	32 Å²	32	40%	0.4	18%	0.179	S	C	.	.			trans	-71.7	144.4	-175.3	-176.6	172.9	174.4	179.9	0	112.7	R74 K75 Q80 T81 F85	R74-K83 WeakPolarHBondContact CA-O 3.17Å; K75-K83 PolarHBondContact N-O 2.99Å; Q80-K83 HydrophobicContact CB-CB 4.33Å; Q80-K83 HydrophobicContact CB-CD 4.39Å; Q80-K83 WeakPolarHBondContact O-CB 3.3Å; Q80-K83 PolarHBondContact O-N 2.94Å; Q80-K83 VanDerWaalsContact O-N 3.1Å; T81-K83 VanDerWaalsContact C-N 3.34Å; K83-F85 HydrophobicContact CB-CE2 3.75Å; K83-F85 HydrophobicContact CB-CZ 4.09Å; K83-F85 HydrophobicContact CD-CE1 4.17Å; K83-F85 HydrophobicContact CD-CE2 4.19Å; K83-F85 HydrophobicContact CD-CZ 3.69Å; K83-F85 HydrophobicContact CG-CD2 4.46Å; K83-F85 HydrophobicContact CG-CE1 4.49Å; K83-F85 HydrophobicContact CG-CE2 3.82Å; K83-F85 HydrophobicContact CG-CZ 3.85Å; K83-F85 VanDerWaalsContact O-CD2 3.32Å; K83-F85 WeakPolarHBondContact O-CD2 3.29Å; K83-F85 WeakPolarHBondContact O-CE2 3.34Å
84	I	96.5	Very high	92.8	Very high	10 Å²	10	36.4 Å²	36.4	5%	0.051	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	138.4	176.9	-50	-55.7	0	0	0	111.8	L59 Q72 V73 R74 C139 E341 E342	L59-I84 HydrophobicContact CD1-CD1 3.78Å; Q72-I84 HydrophobicContact CG-CG2 3.66Å; V73-I84 CarbonylContact O-C 3.56Å; V73-I84 WeakPolarHBondContact O-CA 3.39Å; R74-I84 HydrophobicContact CB-CD1 4.11Å; R74-I84 HydrophobicContact CG-CD1 4.04Å; I84-C139 HydrophobicContact CG2-CB 3.95Å; I84-E341 HydrophobicContact CG1-CB 4.01Å; I84-E342 HydrophobicContact CD1-CG 3.66Å; I84-E342 HydrophobicContact CG1-CG 4.05Å
85	F	97.2	Very high	92.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	164.9	179.2	-60.4	-91.7	0	0	0	111.6	F56 V73 K75 Q80 K83 L124 Y125 I136 L137	F56-F85 HydrophobicContact CE1-CD2 4.28Å; V73-F85 HydrophobicContact CG2-CB 3.86Å; V73-F85 PolarHBondContact N-O 2.8Å; V73-F85 PolarHBondContact O-N 3.49Å; K75-F85 HydrophobicContact CB-CD2 4.16Å; K75-F85 HydrophobicContact CB-CE2 3.68Å; K75-F85 HydrophobicContact CD-CE2 4.19Å; Q80-F85 HydrophobicContact CB-CZ 4.22Å; K83-F85 HydrophobicContact CB-CE2 3.75Å; K83-F85 HydrophobicContact CB-CZ 4.09Å; K83-F85 HydrophobicContact CD-CE1 4.17Å; K83-F85 HydrophobicContact CD-CE2 4.19Å; K83-F85 HydrophobicContact CD-CZ 3.69Å; K83-F85 HydrophobicContact CG-CD2 4.46Å; K83-F85 HydrophobicContact CG-CE1 4.49Å; K83-F85 HydrophobicContact CG-CE2 3.82Å; K83-F85 HydrophobicContact CG-CZ 3.85Å; K83-F85 VanDerWaalsContact O-CD2 3.32Å; K83-F85 WeakPolarHBondContact O-CD2 3.29Å; K83-F85 WeakPolarHBondContact O-CE2 3.34Å; F85-L124 HydrophobicContact CD1-CD2 4.34Å; F85-L124 HydrophobicContact CD1-CG 4.47Å; F85-L124 HydrophobicContact CE1-CB 4.32Å; F85-L124 HydrophobicContact CE1-CD2 4.38Å; F85-L124 HydrophobicContact CE1-CG 4.07Å; F85-Y125 HydrophobicContact CE1-CE2 4.14Å; F85-Y125 HydrophobicContact CZ-CE2 4.21Å; F85-I136 HydrophobicContact CB-CG2 3.64Å; F85-I136 HydrophobicContact CD1-CG2 3.75Å; F85-I136 HydrophobicContact CG-CG2 3.75Å; F85-L137 WeakPolarHBondContact CB-O 3.41Å
86	A	97.3	Very high	92.3	Very high	9 Å²	9	35.9 Å²	35.9	7%	0.074	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	113.2	169	0	0	0	0	0	110.6	L62 V70 F71 L137	L62-A86 HydrophobicContact CD1-CB 4.39Å; V70-A86 HydrophobicContact CG1-CB 4.28Å; F71-A86 CarbonylContact O-C 3.53Å; F71-A86 WeakPolarHBondContact O-CA 3.41Å; A86-L137 HydrophobicContact CB-CB 4.35Å; A86-L137 PolarHBondContact N-O 2.82Å; A86-L137 PolarHBondContact O-N 3.47Å
87	M	97.3	Very high	92	Very high	3 Å²	3	43 Å²	43	2%	0.015	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	107.1	179.2	179.8	-169.4	-79.9	0	0	110.8	F56 L58 V70 F71 V73 V89 F127 Y134 L135 I136	F56-M87 HydrophobicContact CB-CE 3.62Å; F56-M87 HydrophobicContact CD2-CE 3.86Å; F56-M87 HydrophobicContact CG-CE 3.78Å; L58-M87 HydrophobicContact CD2-SD 3.94Å; V70-M87 CarbonylContact C-O 3.53Å; V70-M87 WeakPolarHBondContact CA-O 3.39Å; F71-M87 PolarHBondContact N-O 2.62Å; F71-M87 PolarHBondContact O-N 2.83Å; V73-M87 HydrophobicContact CB-CB 4.5Å; V73-M87 HydrophobicContact CG1-CB 3.6Å; V73-M87 HydrophobicContact CG1-CE 4.08Å; V73-M87 HydrophobicContact CG1-CG 4.46Å; V73-M87 HydrophobicContact CG1-SD 4.11Å; V73-M87 HydrophobicContact CG2-CB 4Å; V73-M87 HydrophobicContact CG2-CE 4.41Å; M87-V89 HydrophobicContact CG-CG2 3.57Å; M87-V89 HydrophobicContact SD-CG2 3.57Å; M87-V89 VanDerWaalsContact SD-CG2 3.57Å; M87-F127 HydrophobicContact CE-CZ 4.38Å; M87-Y134 HydrophobicContact CE-CD1 4.31Å; M87-Y134 HydrophobicContact CG-CD1 4.09Å; M87-Y134 HydrophobicContact SD-CD1 3.71Å; M87-Y134 HydrophobicContact SD-CE1 4.01Å; M87-L135 CarbonylContact C-O 3.59Å; M87-L135 WeakPolarHBondContact CA-O 3.5Å; M87-I136 HydrophobicContact CB-CD1 3.87Å; M87-I136 HydrophobicContact CE-CD1 3.7Å; M87-I136 HydrophobicContact CG-CD1 3.64Å
88	K	95.8	Very high	91.9	Very high	29 Å²	29	41.5 Å²	41.5	13%	0.126	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	106.8	171	-169.7	-177.1	-164	-172.9	0	108.4	V70 L90 E108 L135 D201	V70-K88 HydrophobicContact CG2-CB 4.36Å; V70-K88 HydrophobicContact CG2-CG 4.19Å; K88-L90 HydrophobicContact CG-CD2 4.07Å; K88-L90 HydrophobicContact CG-CG 4.39Å; K88-E108 IonicContact NZ-OE1 3.48Å; K88-E108 PolarHBondContact NZ-OE1 3.28Å; K88-E108 IonicContact NZ-OE2 3.14Å; K88-E108 PolarHBondContact NZ-OE2 3.47Å; K88-L135 HydrophobicContact CB-CB 4.28Å; K88-L135 HydrophobicContact CD-CD1 4.33Å; K88-L135 PolarHBondContact N-O 3.49Å; K88-L135 PolarHBondContact O-N 3.09Å; K88-D201 IonicContact NZ-OD1 2.8Å; K88-D201 PolarHBondContact NZ-OD1 2.94Å
89	V	95.5	Very high	92	Very high	5 Å²	5	44 Å²	44	3%	0.03	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	118.2	-178.9	-172.8	0	0	0	0	110	G68 K69 F71 M87 K132 Y134	G68-V89 CarbonylContact C-O 3.55Å; G68-V89 WeakPolarHBondContact CA-O 3.05Å; K69-V89 PolarHBondContact N-O 2.7Å; K69-V89 PolarHBondContact O-N 2.66Å; F71-V89 HydrophobicContact CD2-CG2 3.76Å; F71-V89 HydrophobicContact CE2-CB 4.16Å; F71-V89 HydrophobicContact CE2-CG2 3.74Å; M87-V89 HydrophobicContact CG-CG2 3.57Å; M87-V89 HydrophobicContact SD-CG2 3.57Å; M87-V89 VanDerWaalsContact SD-CG2 3.57Å; V89-K132 HydrophobicContact CG1-CD 4.12Å; V89-Y134 HydrophobicContact CB-CD1 4.4Å; V89-Y134 HydrophobicContact CB-CE1 4.33Å; V89-Y134 HydrophobicContact CG1-CD1 4.11Å; V89-Y134 HydrophobicContact CG1-CE1 3.69Å; V89-Y134 HydrophobicContact CG2-CD1 3.69Å; V89-Y134 HydrophobicContact CG2-CE1 3.71Å
90	L	93.9	Very high	92.2	Very high	12 Å²	12	49.8 Å²	49.8	6%	0.063	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	133.2	-175	-52	172.7	0	0	0	110.9	K88 I95 T105 K132 L133	K88-L90 HydrophobicContact CG-CD2 4.07Å; K88-L90 HydrophobicContact CG-CG 4.39Å; L90-I95 HydrophobicContact CB-CD1 3.83Å; L90-I95 HydrophobicContact CD1-CD1 4.47Å; L90-T105 HydrophobicContact CD1-CG2 3.74Å; L90-K132 CarbonylContact O-C 3.58Å; L90-K132 VanDerWaalsContact O-CA 3.31Å; L90-K132 WeakPolarHBondContact O-CA 3.02Å; L90-L133 HydrophobicContact CB-CB 4.36Å; L90-L133 PolarHBondContact N-O 2.98Å; L90-L133 PolarHBondContact O-N 3.02Å
91	K	93	Very high	92.4	Very high	58 Å²	58	48.7 Å²	48.7	25%	0.252	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	113.7	177.3	-70.3	-176.8	168.2	-93.5	0	110.5	Y67 A93 K94 I95 P360 D361	Y67-K91 PolarHBondContact O-N 2.73Å; K91-A93 VanDerWaalsContact C-N 3.25Å; K91-A93 PolarHBondContact O-N 2.86Å; K91-K94 HydrophobicContact CB-CD 4.45Å; K91-K94 HydrophobicContact CB-CG 4.3Å; K91-K94 WeakPolarHBondContact O-CB 3.26Å; K91-K94 PolarHBondContact O-N 2.87Å; K91-I95 PolarHBondContact O-N 3.41Å; K91-P360 PolarHBondContact NZ-O 2.83Å; K91-D361 VanDerWaalsContact CD-OD2 3.23Å; K91-D361 WeakPolarHBondContact CD-OD2 3.47Å; K91-D361 WeakPolarHBondContact CE-OD2 3.39Å; K91-D361 VanDerWaalsContact CG-OD2 3.24Å; K91-D361 WeakPolarHBondContact CG-OD2 3.4Å; K91-D361 IonicContact NZ-OD1 2.72Å; K91-D361 IonicContact NZ-OD2 2.65Å; K91-D361 PolarHBondContact NZ-OD2 3.19Å
92	K	92.9	Very high	92.4	Very high	6 Å²	6	45.8 Å²	45.8	3%	0.026	24%	0.235	C	C	.	.	H	α-helix	trans	-53.1	-44	178.4	-70.5	175.3	174.4	174.2	0	111.4	K94 I95 V96 T129 G130 G131 L133 L365 F373	K92-K94 PolarHBondContact O-N 3.41Å; K92-I95 PolarHBondContact O-N 2.9Å; K92-V96 WeakPolarHBondContact O-CG2 3.34Å; K92-V96 PolarHBondContact O-N 3.08Å; K92-T129 WeakPolarHBondContact CE-O 3.42Å; K92-T129 PolarHBondContact NZ-O 3.42Å; K92-G130 WeakPolarHBondContact CD-O 3.41Å; K92-G130 PolarHBondContact NZ-O 3.41Å; K92-G131 WeakPolarHBondContact CB-O 3.31Å; K92-G131 PolarHBondContact N-O 2.73Å; K92-L133 HydrophobicContact CD-CD2 4.34Å; K92-L133 HydrophobicContact CG-CD1 4.42Å; K92-L133 HydrophobicContact CG-CD2 4.11Å; K92-L133 HydrophobicContact CG-CG 3.84Å; K92-L365 HydrophobicContact CB-CD1 3.65Å; K92-L365 HydrophobicContact CD-CD1 3.56Å; K92-L365 HydrophobicContact CG-CD1 4.28Å; K92-F373 HydrophobicContact CB-CE2 4.17Å; K92-F373 HydrophobicContact CD-CD2 4.01Å; K92-F373 HydrophobicContact CD-CE2 4.35Å; K92-F373 HydrophobicContact CG-CD2 3.96Å; K92-F373 HydrophobicContact CG-CE2 3.87Å
93	A	90.4	Very high	92.1	Very high	14 Å²	14	46.8 Å²	46.8	12%	0.116	24%	0.24	C	C	.	.	H	α-helix	trans	-61.7	-9.6	178.3	0	0	0	0	0	115.6	K91 R97 T363 L365	K91-A93 VanDerWaalsContact C-N 3.25Å; K91-A93 PolarHBondContact O-N 2.86Å; A93-R97 PolarHBondContact O-NE 3.19Å; A93-T363 HydrophobicContact CB-CG2 3.67Å; A93-L365 HydrophobicContact CB-CD2 4.02Å
94	K	89.8	Confident	91.8	Very high	92 Å²	92	44.3 Å²	44.3	40%	0.4	23%	0.229	S	C	.	.	H	α-helix	trans	-92.1	-46.1	165.1	-72.1	-175.8	166.9	-173.8	0	111.8	A66 Y67 K91 K92 R97	A66-K94 PolarHBondContact O-NZ 3.15Å; Y67-K94 HydrophobicContact CD1-CB 4.28Å; K91-K94 HydrophobicContact CB-CD 4.45Å; K91-K94 HydrophobicContact CB-CG 4.3Å; K91-K94 WeakPolarHBondContact O-CB 3.26Å; K91-K94 PolarHBondContact O-N 2.87Å; K92-K94 PolarHBondContact O-N 3.41Å; K94-R97 WeakPolarHBondContact O-CB 3.5Å; K94-R97 WeakPolarHBondContact O-CG 3.43Å; K94-R97 PolarHBondContact O-N 3.02Å
95	I	89.9	Confident	91.6	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.8	-48.9	-174.9	-63.4	159.9	0	0	0	111.3	Y67 L90 K91 K92 R97 N98 D101 T102 T105 L133 F373	Y67-I95 HydrophobicContact CD1-CG1 4.41Å; Y67-I95 HydrophobicContact CG-CG1 4.28Å; L90-I95 HydrophobicContact CB-CD1 3.83Å; L90-I95 HydrophobicContact CD1-CD1 4.47Å; K91-I95 PolarHBondContact O-N 3.41Å; K92-I95 PolarHBondContact O-N 2.9Å; I95-R97 PolarHBondContact O-N 3.48Å; I95-N98 PolarHBondContact O-N 2.91Å; I95-N98 VanDerWaalsContact O-N 3.07Å; I95-N98 VanDerWaalsContact O-O 3.06Å; I95-D101 HydrophobicContact CG2-CB 4.35Å; I95-D101 WeakPolarHBondContact CG2-O 3.38Å; I95-T102 VanDerWaalsContact CG2-CA 3.46Å; I95-T102 PolarHBondContact O-OG1 3.11Å; I95-T105 HydrophobicContact CD1-CG2 3.98Å; I95-L133 HydrophobicContact CD1-CD1 4.02Å; I95-F373 HydrophobicContact CB-CZ 4.34Å; I95-F373 HydrophobicContact CG2-CE1 4.38Å; I95-F373 HydrophobicContact CG2-CZ 3.82Å
96	V	91	Very high	91.2	Very high	47 Å²	47	49.2 Å²	49.2	29%	0.285	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-4.5	-173.8	-55.7	0	0	0	0	114.4	K92 N98 L365 A369 F373	K92-V96 WeakPolarHBondContact O-CG2 3.34Å; K92-V96 PolarHBondContact O-N 3.08Å; V96-N98 PolarHBondContact O-N 2.89Å; V96-L365 HydrophobicContact CG2-CD2 4.41Å; V96-A369 HydrophobicContact CB-CB 4.17Å; V96-A369 HydrophobicContact CG1-CB 4.02Å; V96-A369 HydrophobicContact CG2-CB 4.08Å; V96-F373 HydrophobicContact CG1-CE2 3.54Å; V96-F373 HydrophobicContact CG1-CZ 3.95Å
97	R	88.8	Confident	90.9	Very high	212 Å²	212	49.8 Å²	49.8	80%	0.8	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-13.9	170.6	-58	-178.1	-176.7	-136.6	-6.1	112.6	A93 K94 I95	A93-R97 PolarHBondContact O-NE 3.19Å; K94-R97 WeakPolarHBondContact O-CB 3.5Å; K94-R97 WeakPolarHBondContact O-CG 3.43Å; K94-R97 PolarHBondContact O-N 3.02Å; I95-R97 PolarHBondContact O-N 3.48Å
98	N	88.7	Confident	90.6	Very high	58 Å²	58	50 Å²	50	31%	0.31	25%	0.254	S	S	.	.			trans	-142.1	118.5	-179.5	178.1	6.9	0	0	0	109.5	I95 V96 K100 D101 T102	I95-N98 PolarHBondContact O-N 2.91Å; I95-N98 VanDerWaalsContact O-N 3.07Å; I95-N98 VanDerWaalsContact O-O 3.06Å; V96-N98 PolarHBondContact O-N 2.89Å; N98-K100 PolarHBondContact O-N 2.99Å; N98-K100 VanDerWaalsContact O-N 3.16Å; N98-K100 WeakPolarHBondContact OD1-CB 3.39Å; N98-K100 PolarHBondContact OD1-N 3.38Å; N98-D101 HydrophobicContact CB-CB 4.13Å; N98-D101 VanDerWaalsContact CB-OD2 3.23Å; N98-D101 WeakPolarHBondContact CB-OD2 3.41Å; N98-D101 PolarHBondContact ND2-OD1 3.18Å; N98-D101 VanDerWaalsContact ND2-OD1 3.11Å; N98-D101 PolarHBondContact ND2-OD2 3.27Å; N98-D101 PolarHBondContact O-N 2.8Å; N98-D101 VanDerWaalsContact O-N 3.14Å; N98-T102 PolarHBondContact O-N 3.32Å; N98-T102 PolarHBondContact O-OG1 3.11Å
99	A	87.5	Confident	90.5	Very high	84 Å²	84	49.7 Å²	49.7	69%	0.694	25%	0.252	S	S	*	.	H	α-helix	trans	-58.3	-29.3	177.9	0	0	0	0	0	112.6	A103	A99-A103 WeakPolarHBondContact O-CB 3.5Å; A99-A103 PolarHBondContact O-N 2.73Å
100	K	86.6	Confident	90.3	Very high	145 Å²	145	52.4 Å²	52.4	63%	0.63	26%	0.264	S	S	*	.	H	α-helix	trans	-68.2	-50	175.2	-61.4	178.8	-178.5	173.8	0	111.2	N98 T102 A103 H104	N98-K100 PolarHBondContact O-N 2.99Å; N98-K100 VanDerWaalsContact O-N 3.16Å; N98-K100 WeakPolarHBondContact OD1-CB 3.39Å; N98-K100 PolarHBondContact OD1-N 3.38Å; K100-T102 PolarHBondContact O-N 2.91Å; K100-A103 PolarHBondContact O-N 3.05Å; K100-A103 VanDerWaalsContact O-N 3.11Å; K100-H104 VanDerWaalsContact C-CD2 3.49Å; K100-H104 WeakPolarHBondContact O-CB 3.4Å; K100-H104 PolarHBondContact O-CD2 2.9Å; K100-H104 PolarHBondContact O-N 2.85Å
101	D	89.3	Confident	90.3	Very high	28 Å²	28	51.8 Å²	51.8	15%	0.15	26%	0.261	C	S	.	.	H	α-helix	trans	-63.3	-32	-179.7	-58.2	-24.9	0	0	0	111.2	Y67 I95 N98 T105	Y67-D101 HydrophobicContact CE1-CB 4.3Å; Y67-D101 PolarHBondContact OH-OD1 2.89Å; Y67-D101 VanDerWaalsContact OH-OD1 3.14Å; Y67-D101 PolarHBondContact OH-OD2 3.33Å; Y67-D101 VanDerWaalsContact OH-OD2 3.11Å; I95-D101 HydrophobicContact CG2-CB 4.35Å; I95-D101 WeakPolarHBondContact CG2-O 3.38Å; N98-D101 HydrophobicContact CB-CB 4.13Å; N98-D101 VanDerWaalsContact CB-OD2 3.23Å; N98-D101 WeakPolarHBondContact CB-OD2 3.41Å; N98-D101 PolarHBondContact ND2-OD1 3.18Å; N98-D101 VanDerWaalsContact ND2-OD1 3.11Å; N98-D101 PolarHBondContact ND2-OD2 3.27Å; N98-D101 PolarHBondContact O-N 2.8Å; N98-D101 VanDerWaalsContact O-N 3.14Å; D101-T105 WeakPolarHBondContact O-CB 3.23Å; D101-T105 PolarHBondContact O-N 3Å; D101-T105 PolarHBondContact O-OG1 3.11Å
102	T	90.2	Very high	90.4	Very high	20 Å²	20	49.4 Å²	49.4	12%	0.123	25%	0.251	C	S	.	.	H	α-helix	trans	-63.9	-50.1	172.1	-54	0	0	0	0	111.6	I95 N98 K100 T105 R106 A372 F373	I95-T102 VanDerWaalsContact CG2-CA 3.46Å; I95-T102 PolarHBondContact O-OG1 3.11Å; N98-T102 PolarHBondContact O-N 3.32Å; N98-T102 PolarHBondContact O-OG1 3.11Å; K100-T102 PolarHBondContact O-N 2.91Å; T102-T105 PolarHBondContact O-N 2.76Å; T102-R106 PolarHBondContact O-N 3.38Å; T102-R106 VanDerWaalsContact O-N 3.08Å; T102-A372 HydrophobicContact CG2-CB 4.07Å; T102-F373 HydrophobicContact CG2-CE1 4.14Å; T102-F373 HydrophobicContact CG2-CZ 3.97Å
103	A	88.1	Confident	90.3	Very high	59 Å²	59	53.4 Å²	53.4	49%	0.488	27%	0.27	S	S	.	.	H	α-helix	trans	-63.6	-39.4	175.6	0	0	0	0	0	112.6	A99 K100 R106 A107	A99-A103 WeakPolarHBondContact O-CB 3.5Å; A99-A103 PolarHBondContact O-N 2.73Å; K100-A103 PolarHBondContact O-N 3.05Å; K100-A103 VanDerWaalsContact O-N 3.11Å; A103-R106 PolarHBondContact O-N 2.97Å; A103-A107 VanDerWaalsContact O-CB 3.26Å; A103-A107 WeakPolarHBondContact O-CB 3.45Å; A103-A107 PolarHBondContact O-N 2.77Å
104	H	88.9	Confident	90.3	Very high	40 Å²	40	58 Å²	58	19%	0.185	29%	0.287	C	S	.	.	H	α-helix	trans	-62.4	-44.4	175.3	-77	-61.5	0	0	0	112	K100 R106 A107 E108 G203	K100-H104 VanDerWaalsContact C-CD2 3.49Å; K100-H104 WeakPolarHBondContact O-CB 3.4Å; K100-H104 PolarHBondContact O-CD2 2.9Å; K100-H104 PolarHBondContact O-N 2.85Å; H104-R106 VanDerWaalsContact C-N 3.34Å; H104-R106 PolarHBondContact O-N 3.25Å; H104-A107 PolarHBondContact O-N 2.78Å; H104-E108 WeakPolarHBondContact O-CB 3.31Å; H104-E108 PolarHBondContact O-N 2.89Å; H104-G203 VanDerWaalsContact CB-O 3.32Å; H104-G203 WeakPolarHBondContact CB-O 3.5Å; H104-G203 VanDerWaalsContact CG-O 3.32Å; H104-G203 PolarHBondContact ND1-O 3.14Å
105	T	91.3	Very high	90.4	Very high	7 Å²	7	54 Å²	54	4%	0.043	27%	0.27	C	S	.	.	H	α-helix	trans	-67.1	-35.6	178.6	-53.3	0	0	0	0	112	L90 I95 D101 T102 L133 F373	L90-T105 HydrophobicContact CD1-CG2 3.74Å; I95-T105 HydrophobicContact CD1-CG2 3.98Å; D101-T105 WeakPolarHBondContact O-CB 3.23Å; D101-T105 PolarHBondContact O-N 3Å; D101-T105 PolarHBondContact O-OG1 3.11Å; T102-T105 PolarHBondContact O-N 2.76Å; T105-L133 HydrophobicContact CG2-CD1 3.68Å; T105-F373 HydrophobicContact CG2-CE1 4.47Å
106	R	90	Very high	90.6	Very high	105 Å²	105	61.4 Å²	61.4	40%	0.396	30%	0.298	S	S	.	.	H	α-helix	trans	-69.2	-47.7	174.6	-164.4	-168	-70	-174.9	-5.1	111.3	T102 A103 H104 E108 R109 E110 A372	T102-R106 PolarHBondContact O-N 3.38Å; T102-R106 VanDerWaalsContact O-N 3.08Å; A103-R106 PolarHBondContact O-N 2.97Å; H104-R106 VanDerWaalsContact C-N 3.34Å; H104-R106 PolarHBondContact O-N 3.25Å; R106-E108 VanDerWaalsContact C-N 3.34Å; R106-E108 PolarHBondContact O-N 3.07Å; R106-R109 PolarHBondContact O-N 2.74Å; R106-R109 VanDerWaalsContact O-N 3.15Å; R106-E110 WeakPolarHBondContact CD-OE1 3.44Å; R106-E110 HydrophobicContact CG-CG 4.46Å; R106-E110 VanDerWaalsContact CG-OE1 3.3Å; R106-E110 WeakPolarHBondContact CG-OE1 3.43Å; R106-E110 WeakPolarHBondContact O-CG 3.33Å; R106-E110 PolarHBondContact O-N 3.29Å; R106-A372 PolarHBondContact NE-O 2.74Å; R106-A372 PolarHBondContact NH2-O 3.38Å
107	A	89.1	Confident	90.9	Very high	21 Å²	21	60.1 Å²	60.1	17%	0.174	29%	0.289	C	S	.	.	H	α-helix	trans	-62.1	-36.6	179	0	0	0	0	0	112.9	A103 H104 R109 E110 I111	A103-A107 VanDerWaalsContact O-CB 3.26Å; A103-A107 WeakPolarHBondContact O-CB 3.45Å; A103-A107 PolarHBondContact O-N 2.77Å; H104-A107 PolarHBondContact O-N 2.78Å; A107-R109 VanDerWaalsContact C-N 3.35Å; A107-R109 PolarHBondContact O-N 2.79Å; A107-E110 PolarHBondContact O-N 2.73Å; A107-I111 VanDerWaalsContact O-CB 3.31Å; A107-I111 WeakPolarHBondContact O-CB 3.5Å; A107-I111 VanDerWaalsContact O-CG1 3.31Å; A107-I111 WeakPolarHBondContact O-CG1 3.18Å; A107-I111 PolarHBondContact O-N 2.97Å
108	E	92.5	Very high	91.3	Very high	7 Å²	7	52.2 Å²	52.2	3%	0.033	27%	0.265	C	S	.	.	H	α-helix	trans	-56.5	-48.5	172.4	171.9	165.5	-140.1	0	0	111.3	K88 H104 R106 L112 L135 F202	K88-E108 IonicContact NZ-OE1 3.48Å; K88-E108 PolarHBondContact NZ-OE1 3.28Å; K88-E108 IonicContact NZ-OE2 3.14Å; K88-E108 PolarHBondContact NZ-OE2 3.47Å; H104-E108 WeakPolarHBondContact O-CB 3.31Å; H104-E108 PolarHBondContact O-N 2.89Å; R106-E108 VanDerWaalsContact C-N 3.34Å; R106-E108 PolarHBondContact O-N 3.07Å; E108-L112 HydrophobicContact CG-CD1 3.72Å; E108-L112 VanDerWaalsContact O-CB 3.3Å; E108-L112 WeakPolarHBondContact O-CB 3.49Å; E108-L112 VanDerWaalsContact O-CG 3.26Å; E108-L112 WeakPolarHBondContact O-CG 3.14Å; E108-L112 PolarHBondContact O-N 2.92Å; E108-L135 HydrophobicContact CG-CD1 4.35Å; E108-F202 HydrophobicContact CG-CB 4.2Å; E108-F202 PolarHBondContact OE1-N 2.8Å
109	R	92.9	Very high	91.8	Very high	23 Å²	23	49.5 Å²	49.5	9%	0.087	25%	0.251	C	S	.	.	H	α-helix	trans	-67.7	-37.3	179.2	-173.8	-120.4	63.9	88.4	-11.1	112.4	R106 A107 E113 A126 L135 F376	R106-R109 PolarHBondContact O-N 2.74Å; R106-R109 VanDerWaalsContact O-N 3.15Å; A107-R109 VanDerWaalsContact C-N 3.35Å; A107-R109 PolarHBondContact O-N 2.79Å; R109-E113 IonicContact CZ-OE2 3.66Å; R109-E113 IonicContact NH1-OE2 3.64Å; R109-E113 PolarHBondContact NH1-OE2 3.06Å; R109-E113 IonicContact NH2-OE2 3.45Å; R109-E113 PolarHBondContact NH2-OE2 3.48Å; R109-E113 PolarHBondContact O-N 3.27Å; R109-A126 HydrophobicContact CG-CB 4.32Å; R109-L135 HydrophobicContact CB-CD2 4.28Å; R109-L135 HydrophobicContact CG-CD2 4Å; R109-F376 HydrophobicContact CB-CD2 4.34Å; R109-F376 HydrophobicContact CB-CE2 3.85Å; R109-F376 HydrophobicContact CB-CZ 4.47Å; R109-F376 HydrophobicContact CG-CD2 4.12Å; R109-F376 HydrophobicContact CG-CE2 3.88Å; R109-F376 HydrophobicContact CG-CZ 4.28Å
110	E	92	Very high	92.3	Very high	62 Å²	62	45.6 Å²	45.6	29%	0.29	22%	0.218	S	C	.	.	H	α-helix	trans	-68.1	-40.1	177.1	-71.5	163.9	169.9	0	0	112.6	R106 A107 K114	R106-E110 WeakPolarHBondContact CD-OE1 3.44Å; R106-E110 HydrophobicContact CG-CG 4.46Å; R106-E110 VanDerWaalsContact CG-OE1 3.3Å; R106-E110 WeakPolarHBondContact CG-OE1 3.43Å; R106-E110 WeakPolarHBondContact O-CG 3.33Å; R106-E110 PolarHBondContact O-N 3.29Å; A107-E110 PolarHBondContact O-N 2.73Å; E110-K114 WeakPolarHBondContact O-CD 3.38Å; E110-K114 WeakPolarHBondContact O-CG 3.33Å; E110-K114 PolarHBondContact O-N 2.87Å
111	I	93.4	Very high	92.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-68.5	-45.3	176	-75	168	0	0	0	110.9	A107 E113 K114 V115 I179 F202 E207	A107-I111 VanDerWaalsContact O-CB 3.31Å; A107-I111 WeakPolarHBondContact O-CB 3.5Å; A107-I111 VanDerWaalsContact O-CG1 3.31Å; A107-I111 WeakPolarHBondContact O-CG1 3.18Å; A107-I111 PolarHBondContact O-N 2.97Å; I111-E113 PolarHBondContact O-N 3.45Å; I111-K114 PolarHBondContact O-N 2.66Å; I111-K114 VanDerWaalsContact O-N 3.17Å; I111-V115 HydrophobicContact CG2-CG2 4.19Å; I111-V115 WeakPolarHBondContact O-CB 3.34Å; I111-V115 WeakPolarHBondContact O-CG2 3.31Å; I111-V115 PolarHBondContact O-N 3.4Å; I111-I179 HydrophobicContact CD1-CG2 3.97Å; I111-I179 HydrophobicContact CG1-CD1 4.24Å; I111-I179 HydrophobicContact CG1-CG1 4.3Å; I111-I179 HydrophobicContact CG1-CG2 4.31Å; I111-I179 HydrophobicContact CG2-CD1 4.17Å; I111-I179 HydrophobicContact CG2-CG2 4.2Å; I111-F202 HydrophobicContact CG2-CB 4.25Å; I111-F202 HydrophobicContact CG2-CD1 3.63Å; I111-F202 HydrophobicContact CG2-CE1 4.33Å; I111-F202 HydrophobicContact CG2-CG 4.11Å; I111-E207 HydrophobicContact CG1-CG 4.23Å
112	L	94.2	Very high	93.1	Very high	7 Å²	7	39.7 Å²	39.7	4%	0.037	19%	0.194	C	C	.	.	H	α-helix	trans	-69.1	-16.5	-179.8	-75.1	172.3	0	0	0	114.5	E108 V121 L123 L137 F202	E108-L112 HydrophobicContact CG-CD1 3.72Å; E108-L112 VanDerWaalsContact O-CB 3.3Å; E108-L112 WeakPolarHBondContact O-CB 3.49Å; E108-L112 VanDerWaalsContact O-CG 3.26Å; E108-L112 WeakPolarHBondContact O-CG 3.14Å; E108-L112 PolarHBondContact O-N 2.92Å; L112-V121 HydrophobicContact CD2-CG1 3.9Å; L112-L123 HydrophobicContact CB-CB 3.87Å; L112-L123 HydrophobicContact CB-CD2 3.78Å; L112-L123 HydrophobicContact CB-CG 4.43Å; L112-L137 HydrophobicContact CD1-CD2 4.17Å; L112-F202 HydrophobicContact CD2-CD2 3.66Å; L112-F202 HydrophobicContact CD2-CE2 4.09Å; L112-F202 HydrophobicContact CD2-CG 4.3Å; L112-F202 HydrophobicContact CG-CB 4.46Å; L112-F202 HydrophobicContact CG-CD2 4.26Å
113	E	92.6	Very high	93.4	Very high	90 Å²	90	39.1 Å²	39.1	42%	0.421	19%	0.19	S	C	.	.	H	α-helix	trans	-79.9	-40.3	168.5	165.3	169.7	-139.9	0	0	112.2	R109 I111 F378	R109-E113 IonicContact CZ-OE2 3.66Å; R109-E113 IonicContact NH1-OE2 3.64Å; R109-E113 PolarHBondContact NH1-OE2 3.06Å; R109-E113 IonicContact NH2-OE2 3.45Å; R109-E113 PolarHBondContact NH2-OE2 3.48Å; R109-E113 PolarHBondContact O-N 3.27Å; I111-E113 PolarHBondContact O-N 3.45Å; E113-F378 HydrophobicContact CB-CD2 4.42Å; E113-F378 HydrophobicContact CB-CE2 4.03Å; E113-F378 HydrophobicContact CB-CZ 4.2Å; E113-F378 HydrophobicContact CG-CD2 4.09Å; E113-F378 HydrophobicContact CG-CE2 3.55Å; E113-F378 HydrophobicContact CG-CZ 4.1Å; E113-F378 VanDerWaalsContact OE1-CD2 3.31Å; E113-F378 WeakPolarHBondContact OE1-CD2 3.23Å; E113-F378 VanDerWaalsContact OE1-CE2 3.3Å; E113-F378 WeakPolarHBondContact OE1-CE2 3.47Å
114	K	89	Confident	93.7	Very high	112 Å²	112	37 Å²	37	49%	0.487	17%	0.17	S	C	.	.	H	α-helix	trans	-77.1	-32	-174.8	-68.5	168.5	-176.5	173.2	0	113.1	E110 I111 E207	E110-K114 WeakPolarHBondContact O-CD 3.38Å; E110-K114 WeakPolarHBondContact O-CG 3.33Å; E110-K114 PolarHBondContact O-N 2.87Å; I111-K114 PolarHBondContact O-N 2.66Å; I111-K114 VanDerWaalsContact O-N 3.17Å; K114-E207 IonicContact NZ-OE1 3.92Å; K114-E207 PolarHBondContact NZ-OE1 3.17Å; K114-E207 IonicContact NZ-OE2 2.79Å; K114-E207 PolarHBondContact NZ-OE2 3.39Å
115	V	92.9	Very high	94	Very high	8 Å²	8	35.1 Å²	35.1	5%	0.048	16%	0.162	C	C	.	.			trans	-96	130.4	-169.9	174.8	0	0	0	0	111.4	I111 I120 L174 I179	I111-V115 HydrophobicContact CG2-CG2 4.19Å; I111-V115 WeakPolarHBondContact O-CB 3.34Å; I111-V115 WeakPolarHBondContact O-CG2 3.31Å; I111-V115 PolarHBondContact O-N 3.4Å; V115-I120 HydrophobicContact CG1-CB 4.32Å; V115-I120 HydrophobicContact CG1-CD1 3.52Å; V115-I120 HydrophobicContact CG1-CG2 3.86Å; V115-L174 HydrophobicContact CB-CD2 4.48Å; V115-L174 HydrophobicContact CG1-CD2 3.92Å; V115-L174 HydrophobicContact CG2-CD2 3.79Å; V115-I179 HydrophobicContact CG2-CD1 3.41Å; V115-I179 VanDerWaalsContact CG2-CD1 3.41Å
116	R	94	Very high	94.2	Very high	154 Å²	154	35 Å²	35	58%	0.581	16%	0.161	S	C	*	.			trans	-144.1	109.3	173.8	-169.2	175.9	-179.9	-163.2	-4.2	110.5	H173	R116-H173 PolarHBondContact O-CE1 3.49Å
117	H	97.4	Very high	94.4	Very high	20 Å²	20	30.4 Å²	30.4	9%	0.093	14%	0.144	C	C	.	.			trans	-146.8	145.2	-174.3	-168.7	-112	0	0	0	111.4	F119 I120 H173	H117-F119 AromaticContact CE1-CD2 3.7Å; H117-F119 PolarHBondContact O-N 3.1Å; H117-I120 HydrophobicContact CB-CB 4.1Å; H117-I120 HydrophobicContact CB-CD1 3.83Å; H117-I120 HydrophobicContact CB-CG1 3.97Å; H117-I120 PolarHBondContact O-N 2.87Å; H117-H173 AromaticContact CD2-CG 3.65Å; H117-H173 AromaticContact CD2-ND1 3.64Å; H117-H173 AromaticContact CG-CG 3.88Å
118	P	97.5	Very high	94.6	Very high	47 Å²	47	32.2 Å²	32.2	31%	0.305	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-20.2	-178	-28.4	37.8	0	0	0	115.3	K198 L326 K328	P118-K198 VanDerWaalsContact O-CE 3.3Å; P118-K198 WeakPolarHBondContact O-CE 3.42Å; P118-L326 HydrophobicContact CG-CD1 3.91Å; P118-K328 WeakPolarHBondContact O-CE 2.9Å; P118-K328 PolarHBondContact O-NZ 2.91Å
119	F	98.5	Very high	94.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.3	19.1	-178.8	-51.4	-50.2	0	0	0	114.1	H117 E166 M169 A170 H196 I197 K198 L199 L325 K328	H117-F119 AromaticContact CE1-CD2 3.7Å; H117-F119 PolarHBondContact O-N 3.1Å; F119-E166 HydrophobicContact CD1-CB 3.99Å; F119-E166 HydrophobicContact CD1-CG 4.15Å; F119-E166 HydrophobicContact CD2-CB 3.84Å; F119-E166 HydrophobicContact CD2-CG 4.36Å; F119-E166 WeakPolarHBondContact CD2-O 3.2Å; F119-E166 HydrophobicContact CE1-CB 4.04Å; F119-E166 VanDerWaalsContact CE1-CD 3.41Å; F119-E166 HydrophobicContact CE1-CG 3.7Å; F119-E166 WeakPolarHBondContact CE1-OE1 3.41Å; F119-E166 HydrophobicContact CE2-CB 3.91Å; F119-E166 HydrophobicContact CE2-CG 3.95Å; F119-E166 HydrophobicContact CG-CB 3.9Å; F119-E166 HydrophobicContact CG-CG 4.47Å; F119-E166 HydrophobicContact CZ-CB 4Å; F119-E166 HydrophobicContact CZ-CG 3.59Å; F119-E166 WeakPolarHBondContact CZ-OE1 3.26Å; F119-M169 HydrophobicContact CD2-CB 4.2Å; F119-M169 HydrophobicContact CE2-CB 4.39Å; F119-M169 HydrophobicContact CE2-SD 4.13Å; F119-A170 HydrophobicContact CB-CB 4.08Å; F119-H196 HydrophobicContact CD1-CB 4.47Å; F119-H196 HydrophobicContact CE1-CB 4.2Å; F119-I197 WeakPolarHBondContact CA-O 3.41Å; F119-I197 HydrophobicContact CB-CD1 3.92Å; F119-I197 WeakPolarHBondContact CD1-O 3.15Å; F119-K198 WeakPolarHBondContact O-CA 3.41Å; F119-L199 PolarHBondContact O-N 3.27Å; F119-L325 HydrophobicContact CZ-CG 4.29Å; F119-L325 WeakPolarHBondContact CZ-O 3.5Å; F119-K328 HydrophobicContact CE1-CD 4.46Å; F119-K328 VanDerWaalsContact CE1-CE 3.43Å; F119-K328 HydrophobicContact CE1-CG 4.18Å
120	I	98.2	Very high	94.1	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.01	18%	0.182	C	C	.	.	B	Isolated β-bridge	trans	-125.3	142.5	173	-62.9	175.6	0	0	0	108.9	V115 H117 D122 A170 L174 K198 F202	V115-I120 HydrophobicContact CG1-CB 4.32Å; V115-I120 HydrophobicContact CG1-CD1 3.52Å; V115-I120 HydrophobicContact CG1-CG2 3.86Å; H117-I120 HydrophobicContact CB-CB 4.1Å; H117-I120 HydrophobicContact CB-CD1 3.83Å; H117-I120 HydrophobicContact CB-CG1 3.97Å; H117-I120 PolarHBondContact O-N 2.87Å; I120-D122 PolarHBondContact O-N 3.2Å; I120-A170 HydrophobicContact CD1-CB 4.29Å; I120-A170 HydrophobicContact CG1-CB 3.92Å; I120-L174 HydrophobicContact CD1-CD1 4.12Å; I120-L174 HydrophobicContact CD1-CD2 3.9Å; I120-L174 HydrophobicContact CD1-CG 3.73Å; I120-K198 WeakPolarHBondContact O-CD 3.33Å; I120-K198 WeakPolarHBondContact O-CE 3.32Å; I120-K198 PolarHBondContact O-NZ 3.31Å; I120-F202 HydrophobicContact CG2-CE2 3.83Å; I120-F202 HydrophobicContact CG2-CZ 3.55Å
121	V	97.3	Very high	94	Very high	5 Å²	5	32.9 Å²	32.9	3%	0.03	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-62.4	126.3	-179.9	72.2	0	0	0	0	112	L112 L137 E138 L140 L199 T200 F202	L112-V121 HydrophobicContact CD2-CG1 3.9Å; V121-L137 HydrophobicContact CG2-CB 4.07Å; V121-E138 WeakPolarHBondContact CA-OE1 3.47Å; V121-E138 HydrophobicContact CG2-CG 3.91Å; V121-L140 HydrophobicContact CB-CD1 4.4Å; V121-L140 HydrophobicContact CG2-CD1 4.01Å; V121-L199 WeakPolarHBondContact CB-O 3.43Å; V121-L199 WeakPolarHBondContact CG1-O 3.34Å; V121-L199 PolarHBondContact N-O 2.88Å; V121-T200 HydrophobicContact CB-CG2 4.21Å; V121-T200 HydrophobicContact CG1-CG2 4.4Å; V121-F202 HydrophobicContact CG1-CE2 4.19Å
122	D	95.8	Very high	94	Very high	45 Å²	45	33.4 Å²	33.4	24%	0.241	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-77	132.8	175.3	-70.3	-62.4	0	0	0	110.1	I120 L124 L137 E138 K198	I120-D122 PolarHBondContact O-N 3.2Å; D122-L124 HydrophobicContact CB-CD1 4.38Å; D122-L124 HydrophobicContact CB-CD2 4.23Å; D122-L124 WeakPolarHBondContact O-CD2 3.34Å; D122-L137 WeakPolarHBondContact O-CA 3.44Å; D122-E138 PolarHBondContact N-OE1 3.44Å; D122-E138 PolarHBondContact O-N 3.3Å; D122-K198 IonicContact OD2-NZ 3.07Å; D122-K198 PolarHBondContact OD2-NZ 3.34Å; D122-K198 VanDerWaalsContact OD2-NZ 3.07Å
123	L	96.3	Very high	94	Very high	8 Å²	8	33.1 Å²	33.1	4%	0.042	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	122.5	164.4	174.2	68.6	0	0	0	108.9	L112 Y125 L135 L137 F378 A380	L112-L123 HydrophobicContact CB-CB 3.87Å; L112-L123 HydrophobicContact CB-CD2 3.78Å; L112-L123 HydrophobicContact CB-CG 4.43Å; L123-Y125 VanDerWaalsContact CD1-O 3.32Å; L123-Y125 WeakPolarHBondContact CD1-O 3.47Å; L123-L135 HydrophobicContact CD1-CB 3.98Å; L123-L135 HydrophobicContact CD1-CD2 3.84Å; L123-L135 HydrophobicContact CD1-CG 4.5Å; L123-L135 HydrophobicContact CD2-CD2 4.27Å; L123-L137 HydrophobicContact CB-CD2 4.08Å; L123-L137 HydrophobicContact CD1-CD2 3.81Å; L123-F378 HydrophobicContact CD2-CD1 3.9Å; L123-F378 HydrophobicContact CD2-CE1 4.05Å; L123-F378 HydrophobicContact CG-CD1 4.06Å; L123-F378 HydrophobicContact CG-CE1 4.03Å; L123-A380 WeakPolarHBondContact O-CB 3.3Å
124	L	94.9	Very high	94.1	Very high	13 Å²	13	29.1 Å²	29.1	7%	0.068	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	-35.6	-177	-64.6	-47.5	0	0	0	112.5	F85 D122 I136 E138 A380 V383	F85-L124 HydrophobicContact CD1-CD2 4.34Å; F85-L124 HydrophobicContact CD1-CG 4.47Å; F85-L124 HydrophobicContact CE1-CB 4.32Å; F85-L124 HydrophobicContact CE1-CD2 4.38Å; F85-L124 HydrophobicContact CE1-CG 4.07Å; D122-L124 HydrophobicContact CB-CD1 4.38Å; D122-L124 HydrophobicContact CB-CD2 4.23Å; D122-L124 WeakPolarHBondContact O-CD2 3.34Å; L124-I136 PolarHBondContact N-O 2.97Å; L124-E138 HydrophobicContact CD2-CB 4.27Å; L124-A380 HydrophobicContact CD1-CB 4.38Å; L124-A380 WeakPolarHBondContact O-CB 3.16Å; L124-A380 PolarHBondContact O-N 3.32Å; L124-V383 HydrophobicContact CB-CG2 4.27Å
125	Y	94.4	Very high	94.5	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.008	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	145.2	178.3	-44.5	-100.5	0	0	0	110.1	V51 F56 K75 Q80 F85 L123 I136 F378 V379 V383	V51-Y125 HydrophobicContact CB-CD1 4.23Å; V51-Y125 HydrophobicContact CG1-CD1 3.87Å; V51-Y125 HydrophobicContact CG1-CE1 4.44Å; V51-Y125 HydrophobicContact CG1-CG 4.19Å; V51-Y125 HydrophobicContact CG2-CD1 3.79Å; V51-Y125 HydrophobicContact CG2-CE1 3.91Å; F56-Y125 HydrophobicContact CZ-CD2 4.34Å; K75-Y125 HydrophobicContact CD-CE2 4.29Å; K75-Y125 WeakPolarHBondContact CE-OH 3.31Å; Q80-Y125 PolarHBondContact OE1-OH 3.35Å; F85-Y125 HydrophobicContact CE1-CE2 4.14Å; F85-Y125 HydrophobicContact CZ-CE2 4.21Å; L123-Y125 VanDerWaalsContact CD1-O 3.32Å; L123-Y125 WeakPolarHBondContact CD1-O 3.47Å; Y125-I136 HydrophobicContact CD2-CB 3.87Å; Y125-I136 HydrophobicContact CD2-CG1 4.34Å; Y125-I136 HydrophobicContact CD2-CG2 3.77Å; Y125-I136 HydrophobicContact CE2-CG2 4.47Å; Y125-I136 HydrophobicContact CG-CB 4.39Å; Y125-I136 PolarHBondContact N-O 3.39Å; Y125-I136 PolarHBondContact O-N 2.92Å; Y125-F378 CarbonylContact C-O 3.55Å; Y125-F378 WeakPolarHBondContact CA-O 3.13Å; Y125-V379 HydrophobicContact CD1-CG1 4.06Å; Y125-V379 HydrophobicContact CD1-CG2 4.27Å; Y125-V379 HydrophobicContact CE1-CG1 4.13Å; Y125-V383 HydrophobicContact CE1-CG1 3.79Å; Y125-V383 HydrophobicContact CE1-CG2 4.17Å; Y125-V383 HydrophobicContact CE2-CG2 4.22Å; Y125-V383 WeakPolarHBondContact OH-CG1 3.42Å
126	A	95.1	Very high	94.6	Very high	3 Å²	3	23.5 Å²	23.5	3%	0.025	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	142.3	162.5	0	0	0	0	0	109.6	R109 Y134 L135 F376 S377 F378	R109-A126 HydrophobicContact CG-CB 4.32Å; A126-Y134 WeakPolarHBondContact CA-O 3.27Å; A126-L135 HydrophobicContact CB-CD2 3.7Å; A126-F376 HydrophobicContact CB-CD1 4.24Å; A126-F376 HydrophobicContact CB-CE1 3.95Å; A126-F376 WeakPolarHBondContact CB-O 3.36Å; A126-S377 CarbonylContact O-C 3.56Å; A126-S377 VanDerWaalsContact O-CA 3.29Å; A126-S377 WeakPolarHBondContact O-CA 3.38Å; A126-F378 HydrophobicContact CB-CB 3.96Å; A126-F378 PolarHBondContact N-O 2.95Å; A126-F378 PolarHBondContact O-N 2.64Å
127	F	94.1	Very high	94.8	Very high	10 Å²	10	17.1 Å²	17.1	4%	0.044	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	174	175.6	56	-92.9	0	0	0	110.9	V51 P53 F56 M87 Y134 I136 F376	V51-F127 HydrophobicContact CG1-CD1 3.99Å; V51-F127 HydrophobicContact CG1-CE1 3.91Å; V51-F127 WeakPolarHBondContact O-CG 3.32Å; P53-F127 HydrophobicContact CB-CE2 4.36Å; P53-F127 HydrophobicContact CG-CE2 3.9Å; F56-F127 HydrophobicContact CD2-CE1 4.32Å; F56-F127 HydrophobicContact CD2-CZ 4.1Å; F56-F127 AromaticContact CE2-CE1 3.67Å; F56-F127 HydrophobicContact CE2-CE1 3.67Å; F56-F127 AromaticContact CE2-CZ 3.91Å; F56-F127 HydrophobicContact CE2-CZ 3.91Å; F56-F127 HydrophobicContact CZ-CE1 4.46Å; M87-F127 HydrophobicContact CE-CZ 4.38Å; F127-Y134 AromaticContact CD2-CD2 3.73Å; F127-Y134 HydrophobicContact CD2-CD2 3.73Å; F127-Y134 AromaticContact CD2-CG 3.79Å; F127-Y134 HydrophobicContact CD2-CG 3.79Å; F127-Y134 VanDerWaalsContact CE2-CB 3.41Å; F127-Y134 AromaticContact CE2-CD1 3.79Å; F127-Y134 HydrophobicContact CE2-CD1 3.79Å; F127-Y134 AromaticContact CE2-CD2 3.59Å; F127-Y134 HydrophobicContact CE2-CD2 3.59Å; F127-Y134 HydrophobicContact CE2-CE1 4.47Å; F127-Y134 HydrophobicContact CE2-CE2 4.29Å; F127-Y134 AromaticContact CE2-CG 3.32Å; F127-Y134 HydrophobicContact CE2-CG 3.32Å; F127-Y134 HydrophobicContact CZ-CD1 4.13Å; F127-Y134 AromaticContact CZ-CG 3.91Å; F127-Y134 HydrophobicContact CZ-CG 3.91Å; F127-Y134 PolarHBondContact N-O 2.65Å; F127-Y134 PolarHBondContact O-N 3.45Å; F127-I136 HydrophobicContact CD1-CG1 4.44Å; F127-I136 HydrophobicContact CE1-CD1 3.85Å; F127-I136 HydrophobicContact CE1-CG1 3.65Å; F127-I136 HydrophobicContact CZ-CD1 4.11Å; F127-I136 HydrophobicContact CZ-CG1 4.41Å; F127-F376 WeakPolarHBondContact O-CE1 3.42Å
128	Q	92.8	Very high	94.7	Very high	58 Å²	58	18 Å²	18	27%	0.271	11%	0.109	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	156	-176.7	61.4	178.8	-44	0	0	112.3	K132 L133 F373 F376	Q128-K132 WeakPolarHBondContact CA-O 3.26Å; Q128-K132 WeakPolarHBondContact CB-O 3.26Å; Q128-L133 HydrophobicContact CB-CD2 3.77Å; Q128-F373 PolarHBondContact NE2-O 3.39Å; Q128-F376 HydrophobicContact CB-CD1 4.39Å
129	T	90.3	Very high	94.6	Very high	53 Å²	53	17 Å²	17	33%	0.325	10%	0.103	S	C	.	.			trans	-120.7	-176.4	166.7	62.9	0	0	0	0	108.8	P53 K92 G131 K132 Y134	P53-T129 HydrophobicContact CG-CG2 3.82Å; K92-T129 WeakPolarHBondContact CE-O 3.42Å; K92-T129 PolarHBondContact NZ-O 3.42Å; T129-G131 PolarHBondContact O-N 2.77Å; T129-K132 PolarHBondContact N-O 3.43Å; T129-Y134 HydrophobicContact CG2-CE2 3.92Å
130	G	85.9	Confident	94.5	Very high	48 Å²	48	17.3 Å²	17.3	50%	0.495	11%	0.105	S	C	.	.	S	Bend	trans	-49.5	-58.6	179.2	0	0	0	0	0	113	K92 L365	K92-G130 WeakPolarHBondContact CD-O 3.41Å; K92-G130 PolarHBondContact NZ-O 3.41Å; G130-L365 WeakPolarHBondContact O-CD1 3.43Å
131	G	89.3	Confident	94.3	Very high	5 Å²	5	17.7 Å²	17.7	5%	0.052	11%	0.107	C	C	.	.	S	Bend	trans	-89.7	-9.5	-177.3	0	0	0	0	0	117.1	K92 T129	K92-G131 WeakPolarHBondContact CB-O 3.31Å; K92-G131 PolarHBondContact N-O 2.73Å; T129-G131 PolarHBondContact O-N 2.77Å
132	K	93.2	Very high	94	Very high	12 Å²	12	17.7 Å²	17.7	5%	0.052	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	157.4	-164.3	-59.5	170.4	-174.1	179.7	0	114.8	V89 L90 Q128 T129 Y134 D358 S359 D361	V89-K132 HydrophobicContact CG1-CD 4.12Å; L90-K132 CarbonylContact O-C 3.58Å; L90-K132 VanDerWaalsContact O-CA 3.31Å; L90-K132 WeakPolarHBondContact O-CA 3.02Å; Q128-K132 WeakPolarHBondContact CA-O 3.26Å; Q128-K132 WeakPolarHBondContact CB-O 3.26Å; T129-K132 PolarHBondContact N-O 3.43Å; K132-Y134 HydrophobicContact CB-CD2 4.38Å; K132-Y134 HydrophobicContact CB-CE2 3.67Å; K132-Y134 HydrophobicContact CD-CE2 4.22Å; K132-Y134 WeakPolarHBondContact CD-OH 3.31Å; K132-D358 IonicContact NZ-OD1 2.66Å; K132-D358 PolarHBondContact NZ-OD1 3.4Å; K132-D358 IonicContact NZ-OD2 3.28Å; K132-D358 PolarHBondContact NZ-OD2 3.49Å; K132-S359 WeakPolarHBondContact CE-O 3.48Å; K132-S359 PolarHBondContact NZ-O 3.42Å; K132-D361 HydrophobicContact CG-CB 4.27Å
133	L	94.3	Very high	93.9	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	144.5	168.8	-55.3	173.1	0	0	0	109.3	L90 K92 I95 T105 Q128 F373 F376	L90-L133 HydrophobicContact CB-CB 4.36Å; L90-L133 PolarHBondContact N-O 2.98Å; L90-L133 PolarHBondContact O-N 3.02Å; K92-L133 HydrophobicContact CD-CD2 4.34Å; K92-L133 HydrophobicContact CG-CD1 4.42Å; K92-L133 HydrophobicContact CG-CD2 4.11Å; K92-L133 HydrophobicContact CG-CG 3.84Å; I95-L133 HydrophobicContact CD1-CD1 4.02Å; T105-L133 HydrophobicContact CG2-CD1 3.68Å; Q128-L133 HydrophobicContact CB-CD2 3.77Å; L133-F373 HydrophobicContact CD1-CD1 3.63Å; L133-F373 HydrophobicContact CD1-CD2 4.49Å; L133-F373 HydrophobicContact CD1-CE1 3.65Å; L133-F373 HydrophobicContact CD1-CE2 4.49Å; L133-F373 HydrophobicContact CD1-CG 4.08Å; L133-F373 HydrophobicContact CD1-CZ 4.09Å; L133-F373 HydrophobicContact CD2-CB 3.94Å; L133-F373 HydrophobicContact CD2-CD1 4.21Å; L133-F373 HydrophobicContact CD2-CD2 4.38Å; L133-F373 HydrophobicContact CD2-CG 3.91Å; L133-F376 HydrophobicContact CB-CE1 3.84Å; L133-F376 HydrophobicContact CB-CE2 4.41Å; L133-F376 HydrophobicContact CB-CZ 3.77Å; L133-F376 HydrophobicContact CD1-CD2 4.43Å; L133-F376 HydrophobicContact CD1-CE2 4.01Å; L133-F376 HydrophobicContact CD1-CZ 4.21Å; L133-F376 HydrophobicContact CD2-CD1 3.92Å; L133-F376 HydrophobicContact CD2-CD2 4.16Å; L133-F376 HydrophobicContact CD2-CE1 4.07Å; L133-F376 HydrophobicContact CD2-CE2 4.31Å; L133-F376 HydrophobicContact CD2-CG 3.97Å; L133-F376 HydrophobicContact CD2-CZ 4.26Å; L133-F376 HydrophobicContact CG-CE1 4.44Å; L133-F376 HydrophobicContact CG-CE2 4.47Å; L133-F376 HydrophobicContact CG-CZ 4.3Å
134	Y	95.5	Very high	93.7	Very high	7 Å²	7	17.9 Å²	17.9	3%	0.027	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	124.1	-178.5	-64.2	-99.5	0	0	0	109.6	P53 M87 V89 A126 F127 T129 K132 D358	P53-Y134 HydrophobicContact CG-CE2 4.24Å; M87-Y134 HydrophobicContact CE-CD1 4.31Å; M87-Y134 HydrophobicContact CG-CD1 4.09Å; M87-Y134 HydrophobicContact SD-CD1 3.71Å; M87-Y134 HydrophobicContact SD-CE1 4.01Å; V89-Y134 HydrophobicContact CB-CD1 4.4Å; V89-Y134 HydrophobicContact CB-CE1 4.33Å; V89-Y134 HydrophobicContact CG1-CD1 4.11Å; V89-Y134 HydrophobicContact CG1-CE1 3.69Å; V89-Y134 HydrophobicContact CG2-CD1 3.69Å; V89-Y134 HydrophobicContact CG2-CE1 3.71Å; A126-Y134 WeakPolarHBondContact CA-O 3.27Å; F127-Y134 AromaticContact CD2-CD2 3.73Å; F127-Y134 HydrophobicContact CD2-CD2 3.73Å; F127-Y134 AromaticContact CD2-CG 3.79Å; F127-Y134 HydrophobicContact CD2-CG 3.79Å; F127-Y134 VanDerWaalsContact CE2-CB 3.41Å; F127-Y134 AromaticContact CE2-CD1 3.79Å; F127-Y134 HydrophobicContact CE2-CD1 3.79Å; F127-Y134 AromaticContact CE2-CD2 3.59Å; F127-Y134 HydrophobicContact CE2-CD2 3.59Å; F127-Y134 HydrophobicContact CE2-CE1 4.47Å; F127-Y134 HydrophobicContact CE2-CE2 4.29Å; F127-Y134 AromaticContact CE2-CG 3.32Å; F127-Y134 HydrophobicContact CE2-CG 3.32Å; F127-Y134 HydrophobicContact CZ-CD1 4.13Å; F127-Y134 AromaticContact CZ-CG 3.91Å; F127-Y134 HydrophobicContact CZ-CG 3.91Å; F127-Y134 PolarHBondContact N-O 2.65Å; F127-Y134 PolarHBondContact O-N 3.45Å; T129-Y134 HydrophobicContact CG2-CE2 3.92Å; K132-Y134 HydrophobicContact CB-CD2 4.38Å; K132-Y134 HydrophobicContact CB-CE2 3.67Å; K132-Y134 HydrophobicContact CD-CE2 4.22Å; K132-Y134 WeakPolarHBondContact CD-OH 3.31Å; Y134-D358 PolarHBondContact OH-OD2 2.76Å
135	L	96.1	Very high	93.5	Very high	1 Å²	1	17.3 Å²	17.3	1%	0.005	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	125.5	168.3	-62.3	170.6	0	0	0	108.5	M87 K88 E108 R109 L123 A126 F376	M87-L135 CarbonylContact C-O 3.59Å; M87-L135 WeakPolarHBondContact CA-O 3.5Å; K88-L135 HydrophobicContact CB-CB 4.28Å; K88-L135 HydrophobicContact CD-CD1 4.33Å; K88-L135 PolarHBondContact N-O 3.49Å; K88-L135 PolarHBondContact O-N 3.09Å; E108-L135 HydrophobicContact CG-CD1 4.35Å; R109-L135 HydrophobicContact CB-CD2 4.28Å; R109-L135 HydrophobicContact CG-CD2 4Å; L123-L135 HydrophobicContact CD1-CB 3.98Å; L123-L135 HydrophobicContact CD1-CD2 3.84Å; L123-L135 HydrophobicContact CD1-CG 4.5Å; L123-L135 HydrophobicContact CD2-CD2 4.27Å; A126-L135 HydrophobicContact CB-CD2 3.7Å; L135-F376 HydrophobicContact CD2-CE1 4.1Å; L135-F376 HydrophobicContact CD2-CE2 4.42Å; L135-F376 HydrophobicContact CD2-CZ 3.59Å; L135-F376 HydrophobicContact CG-CZ 4.01Å
136	I	96.9	Very high	93.3	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	102.9	178.6	-49.3	-59.6	0	0	0	108.4	F56 F85 M87 L124 Y125 F127	F56-I136 HydrophobicContact CD2-CD1 4.45Å; F56-I136 HydrophobicContact CE1-CD1 4.34Å; F56-I136 HydrophobicContact CE1-CG1 4.37Å; F56-I136 HydrophobicContact CE1-CG2 3.94Å; F56-I136 HydrophobicContact CE2-CD1 4.14Å; F56-I136 HydrophobicContact CE2-CG1 4.17Å; F56-I136 HydrophobicContact CZ-CD1 4.07Å; F56-I136 HydrophobicContact CZ-CG1 3.84Å; F56-I136 HydrophobicContact CZ-CG2 4.11Å; F85-I136 HydrophobicContact CB-CG2 3.64Å; F85-I136 HydrophobicContact CD1-CG2 3.75Å; F85-I136 HydrophobicContact CG-CG2 3.75Å; M87-I136 HydrophobicContact CB-CD1 3.87Å; M87-I136 HydrophobicContact CE-CD1 3.7Å; M87-I136 HydrophobicContact CG-CD1 3.64Å; L124-I136 PolarHBondContact N-O 2.97Å; Y125-I136 HydrophobicContact CD2-CB 3.87Å; Y125-I136 HydrophobicContact CD2-CG1 4.34Å; Y125-I136 HydrophobicContact CD2-CG2 3.77Å; Y125-I136 HydrophobicContact CE2-CG2 4.47Å; Y125-I136 HydrophobicContact CG-CB 4.39Å; Y125-I136 PolarHBondContact N-O 3.39Å; Y125-I136 PolarHBondContact O-N 2.92Å; F127-I136 HydrophobicContact CD1-CG1 4.44Å; F127-I136 HydrophobicContact CE1-CD1 3.85Å; F127-I136 HydrophobicContact CE1-CG1 3.65Å; F127-I136 HydrophobicContact CZ-CD1 4.11Å; F127-I136 HydrophobicContact CZ-CG1 4.41Å
137	L	96.8	Very high	92.9	Very high	21 Å²	21	23 Å²	23	11%	0.11	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	164.2	-179.1	-54.3	173.2	0	0	0	110.3	F85 A86 L112 V121 D122 L123	F85-L137 WeakPolarHBondContact CB-O 3.41Å; A86-L137 HydrophobicContact CB-CB 4.35Å; A86-L137 PolarHBondContact N-O 2.82Å; A86-L137 PolarHBondContact O-N 3.47Å; L112-L137 HydrophobicContact CD1-CD2 4.17Å; V121-L137 HydrophobicContact CG2-CB 4.07Å; D122-L137 WeakPolarHBondContact O-CA 3.44Å; L123-L137 HydrophobicContact CB-CD2 4.08Å; L123-L137 HydrophobicContact CD1-CD2 3.81Å
138	E	95.8	Very high	92.7	Very high	38 Å²	38	23.6 Å²	23.6	18%	0.178	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	151.1	166.9	76.1	-169.4	111.3	0	0	111.5	V121 D122 L124 L140 K198	V121-E138 WeakPolarHBondContact CA-OE1 3.47Å; V121-E138 HydrophobicContact CG2-CG 3.91Å; D122-E138 PolarHBondContact N-OE1 3.44Å; D122-E138 PolarHBondContact O-N 3.3Å; L124-E138 HydrophobicContact CD2-CB 4.27Å; E138-L140 HydrophobicContact CG-CD2 3.68Å; E138-L140 HydrophobicContact CG-CG 4.07Å; E138-K198 WeakPolarHBondContact OE1-CD 3.45Å; E138-K198 WeakPolarHBondContact OE1-CE 3.43Å; E138-K198 IonicContact OE1-NZ 2.67Å; E138-K198 PolarHBondContact OE1-NZ 2.85Å; E138-K198 VanDerWaalsContact OE2-CE 3.24Å; E138-K198 WeakPolarHBondContact OE2-CE 3.41Å; E138-K198 IonicContact OE2-NZ 2.71Å; E138-K198 PolarHBondContact OE2-NZ 2.88Å
139	C	95.7	Very high	92.7	Very high	26 Å²	26	21.2 Å²	21.2	18%	0.176	12%	0.123	C	C	.	.			trans	-86	114	177.4	-167.5	0	0	0	0	111	I84 S141	I84-C139 HydrophobicContact CG2-CB 3.95Å; C139-S141 PolarHBondContact O-N 3.48Å; C139-S141 PolarHBondContact SG-OG 2.77Å; C139-S141 VanDerWaalsContact SG-OG 3.34Å
140	L	96.1	Very high	92.6	Very high	7 Å²	7	25.3 Å²	25.3	4%	0.037	14%	0.138	C	C	.	.			trans	-94.5	70.2	-179	-60.6	178.5	0	0	0	110.8	V121 E138 G142 G143 M190 L191 C192 K198 T200 F347	V121-L140 HydrophobicContact CB-CD1 4.4Å; V121-L140 HydrophobicContact CG2-CD1 4.01Å; E138-L140 HydrophobicContact CG-CD2 3.68Å; E138-L140 HydrophobicContact CG-CG 4.07Å; L140-G142 PolarHBondContact O-N 3.31Å; L140-G143 PolarHBondContact O-N 2.88Å; L140-M190 HydrophobicContact CB-CB 4.03Å; L140-M190 HydrophobicContact CB-CE 3.91Å; L140-M190 HydrophobicContact CB-SD 4.23Å; L140-M190 HydrophobicContact CD1-CB 3.7Å; L140-M190 HydrophobicContact CD1-CG 4.49Å; L140-M190 HydrophobicContact CD1-SD 4.21Å; L140-M190 WeakPolarHBondContact O-CE 3.32Å; L140-L191 CarbonylContact C-O 3.47Å; L140-C192 HydrophobicContact CD2-CB 4.32Å; L140-K198 HydrophobicContact CD1-CB 3.63Å; L140-K198 HydrophobicContact CD1-CG 4.39Å; L140-K198 HydrophobicContact CD2-CB 3.86Å; L140-K198 HydrophobicContact CD2-CD 4.41Å; L140-K198 HydrophobicContact CD2-CG 3.71Å; L140-K198 HydrophobicContact CG-CB 4.42Å; L140-T200 HydrophobicContact CD1-CG2 3.63Å; L140-F347 WeakPolarHBondContact O-CZ 3.34Å
141	S	92.9	Very high	92.8	Very high	10 Å²	10	29.3 Å²	29.3	7%	0.07	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-1.5	-170.7	-48.9	0	0	0	0	115.4	C139 G143 L338	C139-S141 PolarHBondContact O-N 3.48Å; C139-S141 PolarHBondContact SG-OG 2.77Å; C139-S141 VanDerWaalsContact SG-OG 3.34Å; S141-G143 VanDerWaalsContact C-N 3.29Å; S141-L338 WeakPolarHBondContact O-CD2 3.31Å
142	G	92.8	Very high	92.9	Very high	5 Å²	5	33.8 Å²	33.8	5%	0.052	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-5.3	172.4	0	0	0	0	0	114.6	L140 L191	L140-G142 PolarHBondContact O-N 3.31Å; G142-L191 WeakPolarHBondContact CA-O 3.45Å; G142-L191 PolarHBondContact N-O 2.85Å
143	G	92.2	Very high	92.9	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.01	18%	0.177	C	C	.	.			trans	79.7	-170.4	178.3	0	0	0	0	0	114.1	L140 S141 M190 L191 Q346	L140-G143 PolarHBondContact O-N 2.88Å; S141-G143 VanDerWaalsContact C-N 3.29Å; G143-M190 CarbonylContact O-C 3.51Å; G143-M190 VanDerWaalsContact O-CA 3.23Å; G143-M190 WeakPolarHBondContact O-CA 3.18Å; G143-M190 WeakPolarHBondContact O-CB 3.43Å; G143-L191 PolarHBondContact O-N 2.9Å; G143-Q346 WeakPolarHBondContact CA-O 3.5Å
144	E	93.1	Very high	92.9	Very high	55 Å²	55	38.5 Å²	38.5	26%	0.257	20%	0.195	S	C	.	.	B	Isolated β-bridge	trans	-80.8	135.2	175.6	-59.7	166.1	-150.4	0	0	110.5	F146 M147 M190	E144-F146 HydrophobicContact CB-CB 4.33Å; E144-F146 PolarHBondContact O-N 2.82Å; E144-F146 VanDerWaalsContact O-N 3.17Å; E144-M147 HydrophobicContact CB-CE 3.74Å; E144-M147 HydrophobicContact CG-CE 3.9Å; E144-M147 PolarHBondContact O-N 3.14Å; E144-M190 HydrophobicContact CG-CG 4.45Å
145	L	91.1	Very high	93	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-59.6	-28	175.5	-176.3	59.1	0	0	0	111.6	M147 Q148 L149 F155 Y163 I189 L191 I197 M251	L145-M147 VanDerWaalsContact C-N 3.32Å; L145-M147 PolarHBondContact O-N 3.3Å; L145-Q148 PolarHBondContact O-N 2.86Å; L145-L149 PolarHBondContact O-N 3.49Å; L145-F155 HydrophobicContact CD1-CE2 3.91Å; L145-F155 HydrophobicContact CD1-CZ 3.92Å; L145-F155 HydrophobicContact CG-CE2 4.29Å; L145-Y163 HydrophobicContact CD1-CD2 4.07Å; L145-Y163 HydrophobicContact CD1-CE2 3.84Å; L145-Y163 HydrophobicContact CD2-CD2 4.39Å; L145-Y163 HydrophobicContact CD2-CG 4.33Å; L145-I189 HydrophobicContact CB-CB 4.22Å; L145-I189 HydrophobicContact CB-CG2 4.02Å; L145-I189 WeakPolarHBondContact CB-O 3.5Å; L145-I189 HydrophobicContact CD2-CB 4.38Å; L145-I189 HydrophobicContact CD2-CG2 3.67Å; L145-I189 PolarHBondContact N-O 2.87Å; L145-L191 HydrophobicContact CD1-CD1 4.26Å; L145-L191 HydrophobicContact CD1-CD2 4.32Å; L145-L191 HydrophobicContact CD1-CG 4.46Å; L145-I197 HydrophobicContact CD2-CG2 4.13Å; L145-M251 HydrophobicContact CD2-CE 3.6Å
146	F	88.7	Confident	93	Very high	69 Å²	69	45.4 Å²	45.4	30%	0.303	23%	0.229	S	C	.	.	H	α-helix	trans	-50.8	-45.6	169.5	-179.2	-105.6	0	0	0	113.4	E144 Q148 L149 E150 P186 E187	E144-F146 HydrophobicContact CB-CB 4.33Å; E144-F146 PolarHBondContact O-N 2.82Å; E144-F146 VanDerWaalsContact O-N 3.17Å; F146-Q148 VanDerWaalsContact C-N 3.31Å; F146-Q148 PolarHBondContact O-N 2.73Å; F146-L149 PolarHBondContact O-N 3.02Å; F146-L149 VanDerWaalsContact O-N 3.12Å; F146-E150 HydrophobicContact CE1-CB 4.37Å; F146-E150 HydrophobicContact CZ-CB 4.34Å; F146-E150 PolarHBondContact O-N 2.86Å; F146-P186 HydrophobicContact CB-CB 3.65Å; F146-P186 HydrophobicContact CD2-CB 3.79Å; F146-P186 HydrophobicContact CD2-CG 4.42Å; F146-P186 HydrophobicContact CG-CB 4.19Å; F146-P186 PolarHBondContact N-O 2.79Å; F146-E187 HydrophobicContact CB-CG 4.49Å; F146-E187 HydrophobicContact CG-CG 4.43Å
147	M	88	Confident	93	Very high	56 Å²	56	47.3 Å²	47.3	28%	0.276	24%	0.238	S	C	.	.	H	α-helix	trans	-68.4	-31.4	-176.3	-74.7	-176.5	-83.3	0	0	112.3	E144 L145 K151 Q346	E144-M147 HydrophobicContact CB-CE 3.74Å; E144-M147 HydrophobicContact CG-CE 3.9Å; E144-M147 PolarHBondContact O-N 3.14Å; L145-M147 VanDerWaalsContact C-N 3.32Å; L145-M147 PolarHBondContact O-N 3.3Å; M147-K151 VanDerWaalsContact O-CB 3.23Å; M147-K151 WeakPolarHBondContact O-CB 3.41Å; M147-K151 PolarHBondContact O-N 3.04Å; M147-Q346 WeakPolarHBondContact CE-O 3.3Å
148	Q	90.2	Very high	92.9	Very high	21 Å²	21	52.6 Å²	52.6	10%	0.098	27%	0.266	C	S	.	.	H	α-helix	trans	-75.2	-33	172.5	-179.4	54.8	20.6	0	0	111.4	L145 F146 E152 F155 Y334	L145-Q148 PolarHBondContact O-N 2.86Å; F146-Q148 VanDerWaalsContact C-N 3.31Å; F146-Q148 PolarHBondContact O-N 2.73Å; Q148-E152 PolarHBondContact NE2-OE1 3.18Å; Q148-E152 WeakPolarHBondContact O-CG 3.3Å; Q148-E152 PolarHBondContact O-N 2.77Å; Q148-E152 VanDerWaalsContact O-N 3.12Å; Q148-F155 HydrophobicContact CB-CZ 4.48Å; Q148-F155 HydrophobicContact CG-CE1 4.13Å; Q148-F155 HydrophobicContact CG-CZ 4.2Å; Q148-Y334 HydrophobicContact CG-CD1 4.16Å; Q148-Y334 HydrophobicContact CG-CE1 4.43Å; Q148-Y334 HydrophobicContact CG-CG 4.23Å
149	L	91.1	Very high	93	Very high	9 Å²	9	52.4 Å²	52.4	5%	0.047	27%	0.268	C	S	.	.	H	α-helix	trans	-69	-44	172.9	-178.1	57.5	0	0	0	112.5	L145 F146 K151 E152 G153 F155 D250 M251	L145-L149 PolarHBondContact O-N 3.49Å; F146-L149 PolarHBondContact O-N 3.02Å; F146-L149 VanDerWaalsContact O-N 3.12Å; L149-K151 PolarHBondContact O-N 3.39Å; L149-E152 PolarHBondContact O-N 2.87Å; L149-G153 WeakPolarHBondContact O-CA 3.43Å; L149-G153 PolarHBondContact O-N 2.99Å; L149-F155 HydrophobicContact CB-CE1 4.1Å; L149-F155 HydrophobicContact CB-CE2 4.21Å; L149-F155 HydrophobicContact CB-CZ 3.72Å; L149-F155 HydrophobicContact CD1-CD1 3.99Å; L149-F155 HydrophobicContact CD1-CD2 4.19Å; L149-F155 HydrophobicContact CD1-CE1 4.03Å; L149-F155 HydrophobicContact CD1-CE2 4.22Å; L149-F155 HydrophobicContact CD1-CG 4.07Å; L149-F155 HydrophobicContact CD1-CZ 4.15Å; L149-D250 WeakPolarHBondContact CD2-OD2 3.49Å; L149-M251 HydrophobicContact CD2-CG 4.43Å
150	E	89.7	Confident	93.1	Very high	139 Å²	139	51.1 Å²	51.1	65%	0.65	26%	0.259	S	S	*	.	H	α-helix	trans	-60.2	-36	175.1	-176	176	-141.2	0	0	111.7	F146	F146-E150 HydrophobicContact CE1-CB 4.37Å; F146-E150 HydrophobicContact CZ-CB 4.34Å; F146-E150 PolarHBondContact O-N 2.86Å
151	K	89.6	Confident	93.2	Very high	131 Å²	131	51.2 Å²	51.2	57%	0.57	26%	0.26	S	S	*	.	H	α-helix	trans	-71.7	-44.3	179.6	169.5	171.4	156.8	-78.3	0	114	M147 L149	M147-K151 VanDerWaalsContact O-CB 3.23Å; M147-K151 WeakPolarHBondContact O-CB 3.41Å; M147-K151 PolarHBondContact O-N 3.04Å; L149-K151 PolarHBondContact O-N 3.39Å
152	E	91	Very high	93.5	Very high	99 Å²	99	51.3 Å²	51.3	46%	0.463	26%	0.26	S	S	.	.	H	α-helix	trans	-84	-19.2	177.2	-53.3	-53.8	148	0	0	112.5	Q148 L149 I154 F155	Q148-E152 PolarHBondContact NE2-OE1 3.18Å; Q148-E152 WeakPolarHBondContact O-CG 3.3Å; Q148-E152 PolarHBondContact O-N 2.77Å; Q148-E152 VanDerWaalsContact O-N 3.12Å; L149-E152 PolarHBondContact O-N 2.87Å; E152-I154 PolarHBondContact O-N 2.75Å; E152-F155 HydrophobicContact CB-CD1 4.39Å; E152-F155 HydrophobicContact CB-CE1 4.45Å; E152-F155 HydrophobicContact CG-CE1 4.32Å
153	G	92.6	Very high	93.8	Very high	36 Å²	36	51.1 Å²	51.1	37%	0.371	26%	0.257	S	S	.	.	S	Bend	trans	77.9	-41.6	-177.3	0	0	0	0	0	113.9	L149 G254	L149-G153 WeakPolarHBondContact O-CA 3.43Å; L149-G153 PolarHBondContact O-N 2.99Å; G153-G254 WeakPolarHBondContact O-CA 3.34Å
154	I	95	Very high	94.1	Very high	75 Å²	75	51.1 Å²	51.1	39%	0.385	26%	0.257	S	S	.	.	S	Bend	trans	-142.2	153.5	167.6	63.5	176.6	0	0	0	110.1	E152	E152-I154 PolarHBondContact O-N 2.75Å
155	F	96.9	Very high	94.3	Very high	11 Å²	11	48.5 Å²	48.5	5%	0.048	25%	0.245	C	C	.	.			trans	-94.7	147.3	166.4	-66	-19.3	0	0	0	111.1	L145 Q148 L149 E152 T159 Y163 M251	L145-F155 HydrophobicContact CD1-CE2 3.91Å; L145-F155 HydrophobicContact CD1-CZ 3.92Å; L145-F155 HydrophobicContact CG-CE2 4.29Å; Q148-F155 HydrophobicContact CB-CZ 4.48Å; Q148-F155 HydrophobicContact CG-CE1 4.13Å; Q148-F155 HydrophobicContact CG-CZ 4.2Å; L149-F155 HydrophobicContact CB-CE1 4.1Å; L149-F155 HydrophobicContact CB-CE2 4.21Å; L149-F155 HydrophobicContact CB-CZ 3.72Å; L149-F155 HydrophobicContact CD1-CD1 3.99Å; L149-F155 HydrophobicContact CD1-CD2 4.19Å; L149-F155 HydrophobicContact CD1-CE1 4.03Å; L149-F155 HydrophobicContact CD1-CE2 4.22Å; L149-F155 HydrophobicContact CD1-CG 4.07Å; L149-F155 HydrophobicContact CD1-CZ 4.15Å; E152-F155 HydrophobicContact CB-CD1 4.39Å; E152-F155 HydrophobicContact CB-CE1 4.45Å; E152-F155 HydrophobicContact CG-CE1 4.32Å; F155-T159 HydrophobicContact CB-CG2 4.03Å; F155-T159 HydrophobicContact CD1-CG2 4.3Å; F155-T159 HydrophobicContact CD2-CG2 4.22Å; F155-T159 HydrophobicContact CG-CG2 3.94Å; F155-Y163 HydrophobicContact CD2-CD2 4.43Å; F155-Y163 HydrophobicContact CE2-CD2 4.18Å; F155-Y163 HydrophobicContact CE2-CE2 4.33Å; F155-M251 HydrophobicContact CD2-CB 4.05Å; F155-M251 HydrophobicContact CD2-CG 3.87Å; F155-M251 HydrophobicContact CD2-SD 4.21Å; F155-M251 HydrophobicContact CE2-CG 4.26Å; F155-M251 PolarHBondContact N-O 3.39Å
156	M	96.4	Very high	94.7	Very high	142 Å²	142	48.4 Å²	48.4	70%	0.7	24%	0.244	S	C	*	.			trans	-67.5	155.8	167.6	-67.9	-63.8	-162.1	0	0	110.6	D158 T159 A160	M156-D158 VanDerWaalsContact C-N 3.27Å; M156-D158 PolarHBondContact O-N 2.99Å; M156-T159 WeakPolarHBondContact O-CB 3.19Å; M156-T159 PolarHBondContact O-N 2.8Å; M156-T159 VanDerWaalsContact O-N 3.12Å; M156-A160 PolarHBondContact O-N 2.87Å
157	E	96.4	Very high	95.2	Very high	41 Å²	41	45.1 Å²	45.1	19%	0.192	23%	0.23	C	C	.	.	H	α-helix	trans	-60.1	-34.1	-177.1	-74.2	-169	-164.3	0	0	113.2	A160 C161 L252 I281 T282 A285 F316	E157-A160 PolarHBondContact O-N 3.41Å; E157-C161 WeakPolarHBondContact O-CB 3.38Å; E157-C161 PolarHBondContact O-N 3.01Å; E157-L252 HydrophobicContact CB-CD2 4.4Å; E157-L252 HydrophobicContact CG-CD1 4.22Å; E157-L252 HydrophobicContact CG-CD2 3.71Å; E157-I281 WeakPolarHBondContact OE1-CA 3.42Å; E157-T282 PolarHBondContact OE1-N 3.22Å; E157-T282 PolarHBondContact OE1-OG1 3.36Å; E157-T282 VanDerWaalsContact OE2-CB 3.31Å; E157-T282 WeakPolarHBondContact OE2-CB 3.28Å; E157-T282 WeakPolarHBondContact OE2-CG2 3.13Å; E157-T282 PolarHBondContact OE2-OG1 3.04Å; E157-A285 WeakPolarHBondContact OE2-CB 3.37Å; E157-F316 HydrophobicContact CB-CE2 4.41Å
158	D	96.6	Very high	95.7	Very high	132 Å²	132	42.4 Å²	42.4	71%	0.706	22%	0.217	S	C	*	.	H	α-helix	trans	-67.2	-43.1	175.1	-56.3	-46.2	0	0	0	112.3	M156 C161 F162	M156-D158 VanDerWaalsContact C-N 3.27Å; M156-D158 PolarHBondContact O-N 2.99Å; D158-C161 PolarHBondContact O-N 2.65Å; D158-F162 PolarHBondContact O-N 3.09Å
159	T	97.2	Very high	96.1	Very high	33 Å²	33	42.4 Å²	42.4	20%	0.202	22%	0.217	C	C	.	.	H	α-helix	trans	-61.5	-44.4	175.4	-55	0	0	0	0	111.3	F155 M156 Y163 P333	F155-T159 HydrophobicContact CB-CG2 4.03Å; F155-T159 HydrophobicContact CD1-CG2 4.3Å; F155-T159 HydrophobicContact CD2-CG2 4.22Å; F155-T159 HydrophobicContact CG-CG2 3.94Å; M156-T159 WeakPolarHBondContact O-CB 3.19Å; M156-T159 PolarHBondContact O-N 2.8Å; M156-T159 VanDerWaalsContact O-N 3.12Å; T159-Y163 HydrophobicContact CG2-CD2 4.17Å; T159-Y163 HydrophobicContact CG2-CE2 3.87Å; T159-Y163 VanDerWaalsContact O-CD2 3.32Å; T159-Y163 WeakPolarHBondContact O-CD2 3.49Å; T159-Y163 PolarHBondContact O-N 3.21Å; T159-P333 HydrophobicContact CG2-CB 4.02Å; T159-P333 HydrophobicContact CG2-CG 3.84Å
160	A	97.8	Very high	96.4	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-67.2	-40.2	175.2	0	0	0	0	0	111.5	M156 E157 F162 Y163 L164 M251 L252	M156-A160 PolarHBondContact O-N 2.87Å; E157-A160 PolarHBondContact O-N 3.41Å; A160-F162 PolarHBondContact O-N 3.5Å; A160-Y163 PolarHBondContact O-N 2.83Å; A160-L164 HydrophobicContact CB-CD1 4.14Å; A160-L164 WeakPolarHBondContact O-CB 3.36Å; A160-L164 WeakPolarHBondContact O-CD1 3.35Å; A160-L164 WeakPolarHBondContact O-CG 2.65Å; A160-L164 PolarHBondContact O-N 3.24Å; A160-M251 HydrophobicContact CB-CB 4.26Å; A160-M251 HydrophobicContact CB-SD 4.25Å; A160-L252 HydrophobicContact CB-CD2 3.57Å; A160-L252 HydrophobicContact CB-CG 4.18Å
161	C	98.3	Very high	96.9	Very high	9 Å²	9	35.4 Å²	35.4	6%	0.061	18%	0.184	C	C	.	.	H	α-helix	trans	-61	-42.7	179.1	-171.4	0	0	0	0	112.1	E157 D158 G165 F316 F317	E157-C161 WeakPolarHBondContact O-CB 3.38Å; E157-C161 PolarHBondContact O-N 3.01Å; D158-C161 PolarHBondContact O-N 2.65Å; C161-G165 PolarHBondContact O-N 3.14Å; C161-F316 HydrophobicContact CB-CE1 3.77Å; C161-F316 HydrophobicContact CB-CE2 4.38Å; C161-F316 HydrophobicContact CB-CZ 3.66Å; C161-F316 PolarHBondContact SG-O 2.84Å; C161-F316 VanDerWaalsContact SG-O 3.36Å; C161-F317 VanDerWaalsContact SG-CD1 3.52Å
162	F	98.5	Very high	97.2	Very high	12 Å²	12	29.9 Å²	29.9	5%	0.053	16%	0.164	C	C	.	.	H	α-helix	trans	-56.3	-58.9	172.3	-180	-84.9	0	0	0	111.6	D158 A160 L164 G165 E166 H196 L325 V330 P332 P333	D158-F162 PolarHBondContact O-N 3.09Å; A160-F162 PolarHBondContact O-N 3.5Å; F162-L164 PolarHBondContact O-N 3.43Å; F162-G165 WeakPolarHBondContact O-CA 3.35Å; F162-G165 PolarHBondContact O-N 3.07Å; F162-G165 VanDerWaalsContact O-N 3.12Å; F162-E166 VanDerWaalsContact CE1-CD 3.41Å; F162-E166 HydrophobicContact CE1-CG 4.19Å; F162-E166 WeakPolarHBondContact CE1-OE1 3.29Å; F162-E166 WeakPolarHBondContact CE1-OE2 3.34Å; F162-E166 HydrophobicContact CZ-CG 4.49Å; F162-E166 VanDerWaalsContact CZ-OE1 3.3Å; F162-E166 WeakPolarHBondContact CZ-OE1 3.39Å; F162-E166 PolarHBondContact O-N 3.3Å; F162-E166 VanDerWaalsContact O-N 3.16Å; F162-H196 AromaticContact CZ-ND1 3.75Å; F162-L325 HydrophobicContact CD2-CD1 4Å; F162-L325 HydrophobicContact CE2-CD1 3.66Å; F162-L325 HydrophobicContact CZ-CD1 4.08Å; F162-V330 HydrophobicContact CD2-CG1 3.89Å; F162-V330 HydrophobicContact CE2-CB 4.03Å; F162-V330 HydrophobicContact CE2-CG1 3.75Å; F162-P332 HydrophobicContact CE1-CB 4.09Å; F162-P332 HydrophobicContact CE1-CG 4.43Å; F162-P332 HydrophobicContact CZ-CB 3.93Å; F162-P332 HydrophobicContact CZ-CG 3.89Å; F162-P333 HydrophobicContact CB-CG 4.23Å; F162-P333 HydrophobicContact CD1-CG 4Å; F162-P333 HydrophobicContact CG-CG 4.16Å
163	Y	98.5	Very high	97.5	Very high	1 Å²	1	27.4 Å²	27.4	0%	0.004	15%	0.152	C	C	.	.	H	α-helix	trans	-66.9	-40.6	-175.4	-67	-45.5	0	0	0	113.2	L145 F155 T159 A160 G165 E166 I167 L191 G195 I197 P333	L145-Y163 HydrophobicContact CD1-CD2 4.07Å; L145-Y163 HydrophobicContact CD1-CE2 3.84Å; L145-Y163 HydrophobicContact CD2-CD2 4.39Å; L145-Y163 HydrophobicContact CD2-CG 4.33Å; F155-Y163 HydrophobicContact CD2-CD2 4.43Å; F155-Y163 HydrophobicContact CE2-CD2 4.18Å; F155-Y163 HydrophobicContact CE2-CE2 4.33Å; T159-Y163 HydrophobicContact CG2-CD2 4.17Å; T159-Y163 HydrophobicContact CG2-CE2 3.87Å; T159-Y163 VanDerWaalsContact O-CD2 3.32Å; T159-Y163 WeakPolarHBondContact O-CD2 3.49Å; T159-Y163 PolarHBondContact O-N 3.21Å; A160-Y163 PolarHBondContact O-N 2.83Å; Y163-G165 PolarHBondContact O-N 3.16Å; Y163-E166 PolarHBondContact O-N 3.32Å; Y163-I167 WeakPolarHBondContact O-CB 3.44Å; Y163-I167 WeakPolarHBondContact O-CD1 3.32Å; Y163-I167 WeakPolarHBondContact O-CG1 3.39Å; Y163-I167 PolarHBondContact O-N 3.44Å; Y163-L191 HydrophobicContact CE1-CD2 3.95Å; Y163-G195 WeakPolarHBondContact CE1-O 3.32Å; Y163-I197 HydrophobicContact CD1-CG2 3.48Å; Y163-I197 VanDerWaalsContact CD1-CG2 3.48Å; Y163-I197 HydrophobicContact CE1-CG2 4Å; Y163-I197 HydrophobicContact CG-CG2 4.2Å; Y163-P333 HydrophobicContact CE1-CG 4.36Å; Y163-P333 HydrophobicContact CE2-CG 3.93Å
164	L	98.7	Very high	97.7	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-65	-28	174.9	-66.2	166	0	0	0	111.6	A160 F162 T168 L244 L247 M248 M251 F316 F317	A160-L164 HydrophobicContact CB-CD1 4.14Å; A160-L164 WeakPolarHBondContact O-CB 3.36Å; A160-L164 WeakPolarHBondContact O-CD1 3.35Å; A160-L164 WeakPolarHBondContact O-CG 2.65Å; A160-L164 PolarHBondContact O-N 3.24Å; F162-L164 PolarHBondContact O-N 3.43Å; L164-T168 VanDerWaalsContact O-CB 3.25Å; L164-T168 WeakPolarHBondContact O-CB 3.36Å; L164-T168 PolarHBondContact O-N 2.73Å; L164-T168 PolarHBondContact O-OG1 3.22Å; L164-L244 HydrophobicContact CD2-CD1 3.57Å; L164-L244 HydrophobicContact CD2-CG 4.3Å; L164-L247 HydrophobicContact CD2-CD2 4.32Å; L164-L247 HydrophobicContact CD2-CG 4.44Å; L164-M248 HydrophobicContact CD1-CB 3.7Å; L164-M248 HydrophobicContact CD1-CG 3.54Å; L164-M248 HydrophobicContact CD1-SD 4.15Å; L164-M248 HydrophobicContact CD2-CB 4.05Å; L164-M251 HydrophobicContact CD1-SD 4.42Å; L164-M251 HydrophobicContact CD2-SD 4.08Å; L164-M251 HydrophobicContact CG-SD 3.98Å; L164-F316 HydrophobicContact CD1-CE1 4.05Å; L164-F316 HydrophobicContact CD1-CZ 4.31Å; L164-F317 HydrophobicContact CB-CE1 4.17Å; L164-F317 HydrophobicContact CB-CZ 4.11Å
165	G	98.6	Very high	97.8	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62.8	-57.2	170.3	0	0	0	0	0	111.3	C161 F162 Y163 I167 T168 M169	C161-G165 PolarHBondContact O-N 3.14Å; F162-G165 WeakPolarHBondContact O-CA 3.35Å; F162-G165 PolarHBondContact O-N 3.07Å; F162-G165 VanDerWaalsContact O-N 3.12Å; Y163-G165 PolarHBondContact O-N 3.16Å; G165-I167 VanDerWaalsContact C-N 3.29Å; G165-I167 PolarHBondContact O-N 2.83Å; G165-T168 WeakPolarHBondContact O-CB 3.44Å; G165-T168 PolarHBondContact O-N 3.05Å; G165-M169 WeakPolarHBondContact O-CG 3.48Å; G165-M169 PolarHBondContact O-N 3.13Å
166	E	98.8	Very high	97.6	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-56.8	-42.5	179.3	-60.2	-169.5	139.5	0	0	112.2	F119 F162 Y163 M169 A170 H196 I197 L325	F119-E166 HydrophobicContact CD1-CB 3.99Å; F119-E166 HydrophobicContact CD1-CG 4.15Å; F119-E166 HydrophobicContact CD2-CB 3.84Å; F119-E166 HydrophobicContact CD2-CG 4.36Å; F119-E166 WeakPolarHBondContact CD2-O 3.2Å; F119-E166 HydrophobicContact CE1-CB 4.04Å; F119-E166 VanDerWaalsContact CE1-CD 3.41Å; F119-E166 HydrophobicContact CE1-CG 3.7Å; F119-E166 WeakPolarHBondContact CE1-OE1 3.41Å; F119-E166 HydrophobicContact CE2-CB 3.91Å; F119-E166 HydrophobicContact CE2-CG 3.95Å; F119-E166 HydrophobicContact CG-CB 3.9Å; F119-E166 HydrophobicContact CG-CG 4.47Å; F119-E166 HydrophobicContact CZ-CB 4Å; F119-E166 HydrophobicContact CZ-CG 3.59Å; F119-E166 WeakPolarHBondContact CZ-OE1 3.26Å; F162-E166 VanDerWaalsContact CE1-CD 3.41Å; F162-E166 HydrophobicContact CE1-CG 4.19Å; F162-E166 WeakPolarHBondContact CE1-OE1 3.29Å; F162-E166 WeakPolarHBondContact CE1-OE2 3.34Å; F162-E166 HydrophobicContact CZ-CG 4.49Å; F162-E166 VanDerWaalsContact CZ-OE1 3.3Å; F162-E166 WeakPolarHBondContact CZ-OE1 3.39Å; F162-E166 PolarHBondContact O-N 3.3Å; F162-E166 VanDerWaalsContact O-N 3.16Å; Y163-E166 PolarHBondContact O-N 3.32Å; E166-M169 PolarHBondContact O-N 3.28Å; E166-A170 PolarHBondContact O-N 2.81Å; E166-H196 WeakPolarHBondContact OE1-CB 3.47Å; E166-H196 IonicContact OE1-CE1 2.72Å; E166-H196 IonicContact OE1-CG 2.65Å; E166-H196 IonicContact OE1-ND1 3.61Å; E166-H196 PolarHBondContact OE1-ND1 3.22Å; E166-I197 HydrophobicContact CB-CD1 4.14Å; E166-I197 HydrophobicContact CB-CG1 3.49Å; E166-I197 VanDerWaalsContact CB-CG1 3.49Å; E166-I197 HydrophobicContact CG-CG1 4.44Å; E166-I197 WeakPolarHBondContact OE2-CG1 3.38Å; E166-I197 PolarHBondContact OE2-N 3.01Å; E166-L325 HydrophobicContact CG-CD1 3.79Å; E166-L325 HydrophobicContact CG-CD2 4.12Å; E166-L325 HydrophobicContact CG-CG 4.01Å
167	I	98.8	Very high	97.5	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-64.6	-42.6	175.9	-64.5	162.2	0	0	0	111.3	Y163 G165 M169 A170 L171 L184 I189 I197 L199 L244 L247 M251	Y163-I167 WeakPolarHBondContact O-CB 3.44Å; Y163-I167 WeakPolarHBondContact O-CD1 3.32Å; Y163-I167 WeakPolarHBondContact O-CG1 3.39Å; Y163-I167 PolarHBondContact O-N 3.44Å; G165-I167 VanDerWaalsContact C-N 3.29Å; G165-I167 PolarHBondContact O-N 2.83Å; I167-M169 VanDerWaalsContact C-N 3.26Å; I167-M169 PolarHBondContact O-N 3.04Å; I167-A170 PolarHBondContact O-N 3.42Å; I167-L171 HydrophobicContact CG2-CD1 4.01Å; I167-L171 HydrophobicContact CG2-CG 4.28Å; I167-L171 WeakPolarHBondContact O-CG 3.45Å; I167-L171 PolarHBondContact O-N 2.88Å; I167-L184 HydrophobicContact CG2-CD1 3.72Å; I167-L184 HydrophobicContact CG2-CD2 4.05Å; I167-I189 HydrophobicContact CD1-CD1 3.82Å; I167-I189 HydrophobicContact CD1-CG2 4.44Å; I167-I197 HydrophobicContact CG1-CD1 3.64Å; I167-I197 HydrophobicContact CG1-CG1 4.03Å; I167-L199 HydrophobicContact CG1-CD2 4.48Å; I167-L244 HydrophobicContact CB-CD1 4.32Å; I167-L244 HydrophobicContact CG2-CD1 3.73Å; I167-L247 HydrophobicContact CD1-CD2 3.72Å; I167-M251 HydrophobicContact CD1-CE 4.3Å
168	T	98.8	Very high	97.3	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.6	-38.9	176.5	-64.4	0	0	0	0	111.3	L164 G165 G172 W241 A308 I311 Q312	L164-T168 VanDerWaalsContact O-CB 3.25Å; L164-T168 WeakPolarHBondContact O-CB 3.36Å; L164-T168 PolarHBondContact O-N 2.73Å; L164-T168 PolarHBondContact O-OG1 3.22Å; G165-T168 WeakPolarHBondContact O-CB 3.44Å; G165-T168 PolarHBondContact O-N 3.05Å; T168-G172 PolarHBondContact O-N 3Å; T168-W241 HydrophobicContact CG2-CH2 4.13Å; T168-W241 HydrophobicContact CG2-CZ3 4.09Å; T168-A308 HydrophobicContact CG2-CB 4.43Å; T168-I311 HydrophobicContact CG2-CB 3.71Å; T168-I311 HydrophobicContact CG2-CG1 4.31Å; T168-I311 HydrophobicContact CG2-CG2 3.6Å; T168-Q312 HydrophobicContact CG2-CG 4.21Å
169	M	98.6	Very high	97.2	Very high	21 Å²	21	16.8 Å²	16.8	10%	0.103	11%	0.106	C	C	.	.	H	α-helix	trans	-69.4	-41.5	176	-58.2	-169.3	81	0	0	112.1	F119 G165 E166 I167 G172 H173 W322 L325 L326	F119-M169 HydrophobicContact CD2-CB 4.2Å; F119-M169 HydrophobicContact CE2-CB 4.39Å; F119-M169 HydrophobicContact CE2-SD 4.13Å; G165-M169 WeakPolarHBondContact O-CG 3.48Å; G165-M169 PolarHBondContact O-N 3.13Å; E166-M169 PolarHBondContact O-N 3.28Å; I167-M169 VanDerWaalsContact C-N 3.26Å; I167-M169 PolarHBondContact O-N 3.04Å; M169-G172 PolarHBondContact O-N 2.87Å; M169-H173 WeakPolarHBondContact O-CB 3.31Å; M169-H173 PolarHBondContact O-N 3.03Å; M169-W322 HydrophobicContact CG-CE3 3.81Å; M169-W322 HydrophobicContact CG-CZ3 3.94Å; M169-W322 HydrophobicContact SD-CE3 3.79Å; M169-W322 HydrophobicContact SD-CZ3 4.39Å; M169-L325 HydrophobicContact SD-CB 4.47Å; M169-L325 HydrophobicContact SD-CD2 4.27Å; M169-L325 HydrophobicContact SD-CG 4.47Å; M169-L326 HydrophobicContact CE-CB 3.73Å; M169-L326 HydrophobicContact CE-CD1 4.19Å; M169-L326 HydrophobicContact CE-CD2 4.35Å; M169-L326 HydrophobicContact CE-CG 4.31Å; M169-L326 HydrophobicContact SD-CB 4.32Å
170	A	98.6	Very high	97.1	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61.2	-46.7	175.5	0	0	0	0	0	112.3	F119 I120 E166 I167 H173 L174 L199	F119-A170 HydrophobicContact CB-CB 4.08Å; I120-A170 HydrophobicContact CD1-CB 4.29Å; I120-A170 HydrophobicContact CG1-CB 3.92Å; E166-A170 PolarHBondContact O-N 2.81Å; I167-A170 PolarHBondContact O-N 3.42Å; A170-H173 PolarHBondContact O-N 3.19Å; A170-L174 WeakPolarHBondContact O-CG 3.46Å; A170-L174 PolarHBondContact O-N 3.02Å; A170-L199 HydrophobicContact CB-CD1 3.59Å; A170-L199 HydrophobicContact CB-CG 3.95Å
171	L	98.4	Very high	97	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-63.1	-45	176	-68.1	175.7	0	0	0	111.7	I167 H173 L174 H175 Y181 L184 L199 D240 W241	I167-L171 HydrophobicContact CG2-CD1 4.01Å; I167-L171 HydrophobicContact CG2-CG 4.28Å; I167-L171 WeakPolarHBondContact O-CG 3.45Å; I167-L171 PolarHBondContact O-N 2.88Å; L171-H173 VanDerWaalsContact C-N 3.3Å; L171-H173 PolarHBondContact O-N 3.1Å; L171-L174 WeakPolarHBondContact O-CB 3.13Å; L171-L174 PolarHBondContact O-N 2.95Å; L171-L174 VanDerWaalsContact O-N 3.11Å; L171-H175 WeakPolarHBondContact O-CB 3.35Å; L171-H175 PolarHBondContact O-CD2 3.47Å; L171-H175 VanDerWaalsContact O-CD2 3.24Å; L171-H175 PolarHBondContact O-N 2.87Å; L171-Y181 HydrophobicContact CD2-CD1 4.1Å; L171-Y181 HydrophobicContact CD2-CG 4.35Å; L171-L184 HydrophobicContact CD1-CD2 4.16Å; L171-L199 HydrophobicContact CD2-CD1 4.35Å; L171-D240 HydrophobicContact CD1-CB 4.29Å; L171-D240 HydrophobicContact CD2-CB 3.99Å; L171-W241 HydrophobicContact CB-CH2 3.7Å; L171-W241 HydrophobicContact CB-CZ2 4.4Å; L171-W241 HydrophobicContact CB-CZ3 3.94Å; L171-W241 HydrophobicContact CD1-CE3 4.14Å; L171-W241 HydrophobicContact CD1-CH2 4.39Å; L171-W241 HydrophobicContact CD1-CZ3 3.78Å
172	G	97.5	Very high	96.9	Very high	15 Å²	15	15.3 Å²	15.3	16%	0.155	10%	0.095	C	C	.	.	H	α-helix	trans	-59.7	-37.5	176.2	0	0	0	0	0	113.6	T168 M169 S176	T168-G172 PolarHBondContact O-N 3Å; M169-G172 PolarHBondContact O-N 2.87Å; G172-S176 WeakPolarHBondContact O-CB 3.34Å; G172-S176 PolarHBondContact O-N 3.18Å; G172-S176 PolarHBondContact O-OG 3.44Å
173	H	97.3	Very high	96.7	Very high	47 Å²	47	15.2 Å²	15.2	22%	0.218	10%	0.095	C	C	.	.	H	α-helix	trans	-69.2	-36.8	173.9	179.2	94.9	0	0	0	112.6	R116 H117 M169 A170 L171 S176 N177	R116-H173 PolarHBondContact O-CE1 3.49Å; H117-H173 AromaticContact CD2-CG 3.65Å; H117-H173 AromaticContact CD2-ND1 3.64Å; H117-H173 AromaticContact CG-CG 3.88Å; M169-H173 WeakPolarHBondContact O-CB 3.31Å; M169-H173 PolarHBondContact O-N 3.03Å; A170-H173 PolarHBondContact O-N 3.19Å; L171-H173 VanDerWaalsContact C-N 3.3Å; L171-H173 PolarHBondContact O-N 3.1Å; H173-S176 PolarHBondContact O-OG 3.02Å; H173-S176 VanDerWaalsContact O-OG 3.11Å; H173-N177 PolarHBondContact NE2-ND2 3.19Å; H173-N177 PolarHBondContact O-N 3.44Å; H173-N177 PolarHBondContact O-ND2 3.14Å
174	L	96.7	Very high	96.6	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-65.2	-47.3	172.6	-69.9	167.4	0	0	0	110.7	V115 I120 A170 L171 S176 N177 G178 I179 Y181 L199 F202	V115-L174 HydrophobicContact CB-CD2 4.48Å; V115-L174 HydrophobicContact CG1-CD2 3.92Å; V115-L174 HydrophobicContact CG2-CD2 3.79Å; I120-L174 HydrophobicContact CD1-CD1 4.12Å; I120-L174 HydrophobicContact CD1-CD2 3.9Å; I120-L174 HydrophobicContact CD1-CG 3.73Å; A170-L174 WeakPolarHBondContact O-CG 3.46Å; A170-L174 PolarHBondContact O-N 3.02Å; L171-L174 WeakPolarHBondContact O-CB 3.13Å; L171-L174 PolarHBondContact O-N 2.95Å; L171-L174 VanDerWaalsContact O-N 3.11Å; L174-S176 VanDerWaalsContact C-N 3.34Å; L174-S176 PolarHBondContact O-N 2.88Å; L174-N177 CarbonylContact O-C 3.48Å; L174-N177 PolarHBondContact O-N 2.97Å; L174-N177 VanDerWaalsContact O-N 3.13Å; L174-G178 PolarHBondContact O-N 2.91Å; L174-I179 CarbonylContact C-O 3.23Å; L174-I179 VanDerWaalsContact C-O 3.23Å; L174-I179 HydrophobicContact CB-CB 4.29Å; L174-I179 HydrophobicContact CB-CG2 4.45Å; L174-I179 HydrophobicContact CD2-CB 4.26Å; L174-I179 HydrophobicContact CD2-CD1 4.49Å; L174-I179 HydrophobicContact CD2-CG2 3.98Å; L174-I179 PolarHBondContact O-N 3.5Å; L174-Y181 HydrophobicContact CD1-CD2 4.17Å; L174-Y181 HydrophobicContact CD1-CG 4.24Å; L174-L199 HydrophobicContact CD1-CD1 4.29Å; L174-F202 HydrophobicContact CD1-CE1 3.79Å; L174-F202 HydrophobicContact CD1-CZ 4.34Å; L174-F202 HydrophobicContact CD2-CE1 3.76Å; L174-F202 HydrophobicContact CD2-CZ 4.5Å; L174-F202 HydrophobicContact CG-CE1 4.44Å
175	H	95.7	Very high	96.4	Very high	12 Å²	12	16.1 Å²	16.1	6%	0.056	10%	0.099	C	C	.	.	H	α-helix	trans	-61.8	-38.3	-179.5	-67.9	-177.5	0	0	0	112.8	L171 N177 G178 I179 D240 W241 D307	L171-H175 WeakPolarHBondContact O-CB 3.35Å; L171-H175 PolarHBondContact O-CD2 3.47Å; L171-H175 VanDerWaalsContact O-CD2 3.24Å; L171-H175 PolarHBondContact O-N 2.87Å; H175-N177 VanDerWaalsContact C-N 3.33Å; H175-G178 PolarHBondContact O-N 2.85Å; H175-I179 PolarHBondContact CD2-O 2.73Å; H175-I179 PolarHBondContact N-O 3.13Å; H175-D240 IonicContact NE2-OD2 2.73Å; H175-W241 AromaticContact CE1-CE2 3.49Å; H175-W241 VanDerWaalsContact CE1-CE2 3.49Å; H175-W241 AromaticContact CE1-CZ2 3.57Å; H175-W241 AromaticContact CE1-NE1 3.48Å; H175-W241 PolarHBondContact CE1-NE1 3.13Å; H175-W241 AromaticContact ND1-CE2 3.73Å; H175-W241 AromaticContact ND1-CZ2 3.52Å; H175-W241 AromaticContact ND1-NE1 3.64Å; H175-D307 WeakPolarHBondContact CB-OD2 3.22Å; H175-D307 IonicContact CE1-OD1 3.84Å; H175-D307 IonicContact CE1-OD2 2.65Å; H175-D307 IonicContact CG-OD2 3.23Å; H175-D307 VanDerWaalsContact ND1-CG 3.33Å; H175-D307 IonicContact ND1-OD1 2.7Å; H175-D307 PolarHBondContact ND1-OD1 2.83Å; H175-D307 VanDerWaalsContact ND1-OD1 3.13Å; H175-D307 IonicContact ND1-OD2 2.68Å; H175-D307 PolarHBondContact ND1-OD2 3.36Å
176	S	94.3	Very high	96.1	Very high	95 Å²	95	16.2 Å²	16.2	66%	0.664	10%	0.1	S	C	*	.	H	α-helix	trans	-71.9	-25.3	176.5	66.6	0	0	0	0	113.6	G172 H173 L174 G178	G172-S176 WeakPolarHBondContact O-CB 3.34Å; G172-S176 PolarHBondContact O-N 3.18Å; G172-S176 PolarHBondContact O-OG 3.44Å; H173-S176 PolarHBondContact O-OG 3.02Å; H173-S176 VanDerWaalsContact O-OG 3.11Å; L174-S176 VanDerWaalsContact C-N 3.34Å; L174-S176 PolarHBondContact O-N 2.88Å; S176-G178 PolarHBondContact O-N 2.84Å
177	N	93.4	Very high	95.8	Very high	78 Å²	78	19.5 Å²	19.5	42%	0.417	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	10.1	167.4	-74	-84.1	0	0	0	112.9	H173 L174 H175 I179	H173-N177 PolarHBondContact NE2-ND2 3.19Å; H173-N177 PolarHBondContact O-N 3.44Å; H173-N177 PolarHBondContact O-ND2 3.14Å; L174-N177 CarbonylContact O-C 3.48Å; L174-N177 PolarHBondContact O-N 2.97Å; L174-N177 VanDerWaalsContact O-N 3.13Å; H175-N177 VanDerWaalsContact C-N 3.33Å; N177-I179 VanDerWaalsContact C-N 3.33Å; N177-I179 HydrophobicContact CB-CD1 4.06Å; N177-I179 PolarHBondContact O-N 2.99Å
178	G	92.4	Very high	95.6	Very high	26 Å²	26	20 Å²	20	27%	0.268	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	23.5	179.1	0	0	0	0	0	114.3	L174 H175 S176 E207 S208	L174-G178 PolarHBondContact O-N 2.91Å; H175-G178 PolarHBondContact O-N 2.85Å; S176-G178 PolarHBondContact O-N 2.84Å; G178-E207 CarbonylContact O-C 3.57Å; G178-E207 WeakPolarHBondContact O-CA 3.49Å; G178-S208 WeakPolarHBondContact O-CA 3.35Å; G178-S208 WeakPolarHBondContact O-CB 3.48Å; G178-S208 PolarHBondContact O-N 2.79Å
179	I	94	Very high	95.6	Very high	3 Å²	3	20 Å²	20	2%	0.015	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	130.4	-177.5	-64	154.6	0	0	0	110	I111 V115 L174 H175 N177 E207	I111-I179 HydrophobicContact CD1-CG2 3.97Å; I111-I179 HydrophobicContact CG1-CD1 4.24Å; I111-I179 HydrophobicContact CG1-CG1 4.3Å; I111-I179 HydrophobicContact CG1-CG2 4.31Å; I111-I179 HydrophobicContact CG2-CD1 4.17Å; I111-I179 HydrophobicContact CG2-CG2 4.2Å; V115-I179 HydrophobicContact CG2-CD1 3.41Å; V115-I179 VanDerWaalsContact CG2-CD1 3.41Å; L174-I179 CarbonylContact C-O 3.23Å; L174-I179 VanDerWaalsContact C-O 3.23Å; L174-I179 HydrophobicContact CB-CB 4.29Å; L174-I179 HydrophobicContact CB-CG2 4.45Å; L174-I179 HydrophobicContact CD2-CB 4.26Å; L174-I179 HydrophobicContact CD2-CD1 4.49Å; L174-I179 HydrophobicContact CD2-CG2 3.98Å; L174-I179 PolarHBondContact O-N 3.5Å; H175-I179 PolarHBondContact CD2-O 2.73Å; H175-I179 PolarHBondContact N-O 3.13Å; N177-I179 VanDerWaalsContact C-N 3.33Å; N177-I179 HydrophobicContact CB-CD1 4.06Å; N177-I179 PolarHBondContact O-N 2.99Å; I179-E207 HydrophobicContact CG1-CG 4.08Å
180	I	94.9	Very high	95.5	Very high	3 Å²	3	20.4 Å²	20.4	2%	0.015	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	130.8	171.4	-47	166.1	0	0	0	107.8	R182 S205 K206 R237 V239 D240	I180-R182 HydrophobicContact CB-CG 4.02Å; I180-R182 HydrophobicContact CG2-CG 3.42Å; I180-R182 VanDerWaalsContact CG2-CG 3.42Å; I180-S205 CarbonylContact O-C 3.53Å; I180-S205 WeakPolarHBondContact O-CA 3.38Å; I180-S205 WeakPolarHBondContact O-CB 3.46Å; I180-K206 PolarHBondContact N-O 3.11Å; I180-K206 PolarHBondContact O-N 3.04Å; I180-R237 HydrophobicContact CG1-CB 4.34Å; I180-V239 HydrophobicContact CG2-CG2 4.08Å; I180-D240 WeakPolarHBondContact CG2-OD2 3.46Å
181	Y	96.1	Very high	95.4	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.12	C	C	.	.			trans	-81.9	-46.4	-171.9	-176.6	-126	0	0	0	112.9	L171 L174 D183 L184 N188 L199 T200 F202 S205 D240	L171-Y181 HydrophobicContact CD2-CD1 4.1Å; L171-Y181 HydrophobicContact CD2-CG 4.35Å; L174-Y181 HydrophobicContact CD1-CD2 4.17Å; L174-Y181 HydrophobicContact CD1-CG 4.24Å; Y181-D183 VanDerWaalsContact C-N 3.28Å; Y181-D183 PolarHBondContact O-N 3.08Å; Y181-L184 HydrophobicContact CD1-CB 3.95Å; Y181-L184 HydrophobicContact CD1-CD1 4.26Å; Y181-L184 HydrophobicContact CE1-CB 4Å; Y181-L184 HydrophobicContact CE1-CD1 3.93Å; Y181-N188 WeakPolarHBondContact OH-CB 3.23Å; Y181-L199 HydrophobicContact CD1-CD1 4.47Å; Y181-L199 HydrophobicContact CE1-CD1 4.28Å; Y181-T200 PolarHBondContact OH-O 3.19Å; Y181-F202 AromaticContact CD2-CD1 3.84Å; Y181-F202 HydrophobicContact CD2-CD1 3.84Å; Y181-F202 AromaticContact CD2-CE1 3.53Å; Y181-F202 HydrophobicContact CD2-CE1 3.53Å; Y181-F202 HydrophobicContact CD2-CZ 4.13Å; Y181-F202 AromaticContact CE2-CD1 3.95Å; Y181-F202 HydrophobicContact CE2-CD1 3.95Å; Y181-F202 AromaticContact CE2-CE1 3.67Å; Y181-F202 HydrophobicContact CE2-CE1 3.67Å; Y181-F202 HydrophobicContact CE2-CE2 4.29Å; Y181-F202 HydrophobicContact CE2-CG 4.37Å; Y181-F202 AromaticContact CE2-CZ 3.84Å; Y181-F202 HydrophobicContact CE2-CZ 3.84Å; Y181-S205 WeakPolarHBondContact CD2-OG 3.4Å; Y181-S205 VanDerWaalsContact O-CA 3.29Å; Y181-S205 WeakPolarHBondContact O-CA 3.47Å; Y181-S205 PolarHBondContact O-N 3.45Å; Y181-S205 PolarHBondContact O-OG 3.48Å; Y181-D240 PolarHBondContact N-OD2 3.05Å
182	R	95.6	Very high	95.2	Very high	8 Å²	8	20.9 Å²	20.9	3%	0.03	12%	0.123	C	C	.	.			trans	66.1	-0.2	170.1	-50.6	-168.2	-59.6	173.1	6.3	118.8	I180 L204 T215 T217 C219 H235 V239 D240	I180-R182 HydrophobicContact CB-CG 4.02Å; I180-R182 HydrophobicContact CG2-CG 3.42Å; I180-R182 VanDerWaalsContact CG2-CG 3.42Å; R182-L204 VanDerWaalsContact CZ-O 3.25Å; R182-L204 PolarHBondContact NE-O 3.12Å; R182-L204 PolarHBondContact NH2-O 3.42Å; R182-T215 PolarHBondContact NH1-OG1 3.41Å; R182-T217 PolarHBondContact NH1-OG1 3.08Å; R182-C219 VanDerWaalsContact CZ-SG 3.58Å; R182-H235 WeakPolarHBondContact CD-NE2 3.24Å; R182-H235 PolarHBondContact NE-NE2 3.24Å; R182-H235 PolarHBondContact NH1-NE2 3.21Å; R182-H235 VanDerWaalsContact NH1-NE2 3.13Å; R182-V239 HydrophobicContact CG-CG2 4.34Å; R182-D240 VanDerWaalsContact CA-OD1 3.27Å; R182-D240 WeakPolarHBondContact CA-OD1 3.39Å; R182-D240 PolarHBondContact N-OD1 3.45Å; R182-D240 PolarHBondContact N-OD2 2.8Å
183	D	94.9	Very high	95.1	Very high	11 Å²	11	24.3 Å²	24.3	6%	0.059	14%	0.135	C	C	.	.			trans	-140.9	43.1	178.4	-162.2	29	0	0	0	112.4	Y181 K185 N188 L204 G220 T221	Y181-D183 VanDerWaalsContact C-N 3.28Å; Y181-D183 PolarHBondContact O-N 3.08Å; D183-K185 PolarHBondContact O-N 2.24Å; D183-K185 IonicContact OD1-NZ 3.63Å; D183-K185 PolarHBondContact OD1-NZ 3.22Å; D183-K185 VanDerWaalsContact OD1-NZ 3.14Å; D183-K185 IonicContact OD2-NZ 3.24Å; D183-K185 PolarHBondContact OD2-NZ 3.36Å; D183-N188 PolarHBondContact O-ND2 3.31Å; D183-N188 PolarHBondContact OD2-ND2 2.71Å; D183-L204 HydrophobicContact CB-CB 4.11Å; D183-L204 HydrophobicContact CB-CD1 4.05Å; D183-G220 WeakPolarHBondContact OD1-CA 3.24Å; D183-T221 PolarHBondContact OD1-N 2.76Å
184	L	97.6	Very high	95	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	15%	0.145	C	C	.	.			trans	-71.1	114.5	172.9	-171.6	80.6	0	0	0	110.8	I167 L171 Y181 I189 L199 L244 L247	I167-L184 HydrophobicContact CG2-CD1 3.72Å; I167-L184 HydrophobicContact CG2-CD2 4.05Å; L171-L184 HydrophobicContact CD1-CD2 4.16Å; Y181-L184 HydrophobicContact CD1-CB 3.95Å; Y181-L184 HydrophobicContact CD1-CD1 4.26Å; Y181-L184 HydrophobicContact CE1-CB 4Å; Y181-L184 HydrophobicContact CE1-CD1 3.93Å; L184-I189 HydrophobicContact CD1-CD1 4.02Å; L184-I189 HydrophobicContact CD1-CG1 4.26Å; L184-L199 HydrophobicContact CD1-CD2 3.91Å; L184-L244 HydrophobicContact CD2-CB 4.12Å; L184-L244 HydrophobicContact CD2-CD1 4.23Å; L184-L247 HydrophobicContact CD2-CD2 3.96Å; L184-L247 HydrophobicContact CG-CD2 4.14Å
185	K	94.6	Very high	94.9	Very high	19 Å²	19	26.4 Å²	26.4	8%	0.083	15%	0.145	C	C	.	.	S	Bend	trans	-157.3	159.4	177.3	63.5	-178.8	-171	-77.4	0	109.8	D183 E187 N188 I189 T221 Y224	D183-K185 PolarHBondContact O-N 2.24Å; D183-K185 IonicContact OD1-NZ 3.63Å; D183-K185 PolarHBondContact OD1-NZ 3.22Å; D183-K185 VanDerWaalsContact OD1-NZ 3.14Å; D183-K185 IonicContact OD2-NZ 3.24Å; D183-K185 PolarHBondContact OD2-NZ 3.36Å; K185-E187 WeakPolarHBondContact CB-OE2 3.45Å; K185-E187 WeakPolarHBondContact CD-OE2 3.48Å; K185-E187 VanDerWaalsContact CG-OE2 3.23Å; K185-E187 WeakPolarHBondContact CG-OE2 3.2Å; K185-E187 PolarHBondContact O-N 2.65Å; K185-E187 VanDerWaalsContact O-N 3.12Å; K185-N188 WeakPolarHBondContact CE-OD1 3.21Å; K185-N188 HydrophobicContact CG-CB 4.25Å; K185-N188 PolarHBondContact NZ-ND2 2.96Å; K185-N188 PolarHBondContact NZ-OD1 2.77Å; K185-N188 PolarHBondContact O-N 2.91Å; K185-N188 VanDerWaalsContact O-N 3.1Å; K185-I189 WeakPolarHBondContact O-CD1 3.41Å; K185-I189 WeakPolarHBondContact O-CG1 3.43Å; K185-T221 HydrophobicContact CD-CG2 4.48Å; K185-T221 VanDerWaalsContact CD-OG1 3.27Å; K185-T221 WeakPolarHBondContact CD-OG1 3.42Å; K185-Y224 HydrophobicContact CB-CD2 3.64Å; K185-Y224 HydrophobicContact CB-CE2 3.64Å; K185-Y224 HydrophobicContact CB-CG 4.15Å
186	P	92.4	Very high	95	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.013	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-51.5	-34.2	-178.3	-28.8	35.8	0	0	0	115.4	F146 N188 I189 Y224 L247 D250	F146-P186 HydrophobicContact CB-CB 3.65Å; F146-P186 HydrophobicContact CD2-CB 3.79Å; F146-P186 HydrophobicContact CD2-CG 4.42Å; F146-P186 HydrophobicContact CG-CB 4.19Å; F146-P186 PolarHBondContact N-O 2.79Å; P186-N188 VanDerWaalsContact C-N 3.34Å; P186-N188 PolarHBondContact O-N 2.84Å; P186-I189 PolarHBondContact O-N 3.48Å; P186-Y224 VanDerWaalsContact CD-CZ 3.42Å; P186-Y224 WeakPolarHBondContact CD-OH 3.44Å; P186-Y224 WeakPolarHBondContact CG-OH 3.38Å; P186-L247 HydrophobicContact CG-CD1 3.64Å; P186-D250 WeakPolarHBondContact CG-OD2 3.35Å
187	E	91.4	Very high	95.2	Very high	68 Å²	68	21.8 Å²	21.8	32%	0.318	11%	0.113	S	C	.	.	G	3₁₀ helix	trans	-72.9	-24.6	-177.1	-45.9	96.6	107.1	0	0	113.1	F146 K185 I189	F146-E187 HydrophobicContact CB-CG 4.49Å; F146-E187 HydrophobicContact CG-CG 4.43Å; K185-E187 WeakPolarHBondContact CB-OE2 3.45Å; K185-E187 WeakPolarHBondContact CD-OE2 3.48Å; K185-E187 VanDerWaalsContact CG-OE2 3.23Å; K185-E187 WeakPolarHBondContact CG-OE2 3.2Å; K185-E187 PolarHBondContact O-N 2.65Å; K185-E187 VanDerWaalsContact O-N 3.12Å; E187-I189 VanDerWaalsContact C-N 3.34Å
188	N	95.4	Very high	95.4	Very high	11 Å²	11	18.4 Å²	18.4	6%	0.059	10%	0.095	C	C	.	.	G	3₁₀ helix	trans	-94.1	8.4	177.8	-69.7	8.5	0	0	0	112.7	Y181 D183 K185 P186 T200	Y181-N188 WeakPolarHBondContact OH-CB 3.23Å; D183-N188 PolarHBondContact O-ND2 3.31Å; D183-N188 PolarHBondContact OD2-ND2 2.71Å; K185-N188 WeakPolarHBondContact CE-OD1 3.21Å; K185-N188 HydrophobicContact CG-CB 4.25Å; K185-N188 PolarHBondContact NZ-ND2 2.96Å; K185-N188 PolarHBondContact NZ-OD1 2.77Å; K185-N188 PolarHBondContact O-N 2.91Å; K185-N188 VanDerWaalsContact O-N 3.1Å; P186-N188 VanDerWaalsContact C-N 3.34Å; P186-N188 PolarHBondContact O-N 2.84Å; N188-T200 PolarHBondContact O-N 3.26Å; N188-T200 PolarHBondContact O-OG1 3.11Å
189	I	97.6	Very high	95.7	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	110.3	179.1	-58	161.4	0	0	0	106.8	L145 I167 L184 K185 P186 E187 I197 L199 L247	L145-I189 HydrophobicContact CB-CB 4.22Å; L145-I189 HydrophobicContact CB-CG2 4.02Å; L145-I189 WeakPolarHBondContact CB-O 3.5Å; L145-I189 HydrophobicContact CD2-CB 4.38Å; L145-I189 HydrophobicContact CD2-CG2 3.67Å; L145-I189 PolarHBondContact N-O 2.87Å; I167-I189 HydrophobicContact CD1-CD1 3.82Å; I167-I189 HydrophobicContact CD1-CG2 4.44Å; L184-I189 HydrophobicContact CD1-CD1 4.02Å; L184-I189 HydrophobicContact CD1-CG1 4.26Å; K185-I189 WeakPolarHBondContact O-CD1 3.41Å; K185-I189 WeakPolarHBondContact O-CG1 3.43Å; P186-I189 PolarHBondContact O-N 3.48Å; E187-I189 VanDerWaalsContact C-N 3.34Å; I189-I197 HydrophobicContact CG2-CB 3.8Å; I189-I197 HydrophobicContact CG2-CD1 4.49Å; I189-I197 HydrophobicContact CG2-CG2 3.78Å; I189-L199 HydrophobicContact CG1-CD2 3.85Å; I189-L247 HydrophobicContact CD1-CD1 4.18Å; I189-L247 HydrophobicContact CD1-CD2 3.47Å; I189-L247 VanDerWaalsContact CD1-CD2 3.47Å; I189-L247 HydrophobicContact CD1-CG 4.49Å
190	M	96.9	Very high	95.8	Very high	30 Å²	30	18 Å²	18	15%	0.148	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	157.6	-179.4	-70.5	-169.8	76.4	0	0	111.5	L140 G143 E144 I197 K198 T200 F347	L140-M190 HydrophobicContact CB-CB 4.03Å; L140-M190 HydrophobicContact CB-CE 3.91Å; L140-M190 HydrophobicContact CB-SD 4.23Å; L140-M190 HydrophobicContact CD1-CB 3.7Å; L140-M190 HydrophobicContact CD1-CG 4.49Å; L140-M190 HydrophobicContact CD1-SD 4.21Å; L140-M190 WeakPolarHBondContact O-CE 3.32Å; G143-M190 CarbonylContact O-C 3.51Å; G143-M190 VanDerWaalsContact O-CA 3.23Å; G143-M190 WeakPolarHBondContact O-CA 3.18Å; G143-M190 WeakPolarHBondContact O-CB 3.43Å; E144-M190 HydrophobicContact CG-CG 4.45Å; M190-I197 CarbonylContact O-C 3.47Å; M190-I197 VanDerWaalsContact O-CA 3.32Å; M190-I197 WeakPolarHBondContact O-CA 3.27Å; M190-K198 PolarHBondContact N-O 2.89Å; M190-K198 PolarHBondContact O-N 2.79Å; M190-T200 HydrophobicContact CB-CG2 4.09Å; M190-T200 HydrophobicContact CG-CG2 3.95Å; M190-T200 HydrophobicContact SD-CG2 3.94Å; M190-F347 HydrophobicContact CE-CE1 3.66Å; M190-F347 HydrophobicContact CE-CZ 3.96Å
191	L	96.7	Very high	95.6	Very high	1 Å²	1	21 Å²	21	1%	0.005	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	137.7	177.2	-65.7	173.7	0	0	0	111.1	L140 G142 G143 L145 Y163 G195 H196 I197 Y334	L140-L191 CarbonylContact C-O 3.47Å; G142-L191 WeakPolarHBondContact CA-O 3.45Å; G142-L191 PolarHBondContact N-O 2.85Å; G143-L191 PolarHBondContact O-N 2.9Å; L145-L191 HydrophobicContact CD1-CD1 4.26Å; L145-L191 HydrophobicContact CD1-CD2 4.32Å; L145-L191 HydrophobicContact CD1-CG 4.46Å; Y163-L191 HydrophobicContact CE1-CD2 3.95Å; L191-G195 WeakPolarHBondContact CD2-O 3.09Å; L191-H196 WeakPolarHBondContact CA-O 3.49Å; L191-I197 HydrophobicContact CD2-CG2 3.84Å; L191-Y334 HydrophobicContact CD1-CD1 3.81Å; L191-Y334 HydrophobicContact CD1-CE1 3.82Å
192	C	94.8	Very high	95.5	Very high	9 Å²	9	21.1 Å²	21.1	6%	0.061	10%	0.104	C	C	.	.			trans	-79.3	166.8	165	76.8	0	0	0	0	110.9	L140 Q194 G195 H196	L140-C192 HydrophobicContact CD2-CB 4.32Å; C192-Q194 PolarHBondContact O-N 2.91Å; C192-Q194 PolarHBondContact SG-OE1 3.4Å; C192-G195 PolarHBondContact O-N 3.2Å; C192-H196 PolarHBondContact N-O 3.04Å
193	Q	93.9	Very high	95.1	Very high	86 Å²	86	21.3 Å²	21.3	40%	0.402	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-27.2	178.9	175	178.5	28.6	0	0	114	L338	Q193-L338 HydrophobicContact CB-CD1 4.2Å; Q193-L338 HydrophobicContact CG-CD1 4.07Å
194	Q	94.8	Very high	94.7	Very high	91 Å²	91	23.1 Å²	23.1	43%	0.425	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-20.4	-179.4	-63.6	71.6	26.8	0	0	113.2	C192 P332	C192-Q194 PolarHBondContact O-N 2.91Å; C192-Q194 PolarHBondContact SG-OE1 3.4Å; Q194-P332 WeakPolarHBondContact O-CG 3.47Å
195	G	96	Very high	94.4	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.118	C	C	.	.	S	Bend	trans	106	0	-178.7	0	0	0	0	0	115.9	Y163 L191 C192 P332 Y334	Y163-G195 WeakPolarHBondContact CE1-O 3.32Å; L191-G195 WeakPolarHBondContact CD2-O 3.09Å; C192-G195 PolarHBondContact O-N 3.2Å; G195-P332 WeakPolarHBondContact O-CB 3.33Å; G195-Y334 WeakPolarHBondContact CA-O 3.39Å
196	H	98.1	Very high	94.1	Very high	11 Å²	11	26.3 Å²	26.3	5%	0.051	13%	0.132	C	C	.	.			trans	-81.1	151.2	173.4	-58.2	-82.4	0	0	0	111.4	F119 F162 E166 L191 C192 K328	F119-H196 HydrophobicContact CD1-CB 4.47Å; F119-H196 HydrophobicContact CE1-CB 4.2Å; F162-H196 AromaticContact CZ-ND1 3.75Å; E166-H196 WeakPolarHBondContact OE1-CB 3.47Å; E166-H196 IonicContact OE1-CE1 2.72Å; E166-H196 IonicContact OE1-CG 2.65Å; E166-H196 IonicContact OE1-ND1 3.61Å; E166-H196 PolarHBondContact OE1-ND1 3.22Å; L191-H196 WeakPolarHBondContact CA-O 3.49Å; C192-H196 PolarHBondContact N-O 3.04Å; H196-K328 HydrophobicContact CB-CD 4.45Å
197	I	97.9	Very high	93.8	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	154.8	176.1	70.8	98.5	0	0	0	112.9	F119 L145 Y163 E166 I167 I189 M190 L191 L199	F119-I197 WeakPolarHBondContact CA-O 3.41Å; F119-I197 HydrophobicContact CB-CD1 3.92Å; F119-I197 WeakPolarHBondContact CD1-O 3.15Å; L145-I197 HydrophobicContact CD2-CG2 4.13Å; Y163-I197 HydrophobicContact CD1-CG2 3.48Å; Y163-I197 VanDerWaalsContact CD1-CG2 3.48Å; Y163-I197 HydrophobicContact CE1-CG2 4Å; Y163-I197 HydrophobicContact CG-CG2 4.2Å; E166-I197 HydrophobicContact CB-CD1 4.14Å; E166-I197 HydrophobicContact CB-CG1 3.49Å; E166-I197 VanDerWaalsContact CB-CG1 3.49Å; E166-I197 HydrophobicContact CG-CG1 4.44Å; E166-I197 WeakPolarHBondContact OE2-CG1 3.38Å; E166-I197 PolarHBondContact OE2-N 3.01Å; I167-I197 HydrophobicContact CG1-CD1 3.64Å; I167-I197 HydrophobicContact CG1-CG1 4.03Å; I189-I197 HydrophobicContact CG2-CB 3.8Å; I189-I197 HydrophobicContact CG2-CD1 4.49Å; I189-I197 HydrophobicContact CG2-CG2 3.78Å; M190-I197 CarbonylContact O-C 3.47Å; M190-I197 VanDerWaalsContact O-CA 3.32Å; M190-I197 WeakPolarHBondContact O-CA 3.27Å; L191-I197 HydrophobicContact CD2-CG2 3.84Å; I197-L199 HydrophobicContact CD1-CD2 4.17Å; I197-L199 HydrophobicContact CD1-CG 4.4Å
198	K	98.4	Very high	93.1	Very high	7 Å²	7	26.9 Å²	26.9	3%	0.03	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	120	170.7	-80	-89.5	-170.1	163.9	0	107.6	P118 F119 I120 D122 E138 L140 M190	P118-K198 VanDerWaalsContact O-CE 3.3Å; P118-K198 WeakPolarHBondContact O-CE 3.42Å; F119-K198 WeakPolarHBondContact O-CA 3.41Å; I120-K198 WeakPolarHBondContact O-CD 3.33Å; I120-K198 WeakPolarHBondContact O-CE 3.32Å; I120-K198 PolarHBondContact O-NZ 3.31Å; D122-K198 IonicContact OD2-NZ 3.07Å; D122-K198 PolarHBondContact OD2-NZ 3.34Å; D122-K198 VanDerWaalsContact OD2-NZ 3.07Å; E138-K198 WeakPolarHBondContact OE1-CD 3.45Å; E138-K198 WeakPolarHBondContact OE1-CE 3.43Å; E138-K198 IonicContact OE1-NZ 2.67Å; E138-K198 PolarHBondContact OE1-NZ 2.85Å; E138-K198 VanDerWaalsContact OE2-CE 3.24Å; E138-K198 WeakPolarHBondContact OE2-CE 3.41Å; E138-K198 IonicContact OE2-NZ 2.71Å; E138-K198 PolarHBondContact OE2-NZ 2.88Å; L140-K198 HydrophobicContact CD1-CB 3.63Å; L140-K198 HydrophobicContact CD1-CG 4.39Å; L140-K198 HydrophobicContact CD2-CB 3.86Å; L140-K198 HydrophobicContact CD2-CD 4.41Å; L140-K198 HydrophobicContact CD2-CG 3.71Å; L140-K198 HydrophobicContact CG-CB 4.42Å; M190-K198 PolarHBondContact N-O 2.89Å; M190-K198 PolarHBondContact O-N 2.79Å
199	L	98.3	Very high	91.4	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	139	172.2	-61.6	-171.9	0	0	0	110.6	F119 V121 I167 A170 L171 L174 Y181 L184 I189 I197 F202	F119-L199 PolarHBondContact O-N 3.27Å; V121-L199 WeakPolarHBondContact CB-O 3.43Å; V121-L199 WeakPolarHBondContact CG1-O 3.34Å; V121-L199 PolarHBondContact N-O 2.88Å; I167-L199 HydrophobicContact CG1-CD2 4.48Å; A170-L199 HydrophobicContact CB-CD1 3.59Å; A170-L199 HydrophobicContact CB-CG 3.95Å; L171-L199 HydrophobicContact CD2-CD1 4.35Å; L174-L199 HydrophobicContact CD1-CD1 4.29Å; Y181-L199 HydrophobicContact CD1-CD1 4.47Å; Y181-L199 HydrophobicContact CE1-CD1 4.28Å; L184-L199 HydrophobicContact CD1-CD2 3.91Å; I189-L199 HydrophobicContact CG1-CD2 3.85Å; I197-L199 HydrophobicContact CD1-CD2 4.17Å; I197-L199 HydrophobicContact CD1-CG 4.4Å; L199-F202 HydrophobicContact CB-CZ 4.22Å
200	T	95.7	Very high	89.4	Confident	20 Å²	20	38.5 Å²	38.5	12%	0.123	19%	0.193	C	C	.	.			trans	-128.2	-177.8	-178.2	67.3	0	0	0	0	112.8	V121 L140 Y181 N188 M190	V121-T200 HydrophobicContact CB-CG2 4.21Å; V121-T200 HydrophobicContact CG1-CG2 4.4Å; L140-T200 HydrophobicContact CD1-CG2 3.63Å; Y181-T200 PolarHBondContact OH-O 3.19Å; N188-T200 PolarHBondContact O-N 3.26Å; N188-T200 PolarHBondContact O-OG1 3.11Å; M190-T200 HydrophobicContact CB-CG2 4.09Å; M190-T200 HydrophobicContact CG-CG2 3.95Å; M190-T200 HydrophobicContact SD-CG2 3.94Å
201	D	90.9	Very high	87.5	Confident	67 Å²	67	44.1 Å²	44.1	36%	0.358	22%	0.224	S	C	.	.			trans	44.5	76.6	177.4	-155.4	23.2	0	0	0	116.1	K88 G203	K88-D201 IonicContact NZ-OD1 2.8Å; K88-D201 PolarHBondContact NZ-OD1 2.94Å; D201-G203 PolarHBondContact O-N 2.98Å
202	F	93.2	Very high	85.9	Confident	1 Å²	1	47 Å²	47	0%	0.004	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-81.1	8.8	-178.4	-74.3	-94.6	0	0	0	113.7	E108 I111 L112 I120 V121 L174 Y181 L199 L204 S205	E108-F202 HydrophobicContact CG-CB 4.2Å; E108-F202 PolarHBondContact OE1-N 2.8Å; I111-F202 HydrophobicContact CG2-CB 4.25Å; I111-F202 HydrophobicContact CG2-CD1 3.63Å; I111-F202 HydrophobicContact CG2-CE1 4.33Å; I111-F202 HydrophobicContact CG2-CG 4.11Å; L112-F202 HydrophobicContact CD2-CD2 3.66Å; L112-F202 HydrophobicContact CD2-CE2 4.09Å; L112-F202 HydrophobicContact CD2-CG 4.3Å; L112-F202 HydrophobicContact CG-CB 4.46Å; L112-F202 HydrophobicContact CG-CD2 4.26Å; I120-F202 HydrophobicContact CG2-CE2 3.83Å; I120-F202 HydrophobicContact CG2-CZ 3.55Å; V121-F202 HydrophobicContact CG1-CE2 4.19Å; L174-F202 HydrophobicContact CD1-CE1 3.79Å; L174-F202 HydrophobicContact CD1-CZ 4.34Å; L174-F202 HydrophobicContact CD2-CE1 3.76Å; L174-F202 HydrophobicContact CD2-CZ 4.5Å; L174-F202 HydrophobicContact CG-CE1 4.44Å; Y181-F202 AromaticContact CD2-CD1 3.84Å; Y181-F202 HydrophobicContact CD2-CD1 3.84Å; Y181-F202 AromaticContact CD2-CE1 3.53Å; Y181-F202 HydrophobicContact CD2-CE1 3.53Å; Y181-F202 HydrophobicContact CD2-CZ 4.13Å; Y181-F202 AromaticContact CE2-CD1 3.95Å; Y181-F202 HydrophobicContact CE2-CD1 3.95Å; Y181-F202 AromaticContact CE2-CE1 3.67Å; Y181-F202 HydrophobicContact CE2-CE1 3.67Å; Y181-F202 HydrophobicContact CE2-CE2 4.29Å; Y181-F202 HydrophobicContact CE2-CG 4.37Å; Y181-F202 AromaticContact CE2-CZ 3.84Å; Y181-F202 HydrophobicContact CE2-CZ 3.84Å; L199-F202 HydrophobicContact CB-CZ 4.22Å; F202-L204 PolarHBondContact O-N 3.39Å; F202-L204 VanDerWaalsContact O-N 3.14Å; F202-S205 WeakPolarHBondContact CD1-OG 3.41Å; F202-S205 WeakPolarHBondContact O-CB 3.47Å; F202-S205 PolarHBondContact O-N 2.85Å; F202-S205 PolarHBondContact O-OG 2.81Å
203	G	87.6	Confident	84.7	Confident	13 Å²	13	49 Å²	49	13%	0.134	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-57.4	-27.9	-178.6	0	0	0	0	0	115	H104 D201	H104-G203 VanDerWaalsContact CB-O 3.32Å; H104-G203 WeakPolarHBondContact CB-O 3.5Å; H104-G203 VanDerWaalsContact CG-O 3.32Å; H104-G203 PolarHBondContact ND1-O 3.14Å; D201-G203 PolarHBondContact O-N 2.98Å
204	L	87.1	Confident	84.2	Confident	48 Å²	48	49.6 Å²	49.6	25%	0.251	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-99	-3.5	176.7	-63.6	-173.6	0	0	0	114.3	R182 D183 F202 C219	R182-L204 VanDerWaalsContact CZ-O 3.25Å; R182-L204 PolarHBondContact NE-O 3.12Å; R182-L204 PolarHBondContact NH2-O 3.42Å; D183-L204 HydrophobicContact CB-CB 4.11Å; D183-L204 HydrophobicContact CB-CD1 4.05Å; F202-L204 PolarHBondContact O-N 3.39Å; F202-L204 VanDerWaalsContact O-N 3.14Å; L204-C219 HydrophobicContact CD1-CB 4.3Å; L204-C219 HydrophobicContact CD2-CB 4.19Å
205	S	90.5	Very high	83.7	Confident	3 Å²	3	46.3 Å²	46.3	2%	0.021	26%	0.257	C	S	.	.			trans	-69	165.3	178	-53.7	0	0	0	0	112.3	I180 Y181 F202	I180-S205 CarbonylContact O-C 3.53Å; I180-S205 WeakPolarHBondContact O-CA 3.38Å; I180-S205 WeakPolarHBondContact O-CB 3.46Å; Y181-S205 WeakPolarHBondContact CD2-OG 3.4Å; Y181-S205 VanDerWaalsContact O-CA 3.29Å; Y181-S205 WeakPolarHBondContact O-CA 3.47Å; Y181-S205 PolarHBondContact O-N 3.45Å; Y181-S205 PolarHBondContact O-OG 3.48Å; F202-S205 WeakPolarHBondContact CD1-OG 3.41Å; F202-S205 WeakPolarHBondContact O-CB 3.47Å; F202-S205 PolarHBondContact O-N 2.85Å; F202-S205 PolarHBondContact O-OG 2.81Å
206	K	88.9	Confident	83.3	Confident	85 Å²	85	51.6 Å²	51.6	37%	0.37	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	129.5	-176.8	179.3	56.5	-174.2	160.4	0	112.5	I180 S208	I180-K206 PolarHBondContact N-O 3.11Å; I180-K206 PolarHBondContact O-N 3.04Å; K206-S208 PolarHBondContact O-N 3.04Å
207	E	86.3	Confident	82.7	Confident	55 Å²	55	53.6 Å²	53.6	26%	0.257	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	117.8	165.2	-64.8	-177.8	-155.2	0	0	110.8	I111 K114 G178 I179 I209	I111-E207 HydrophobicContact CG1-CG 4.23Å; K114-E207 IonicContact NZ-OE1 3.92Å; K114-E207 PolarHBondContact NZ-OE1 3.17Å; K114-E207 IonicContact NZ-OE2 2.79Å; K114-E207 PolarHBondContact NZ-OE2 3.39Å; G178-E207 CarbonylContact O-C 3.57Å; G178-E207 WeakPolarHBondContact O-CA 3.49Å; I179-E207 HydrophobicContact CG1-CG 4.08Å; E207-I209 PolarHBondContact O-N 3.02Å
208	S	75.4	Confident	82.3	Confident	26 Å²	26	57.7 Å²	57.7	18%	0.182	31%	0.313	C	S	.	.			trans	-86.9	88.9	169.4	178	0	0	0	0	108.3	G178 K206 H210	G178-S208 WeakPolarHBondContact O-CA 3.35Å; G178-S208 WeakPolarHBondContact O-CB 3.48Å; G178-S208 PolarHBondContact O-N 2.79Å; K206-S208 PolarHBondContact O-N 3.04Å; S208-H210 PolarHBondContact O-N 3.27Å; S208-H210 PolarHBondContact OG-O 3.06Å
209	I	59.6	Low	81.7	Confident	118 Å²	118	57.9 Å²	57.9	61%	0.605	32%	0.315	S	S	*	.			trans	-59.1	-28.6	-163.2	-53.1	177.6	0	0	0	113.1	E207	E207-I209 PolarHBondContact O-N 3.02Å
210	H	57.4	Low	81.2	Confident	137 Å²	137	59 Å²	59	63%	0.634	33%	0.326	S	S	*	.	S	Bend	trans	-142.9	157.5	171.6	-65.6	96	0	0	0	111.7	S208 G212 T213	S208-H210 PolarHBondContact O-N 3.27Å; S208-H210 PolarHBondContact OG-O 3.06Å; H210-G212 PolarHBondContact O-N 3.46Å; H210-T213 PolarHBondContact N-OG1 2.78Å; H210-T213 VanDerWaalsContact O-CB 3.23Å; H210-T213 WeakPolarHBondContact O-CB 2.98Å; H210-T213 PolarHBondContact O-N 3.03Å; H210-T213 PolarHBondContact O-OG1 2.65Å
211	D	57	Low	81.1	Confident	148 Å²	148	59.9 Å²	59.9	79%	0.791	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	124.3	167.5	-109.6	-14.7	0	0	0	110	R237	D211-R237 IonicContact OD1-NH1 3.94Å
212	G	61.4	Low	81.3	Confident	63 Å²	63	57.4 Å²	57.4	65%	0.649	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.4	0.9	-173.2	0	0	0	0	0	115.5	H210 I214	H210-G212 PolarHBondContact O-N 3.46Å; G212-I214 PolarHBondContact O-N 3.24Å
213	T	71	Confident	81.5	Confident	49 Å²	49	59.7 Å²	59.7	30%	0.301	33%	0.329	S	S	.	.			trans	-64.5	122	169.8	-56.3	0	0	0	0	110.1	H210	H210-T213 PolarHBondContact N-OG1 2.78Å; H210-T213 VanDerWaalsContact O-CB 3.23Å; H210-T213 WeakPolarHBondContact O-CB 2.98Å; H210-T213 PolarHBondContact O-N 3.03Å; H210-T213 PolarHBondContact O-OG1 2.65Å
214	I	83	Confident	82	Confident	99 Å²	99	60 Å²	60	51%	0.508	33%	0.326	S	S	.	.			trans	-106.4	135	178.9	-68.8	168.8	0	0	0	109.1	G212	G212-I214 PolarHBondContact O-N 3.24Å
215	T	84.9	Confident	82.5	Confident	22 Å²	22	58 Å²	58	14%	0.135	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-113.6	148.7	173	173.6	0	0	0	0	110.7	R182 T217 G234 H235	R182-T215 PolarHBondContact NH1-OG1 3.41Å; T215-T217 PolarHBondContact OG1-N 2.76Å; T215-T217 PolarHBondContact OG1-OG1 2.87Å; T215-T217 VanDerWaalsContact OG1-OG1 3.09Å; T215-G234 CarbonylContact O-C 3.54Å; T215-G234 WeakPolarHBondContact O-CA 3.4Å; T215-H235 WeakPolarHBondContact CG2-O 3.38Å; T215-H235 PolarHBondContact N-O 3.07Å; T215-H235 PolarHBondContact O-N 2.81Å; T215-H235 PolarHBondContact O-ND1 2.97Å
216	H	86.9	Confident	82.8	Confident	112 Å²	112	57.9 Å²	57.9	52%	0.519	32%	0.315	S	S	.	.			trans	-115.5	16.6	-179.3	-63.3	-94.6	0	0	0	112.7	F218 R232 G234 H235	H216-F218 PolarHBondContact O-N 3.39Å; H216-R232 PolarHBondContact ND1-O 3.29Å; H216-G234 VanDerWaalsContact CE1-CA 3.41Å; H216-G234 WeakPolarHBondContact CE1-CA 3.27Å; H216-G234 WeakPolarHBondContact ND1-CA 3.47Å; H216-G234 PolarHBondContact ND1-N 2.67Å; H216-H235 VanDerWaalsContact C-CE1 3.47Å
217	T	85.6	Confident	83.2	Confident	52 Å²	52	54.2 Å²	54.2	32%	0.319	30%	0.3	S	S	.	.			trans	-67.3	119.9	178.5	-36.8	0	0	0	0	111.6	R182 T215 C219 H235	R182-T217 PolarHBondContact NH1-OG1 3.08Å; T215-T217 PolarHBondContact OG1-N 2.76Å; T215-T217 PolarHBondContact OG1-OG1 2.87Å; T215-T217 VanDerWaalsContact OG1-OG1 3.09Å; T217-C219 HydrophobicContact CG2-CB 4.18Å; T217-C219 PolarHBondContact O-N 2.79Å; T217-H235 WeakPolarHBondContact CA-CE1 3.4Å; T217-H235 PolarHBondContact N-CE1 3.06Å; T217-H235 PolarHBondContact O-CE1 3.25Å
218	F	88.7	Confident	83.7	Confident	86 Å²	86	52.2 Å²	52.2	38%	0.377	29%	0.291	S	S	.	.			trans	-78.4	106.7	167	-174.1	-82.1	0	0	0	109.3	H216 M225 I229 L230 R232	H216-F218 PolarHBondContact O-N 3.39Å; F218-M225 HydrophobicContact CD1-CE 4.46Å; F218-M225 HydrophobicContact CE1-CE 3.92Å; F218-M225 HydrophobicContact CE1-SD 4.37Å; F218-M225 HydrophobicContact CE2-SD 4.22Å; F218-M225 HydrophobicContact CZ-CE 4.1Å; F218-M225 HydrophobicContact CZ-SD 4Å; F218-I229 HydrophobicContact CD2-CG2 4.46Å; F218-L230 HydrophobicContact CE2-CD2 3.83Å; F218-L230 HydrophobicContact CZ-CD2 4.13Å; F218-R232 HydrophobicContact CD2-CG 4.47Å
219	C	86.5	Confident	84.7	Confident	11 Å²	11	51.1 Å²	51.1	7%	0.074	28%	0.283	C	S	.	.			trans	-154.7	160.4	-175.8	57.8	0	0	0	0	112.2	R182 L204 T217 M225	R182-C219 VanDerWaalsContact CZ-SG 3.58Å; L204-C219 HydrophobicContact CD1-CB 4.3Å; L204-C219 HydrophobicContact CD2-CB 4.19Å; T217-C219 HydrophobicContact CG2-CB 4.18Å; T217-C219 PolarHBondContact O-N 2.79Å; C219-M225 WeakPolarHBondContact O-CE 3.42Å
220	G	88.7	Confident	86.4	Confident	23 Å²	23	46.4 Å²	46.4	24%	0.237	26%	0.259	C	S	.	.	S	Bend	trans	106.4	-178.2	-178.4	0	0	0	0	0	113.9	D183 M225	D183-G220 WeakPolarHBondContact OD1-CA 3.24Å; G220-M225 WeakPolarHBondContact O-CE 3.3Å
221	T	92.3	Very high	88.1	Confident	40 Å²	40	43.2 Å²	43.2	25%	0.245	25%	0.249	C	C	.	.			trans	-85.7	128.9	168.3	-70.4	0	0	0	0	111.3	D183 K185 E223 Y224 M225	D183-T221 PolarHBondContact OD1-N 2.76Å; K185-T221 HydrophobicContact CD-CG2 4.48Å; K185-T221 VanDerWaalsContact CD-OG1 3.27Å; K185-T221 WeakPolarHBondContact CD-OG1 3.42Å; T221-E223 VanDerWaalsContact C-N 3.3Å; T221-E223 HydrophobicContact CG2-CB 4.42Å; T221-E223 WeakPolarHBondContact CG2-OE2 3.35Å; T221-E223 PolarHBondContact O-N 3.19Å; T221-Y224 HydrophobicContact CG2-CD2 3.75Å; T221-Y224 HydrophobicContact CG2-CE2 4.04Å; T221-Y224 PolarHBondContact O-N 2.63Å; T221-M225 WeakPolarHBondContact O-CG 3.29Å; T221-M225 PolarHBondContact O-N 3.17Å; T221-M225 VanDerWaalsContact O-N 3.14Å
222	I	95.7	Very high	89.8	Confident	14 Å²	14	44 Å²	44	7%	0.072	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-58	-40.2	-167.4	-68.6	171.7	0	0	0	112.7	Y224 M225 R263 T266 I267 I270	I222-Y224 PolarHBondContact O-N 2.98Å; I222-M225 HydrophobicContact CG1-CE 3.82Å; I222-M225 HydrophobicContact CG1-SD 4.3Å; I222-M225 PolarHBondContact O-N 3.15Å; I222-M225 VanDerWaalsContact O-N 3.11Å; I222-R263 HydrophobicContact CD1-CB 3.95Å; I222-R263 HydrophobicContact CD1-CG 3.72Å; I222-T266 HydrophobicContact CG2-CG2 3.93Å; I222-I267 HydrophobicContact CG2-CD1 4.4Å; I222-I267 HydrophobicContact CG2-CG1 3.8Å; I222-I270 HydrophobicContact CG2-CD1 4.37Å; I222-I270 WeakPolarHBondContact O-CD1 3.43Å
223	E	96.7	Very high	91.1	Very high	50 Å²	50	45.2 Å²	45.2	23%	0.234	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-61.7	-22.1	-178.2	-71	62.3	-147.4	0	0	112.9	T221 P256 T259 T266	T221-E223 VanDerWaalsContact C-N 3.3Å; T221-E223 HydrophobicContact CG2-CB 4.42Å; T221-E223 WeakPolarHBondContact CG2-OE2 3.35Å; T221-E223 PolarHBondContact O-N 3.19Å; E223-P256 HydrophobicContact CB-CB 4.06Å; E223-P256 HydrophobicContact CB-CG 4.15Å; E223-T259 HydrophobicContact CG-CG2 4.42Å; E223-T266 HydrophobicContact CG-CG2 4.29Å
224	Y	97.8	Very high	92	Very high	18 Å²	18	43.5 Å²	43.5	7%	0.071	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-108.4	-9.6	176.4	-53.6	-84	0	0	0	113.2	K185 P186 T221 I222 S243 A246 D250 P256	K185-Y224 HydrophobicContact CB-CD2 3.64Å; K185-Y224 HydrophobicContact CB-CE2 3.64Å; K185-Y224 HydrophobicContact CB-CG 4.15Å; P186-Y224 VanDerWaalsContact CD-CZ 3.42Å; P186-Y224 WeakPolarHBondContact CD-OH 3.44Å; P186-Y224 WeakPolarHBondContact CG-OH 3.38Å; T221-Y224 HydrophobicContact CG2-CD2 3.75Å; T221-Y224 HydrophobicContact CG2-CE2 4.04Å; T221-Y224 PolarHBondContact O-N 2.63Å; I222-Y224 PolarHBondContact O-N 2.98Å; Y224-S243 PolarHBondContact O-OG 3.01Å; Y224-A246 HydrophobicContact CD1-CB 3.84Å; Y224-D250 PolarHBondContact OH-OD2 2.94Å; Y224-P256 HydrophobicContact CE1-CB 4.47Å; Y224-P256 HydrophobicContact CE1-CG 4.15Å; Y224-P256 HydrophobicContact CE2-CG 4.46Å
225	M	97.5	Very high	92.3	Very high	7 Å²	7	39.1 Å²	39.1	3%	0.034	21%	0.209	C	C	.	.			trans	-64.5	137.9	-178.2	-75	-173.9	-160.5	0	0	113	F218 C219 G220 T221 I222 I229 L230 W242	F218-M225 HydrophobicContact CD1-CE 4.46Å; F218-M225 HydrophobicContact CE1-CE 3.92Å; F218-M225 HydrophobicContact CE1-SD 4.37Å; F218-M225 HydrophobicContact CE2-SD 4.22Å; F218-M225 HydrophobicContact CZ-CE 4.1Å; F218-M225 HydrophobicContact CZ-SD 4Å; C219-M225 WeakPolarHBondContact O-CE 3.42Å; G220-M225 WeakPolarHBondContact O-CE 3.3Å; T221-M225 WeakPolarHBondContact O-CG 3.29Å; T221-M225 PolarHBondContact O-N 3.17Å; T221-M225 VanDerWaalsContact O-N 3.14Å; I222-M225 HydrophobicContact CG1-CE 3.82Å; I222-M225 HydrophobicContact CG1-SD 4.3Å; I222-M225 PolarHBondContact O-N 3.15Å; I222-M225 VanDerWaalsContact O-N 3.11Å; M225-I229 HydrophobicContact CG-CG2 4.45Å; M225-I229 HydrophobicContact SD-CG2 3.94Å; M225-L230 HydrophobicContact CB-CD1 4.42Å; M225-L230 HydrophobicContact CB-CD2 3.95Å; M225-L230 HydrophobicContact CB-CG 4.04Å; M225-L230 HydrophobicContact CG-CD2 4.35Å; M225-L230 HydrophobicContact SD-CD2 3.41Å; M225-L230 WeakPolarHBondContact SD-CD2 3.08Å; M225-L230 HydrophobicContact SD-CG 4.35Å; M225-W242 PolarHBondContact O-NE1 3.43Å
226	A	97.6	Very high	92.6	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.218	C	C	.	.			trans	-69.2	147.5	171	0	0	0	0	0	112.5	E228 I229 L230 V239 W242	A226-E228 HydrophobicContact CB-CG 4.28Å; A226-E228 WeakPolarHBondContact CB-OE2 3.36Å; A226-E228 PolarHBondContact O-N 3.34Å; A226-E228 VanDerWaalsContact O-N 3.15Å; A226-I229 HydrophobicContact CB-CD1 4.43Å; A226-I229 HydrophobicContact CB-CG1 4.4Å; A226-I229 WeakPolarHBondContact O-CB 3.43Å; A226-I229 PolarHBondContact O-N 2.99Å; A226-L230 PolarHBondContact O-N 2.92Å; A226-V239 HydrophobicContact CB-CB 3.87Å; A226-V239 HydrophobicContact CB-CG1 3.73Å; A226-W242 VanDerWaalsContact CA-CD1 3.45Å; A226-W242 HydrophobicContact CB-CB 3.84Å; A226-W242 HydrophobicContact CB-CD2 4.35Å; A226-W242 HydrophobicContact CB-CG 3.76Å
227	P	97.8	Very high	93	Very high	9 Å²	9	38.3 Å²	38.3	6%	0.058	20%	0.203	C	C	.	.	H	α-helix	trans	-49.8	-39.7	179.3	-32.2	38.5	0	0	0	114.8	I229 L230 T231 W242 I270 L271 K295	P227-I229 VanDerWaalsContact C-N 3.35Å; P227-I229 PolarHBondContact O-N 3.14Å; P227-L230 WeakPolarHBondContact O-CB 3.42Å; P227-L230 PolarHBondContact O-N 3.45Å; P227-L230 VanDerWaalsContact O-N 3.14Å; P227-T231 PolarHBondContact O-N 3.04Å; P227-T231 PolarHBondContact O-OG1 2.86Å; P227-W242 HydrophobicContact CG-CE3 4.22Å; P227-W242 HydrophobicContact CG-CH2 3.7Å; P227-W242 HydrophobicContact CG-CZ2 4.1Å; P227-W242 HydrophobicContact CG-CZ3 3.76Å; P227-I270 HydrophobicContact CG-CG2 4Å; P227-L271 HydrophobicContact CB-CD2 3.86Å; P227-K295 HydrophobicContact CG-CB 4.1Å; P227-K295 HydrophobicContact CG-CG 4.07Å
228	E	96.7	Very high	93.5	Very high	12 Å²	12	35.9 Å²	35.9	6%	0.056	19%	0.189	C	C	.	.	H	α-helix	trans	-67.9	-27.5	-179.2	58.8	-92.5	-144	0	0	114.4	A226 T231 R232 S233 H235 V239 R300	A226-E228 HydrophobicContact CB-CG 4.28Å; A226-E228 WeakPolarHBondContact CB-OE2 3.36Å; A226-E228 PolarHBondContact O-N 3.34Å; A226-E228 VanDerWaalsContact O-N 3.15Å; E228-T231 WeakPolarHBondContact CA-OG1 3.3Å; E228-T231 PolarHBondContact O-OG1 2.65Å; E228-R232 WeakPolarHBondContact O-CA 3.26Å; E228-R232 PolarHBondContact O-N 2.72Å; E228-R232 VanDerWaalsContact O-N 3.12Å; E228-S233 PolarHBondContact O-N 2.79Å; E228-S233 VanDerWaalsContact O-N 3.08Å; E228-H235 HydrophobicContact CG-CB 3.9Å; E228-V239 HydrophobicContact CG-CG1 4.03Å; E228-R300 IonicContact OE1-CZ 2.74Å; E228-R300 VanDerWaalsContact OE1-CZ 3.3Å; E228-R300 IonicContact OE1-NH1 2.66Å; E228-R300 PolarHBondContact OE1-NH1 2.94Å; E228-R300 IonicContact OE1-NH2 3.44Å; E228-R300 PolarHBondContact OE1-NH2 3.28Å; E228-R300 IonicContact OE2-CZ 2.63Å; E228-R300 IonicContact OE2-NH1 3.83Å; E228-R300 IonicContact OE2-NH2 2.89Å; E228-R300 PolarHBondContact OE2-NH2 2.85Å
229	I	95.8	Very high	93.9	Very high	3 Å²	3	31.8 Å²	31.8	2%	0.015	17%	0.171	C	C	.	.	H	α-helix	trans	-69.6	-45.1	169.9	-56.4	178.8	0	0	0	108.8	F218 M225 A226 P227 T231 R232 H235 V239	F218-I229 HydrophobicContact CD2-CG2 4.46Å; M225-I229 HydrophobicContact CG-CG2 4.45Å; M225-I229 HydrophobicContact SD-CG2 3.94Å; A226-I229 HydrophobicContact CB-CD1 4.43Å; A226-I229 HydrophobicContact CB-CG1 4.4Å; A226-I229 WeakPolarHBondContact O-CB 3.43Å; A226-I229 PolarHBondContact O-N 2.99Å; P227-I229 VanDerWaalsContact C-N 3.35Å; P227-I229 PolarHBondContact O-N 3.14Å; I229-T231 PolarHBondContact O-N 3.16Å; I229-R232 PolarHBondContact O-N 3.28Å; I229-R232 VanDerWaalsContact O-N 3.08Å; I229-H235 HydrophobicContact CG1-CB 4.29Å; I229-V239 HydrophobicContact CD1-CB 3.96Å; I229-V239 HydrophobicContact CD1-CG1 3.91Å; I229-V239 HydrophobicContact CD1-CG2 4.21Å; I229-V239 HydrophobicContact CG1-CB 4.49Å; I229-V239 HydrophobicContact CG1-CG1 3.89Å
230	L	95.6	Very high	94.4	Very high	19 Å²	19	31.3 Å²	31.3	10%	0.099	17%	0.167	C	C	.	.	H	α-helix	trans	-66.6	-36.1	-177.4	-63	177.3	0	0	0	112.9	F218 M225 A226 P227 R232 I267 I270 L271	F218-L230 HydrophobicContact CE2-CD2 3.83Å; F218-L230 HydrophobicContact CZ-CD2 4.13Å; M225-L230 HydrophobicContact CB-CD1 4.42Å; M225-L230 HydrophobicContact CB-CD2 3.95Å; M225-L230 HydrophobicContact CB-CG 4.04Å; M225-L230 HydrophobicContact CG-CD2 4.35Å; M225-L230 HydrophobicContact SD-CD2 3.41Å; M225-L230 WeakPolarHBondContact SD-CD2 3.08Å; M225-L230 HydrophobicContact SD-CG 4.35Å; A226-L230 PolarHBondContact O-N 2.92Å; P227-L230 WeakPolarHBondContact O-CB 3.42Å; P227-L230 PolarHBondContact O-N 3.45Å; P227-L230 VanDerWaalsContact O-N 3.14Å; L230-R232 VanDerWaalsContact C-N 3.33Å; L230-I267 HydrophobicContact CB-CG2 4.4Å; L230-I267 HydrophobicContact CD1-CG1 4.22Å; L230-I267 HydrophobicContact CD1-CG2 4.28Å; L230-I267 HydrophobicContact CD2-CD1 4.22Å; L230-I267 HydrophobicContact CD2-CG1 3.94Å; L230-I270 HydrophobicContact CD1-CB 3.9Å; L230-I270 HydrophobicContact CD1-CD1 3.72Å; L230-I270 HydrophobicContact CD1-CG1 4.41Å; L230-I270 HydrophobicContact CD1-CG2 3.56Å; L230-L271 HydrophobicContact CB-CD2 4.33Å
231	T	94	Very high	94.9	Very high	71 Å²	71	30.2 Å²	30.2	44%	0.436	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-8	172.4	57.1	0	0	0	0	113.5	P227 E228 I229 S233 L271	P227-T231 PolarHBondContact O-N 3.04Å; P227-T231 PolarHBondContact O-OG1 2.86Å; E228-T231 WeakPolarHBondContact CA-OG1 3.3Å; E228-T231 PolarHBondContact O-OG1 2.65Å; I229-T231 PolarHBondContact O-N 3.16Å; T231-S233 WeakPolarHBondContact CB-OG 3.39Å; T231-S233 PolarHBondContact O-N 3.25Å; T231-S233 PolarHBondContact OG1-OG 3.14Å; T231-L271 HydrophobicContact CG2-CD1 4.33Å; T231-L271 HydrophobicContact CG2-CD2 3.87Å
232	R	92.4	Very high	95.2	Very high	165 Å²	165	28.3 Å²	28.3	62%	0.623	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.3	22.1	-172.7	-53.6	-179.7	-178.9	175.5	-0.2	114.2	H216 F218 E228 I229 L230 G234	H216-R232 PolarHBondContact ND1-O 3.29Å; F218-R232 HydrophobicContact CD2-CG 4.47Å; E228-R232 WeakPolarHBondContact O-CA 3.26Å; E228-R232 PolarHBondContact O-N 2.72Å; E228-R232 VanDerWaalsContact O-N 3.12Å; I229-R232 PolarHBondContact O-N 3.28Å; I229-R232 VanDerWaalsContact O-N 3.08Å; L230-R232 VanDerWaalsContact C-N 3.33Å; R232-G234 PolarHBondContact O-N 2.88Å
233	S	88.5	Confident	95.4	Very high	87 Å²	87	27.9 Å²	27.9	61%	0.608	14%	0.143	S	C	*	.	S	Bend	trans	-62.3	-13.3	-179	-62.4	0	0	0	0	113.5	E228 T231	E228-S233 PolarHBondContact O-N 2.79Å; E228-S233 VanDerWaalsContact O-N 3.08Å; T231-S233 WeakPolarHBondContact CB-OG 3.39Å; T231-S233 PolarHBondContact O-N 3.25Å; T231-S233 PolarHBondContact OG1-OG 3.14Å
234	G	88.8	Confident	95.5	Very high	14 Å²	14	25.5 Å²	25.5	14%	0.144	13%	0.132	C	C	.	.			trans	102.7	142.6	-173.3	0	0	0	0	0	110.3	T215 H216 R232	T215-G234 CarbonylContact O-C 3.54Å; T215-G234 WeakPolarHBondContact O-CA 3.4Å; H216-G234 VanDerWaalsContact CE1-CA 3.41Å; H216-G234 WeakPolarHBondContact CE1-CA 3.27Å; H216-G234 WeakPolarHBondContact ND1-CA 3.47Å; H216-G234 PolarHBondContact ND1-N 2.67Å; R232-G234 PolarHBondContact O-N 2.88Å
235	H	90.7	Very high	95.5	Very high	6 Å²	6	24.7 Å²	24.7	3%	0.028	13%	0.128	C	C	.	.	B	Isolated β-bridge	trans	-143.2	161	-177.8	62.6	-77.7	0	0	0	113.6	R182 T215 H216 T217 E228 I229 V239	R182-H235 WeakPolarHBondContact CD-NE2 3.24Å; R182-H235 PolarHBondContact NE-NE2 3.24Å; R182-H235 PolarHBondContact NH1-NE2 3.21Å; R182-H235 VanDerWaalsContact NH1-NE2 3.13Å; T215-H235 WeakPolarHBondContact CG2-O 3.38Å; T215-H235 PolarHBondContact N-O 3.07Å; T215-H235 PolarHBondContact O-N 2.81Å; T215-H235 PolarHBondContact O-ND1 2.97Å; H216-H235 VanDerWaalsContact C-CE1 3.47Å; T217-H235 WeakPolarHBondContact CA-CE1 3.4Å; T217-H235 PolarHBondContact N-CE1 3.06Å; T217-H235 PolarHBondContact O-CE1 3.25Å; E228-H235 HydrophobicContact CG-CB 3.9Å; I229-H235 HydrophobicContact CG1-CB 4.29Å; H235-V239 HydrophobicContact CB-CG1 3.52Å
236	N	91.4	Very high	95.5	Very high	62 Å²	62	24.3 Å²	24.3	33%	0.332	13%	0.127	S	C	.	.			trans	-137.6	-160.6	177.2	68.7	5.1	0	0	0	109.3	A238 V239	N236-A238 PolarHBondContact O-N 3.4Å; N236-A238 WeakPolarHBondContact OD1-CB 3.42Å; N236-A238 PolarHBondContact OD1-N 2.9Å; N236-V239 WeakPolarHBondContact O-CG2 3.3Å; N236-V239 PolarHBondContact O-N 3.25Å
237	R	94.1	Very high	95.6	Very high	55 Å²	55	24.4 Å²	24.4	21%	0.208	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-19.5	179.8	76.7	-174.7	-169.9	-139.5	1.6	116.3	I180 D211 V239 D240 G304 K305 D307	I180-R237 HydrophobicContact CG1-CB 4.34Å; D211-R237 IonicContact OD1-NH1 3.94Å; R237-V239 PolarHBondContact O-N 3.12Å; R237-D240 PolarHBondContact O-N 2.8Å; R237-G304 PolarHBondContact NH2-O 2.86Å; R237-K305 PolarHBondContact NH2-O 3.2Å; R237-D307 VanDerWaalsContact CD-OD1 3.23Å; R237-D307 WeakPolarHBondContact CD-OD1 3.38Å; R237-D307 IonicContact CZ-OD1 3.18Å; R237-D307 IonicContact NE-OD1 2.7Å; R237-D307 PolarHBondContact NE-OD1 3.06Å
238	A	95.7	Very high	95.6	Very high	2 Å²	2	24 Å²	24	2%	0.017	12%	0.124	C	C	.	.	H	α-helix	trans	-57.4	-23.1	176.8	0	0	0	0	0	114.2	N236 W242 P297 R300 S303	N236-A238 PolarHBondContact O-N 3.4Å; N236-A238 WeakPolarHBondContact OD1-CB 3.42Å; N236-A238 PolarHBondContact OD1-N 2.9Å; A238-W242 PolarHBondContact O-N 3.22Å; A238-P297 HydrophobicContact CB-CB 3.79Å; A238-R300 VanDerWaalsContact C-NH1 3.34Å; A238-R300 WeakPolarHBondContact O-CD 3.47Å; A238-R300 PolarHBondContact O-NH1 2.99Å; A238-S303 WeakPolarHBondContact CB-OG 3.44Å
239	V	97.3	Very high	95.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-70.5	-34.3	-178.1	-57.1	0	0	0	0	112.9	I180 R182 A226 E228 I229 H235 N236 R237 W241 W242 S243	I180-V239 HydrophobicContact CG2-CG2 4.08Å; R182-V239 HydrophobicContact CG-CG2 4.34Å; A226-V239 HydrophobicContact CB-CB 3.87Å; A226-V239 HydrophobicContact CB-CG1 3.73Å; E228-V239 HydrophobicContact CG-CG1 4.03Å; I229-V239 HydrophobicContact CD1-CB 3.96Å; I229-V239 HydrophobicContact CD1-CG1 3.91Å; I229-V239 HydrophobicContact CD1-CG2 4.21Å; I229-V239 HydrophobicContact CG1-CB 4.49Å; I229-V239 HydrophobicContact CG1-CG1 3.89Å; H235-V239 HydrophobicContact CB-CG1 3.52Å; N236-V239 WeakPolarHBondContact O-CG2 3.3Å; N236-V239 PolarHBondContact O-N 3.25Å; R237-V239 PolarHBondContact O-N 3.12Å; V239-W241 VanDerWaalsContact C-N 3.26Å; V239-W241 PolarHBondContact O-N 2.89Å; V239-W242 WeakPolarHBondContact O-CA 3.49Å; V239-W242 WeakPolarHBondContact O-CB 3.44Å; V239-W242 PolarHBondContact O-N 2.98Å; V239-S243 PolarHBondContact O-N 2.99Å; V239-S243 PolarHBondContact O-OG 3.19Å; V239-S243 VanDerWaalsContact O-OG 3.09Å
240	D	98.2	Very high	95.8	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-70.5	-29	-178.5	-67.3	-36.6	0	0	0	111.1	L171 H175 I180 Y181 R182 R237 S243 L244	L171-D240 HydrophobicContact CD1-CB 4.29Å; L171-D240 HydrophobicContact CD2-CB 3.99Å; H175-D240 IonicContact NE2-OD2 2.73Å; I180-D240 WeakPolarHBondContact CG2-OD2 3.46Å; Y181-D240 PolarHBondContact N-OD2 3.05Å; R182-D240 VanDerWaalsContact CA-OD1 3.27Å; R182-D240 WeakPolarHBondContact CA-OD1 3.39Å; R182-D240 PolarHBondContact N-OD1 3.45Å; R182-D240 PolarHBondContact N-OD2 2.8Å; R237-D240 PolarHBondContact O-N 2.8Å; D240-S243 PolarHBondContact O-N 3.35Å; D240-L244 WeakPolarHBondContact O-CB 3.25Å; D240-L244 PolarHBondContact O-N 3.47Å
241	W	98.6	Very high	95.9	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-69.8	-29.9	168.7	-57.6	130.8	0	0	0	113.6	T168 L171 H175 V239 L244 G245 L292 G302 D307 A308 I311	T168-W241 HydrophobicContact CG2-CH2 4.13Å; T168-W241 HydrophobicContact CG2-CZ3 4.09Å; L171-W241 HydrophobicContact CB-CH2 3.7Å; L171-W241 HydrophobicContact CB-CZ2 4.4Å; L171-W241 HydrophobicContact CB-CZ3 3.94Å; L171-W241 HydrophobicContact CD1-CE3 4.14Å; L171-W241 HydrophobicContact CD1-CH2 4.39Å; L171-W241 HydrophobicContact CD1-CZ3 3.78Å; H175-W241 AromaticContact CE1-CE2 3.49Å; H175-W241 VanDerWaalsContact CE1-CE2 3.49Å; H175-W241 AromaticContact CE1-CZ2 3.57Å; H175-W241 AromaticContact CE1-NE1 3.48Å; H175-W241 PolarHBondContact CE1-NE1 3.13Å; H175-W241 AromaticContact ND1-CE2 3.73Å; H175-W241 AromaticContact ND1-CZ2 3.52Å; H175-W241 AromaticContact ND1-NE1 3.64Å; V239-W241 VanDerWaalsContact C-N 3.26Å; V239-W241 PolarHBondContact O-N 2.89Å; W241-L244 HydrophobicContact CE3-CB 4.45Å; W241-L244 HydrophobicContact CE3-CD2 3.72Å; W241-L244 HydrophobicContact CZ3-CD2 3.85Å; W241-G245 PolarHBondContact O-N 3.23Å; W241-L292 HydrophobicContact CB-CD2 4.11Å; W241-L292 WeakPolarHBondContact O-CB 3.34Å; W241-L292 WeakPolarHBondContact O-CD2 3.47Å; W241-G302 PolarHBondContact NE1-O 2.82Å; W241-D307 WeakPolarHBondContact CZ2-OD2 3.19Å; W241-D307 PolarHBondContact NE1-OD1 3.46Å; W241-A308 HydrophobicContact CH2-CB 3.71Å; W241-A308 HydrophobicContact CZ2-CB 3.74Å; W241-I311 HydrophobicContact CD2-CD1 4.03Å; W241-I311 HydrophobicContact CD2-CG1 3.98Å; W241-I311 HydrophobicContact CE3-CD1 4.02Å; W241-I311 HydrophobicContact CE3-CG1 3.73Å; W241-I311 HydrophobicContact CG-CD1 4.37Å; W241-I311 HydrophobicContact CH2-CG1 4.01Å; W241-I311 HydrophobicContact CZ2-CG1 4.21Å; W241-I311 HydrophobicContact CZ3-CG1 3.75Å
242	W	98.7	Very high	96.1	Very high	1 Å²	1	20.2 Å²	20.2	0%	0.004	10%	0.102	C	C	.	.	H	α-helix	trans	-68.7	-46.2	168.4	170.5	-77	0	0	0	110.7	M225 A226 P227 A238 V239 L244 G245 A246 F258 I270 L293 K295	M225-W242 PolarHBondContact O-NE1 3.43Å; A226-W242 VanDerWaalsContact CA-CD1 3.45Å; A226-W242 HydrophobicContact CB-CB 3.84Å; A226-W242 HydrophobicContact CB-CD2 4.35Å; A226-W242 HydrophobicContact CB-CG 3.76Å; P227-W242 HydrophobicContact CG-CE3 4.22Å; P227-W242 HydrophobicContact CG-CH2 3.7Å; P227-W242 HydrophobicContact CG-CZ2 4.1Å; P227-W242 HydrophobicContact CG-CZ3 3.76Å; A238-W242 PolarHBondContact O-N 3.22Å; V239-W242 WeakPolarHBondContact O-CA 3.49Å; V239-W242 WeakPolarHBondContact O-CB 3.44Å; V239-W242 PolarHBondContact O-N 2.98Å; W242-L244 VanDerWaalsContact C-N 3.28Å; W242-L244 PolarHBondContact O-N 2.99Å; W242-G245 CarbonylContact O-C 3.57Å; W242-G245 WeakPolarHBondContact O-CA 3.23Å; W242-G245 PolarHBondContact O-N 3.31Å; W242-A246 PolarHBondContact O-N 3.07Å; W242-F258 AromaticContact CH2-CE2 3.85Å; W242-F258 HydrophobicContact CH2-CE2 3.85Å; W242-F258 HydrophobicContact CZ2-CD2 4.14Å; W242-F258 AromaticContact CZ2-CE2 3.72Å; W242-F258 HydrophobicContact CZ2-CE2 3.72Å; W242-I270 HydrophobicContact CH2-CG2 4.37Å; W242-I270 HydrophobicContact CZ2-CG2 3.83Å; W242-L293 HydrophobicContact CD2-CD2 3.77Å; W242-L293 HydrophobicContact CE3-CB 4.41Å; W242-L293 HydrophobicContact CE3-CD2 4.05Å; W242-L293 HydrophobicContact CG-CD2 4.26Å; W242-L293 HydrophobicContact CH2-CB 4.34Å; W242-L293 HydrophobicContact CH2-CD2 4.23Å; W242-L293 HydrophobicContact CZ2-CD2 3.96Å; W242-L293 HydrophobicContact CZ3-CB 4.1Å; W242-L293 HydrophobicContact CZ3-CD2 4.28Å; W242-L293 WeakPolarHBondContact CZ3-O 3.43Å; W242-K295 HydrophobicContact CH2-CG 4.21Å; W242-K295 HydrophobicContact CZ3-CG 4.02Å
243	S	98.6	Very high	96.3	Very high	5 Å²	5	13.4 Å²	13.4	4%	0.035	8%	0.078	C	C	.	.	H	α-helix	trans	-59.6	-38.6	177.8	-51	0	0	0	0	111.5	Y224 V239 D240 G245 A246 L247	Y224-S243 PolarHBondContact O-OG 3.01Å; V239-S243 PolarHBondContact O-N 2.99Å; V239-S243 PolarHBondContact O-OG 3.19Å; V239-S243 VanDerWaalsContact O-OG 3.09Å; D240-S243 PolarHBondContact O-N 3.35Å; S243-G245 VanDerWaalsContact C-N 3.34Å; S243-G245 PolarHBondContact O-N 3.36Å; S243-A246 PolarHBondContact O-N 3.48Å; S243-L247 WeakPolarHBondContact O-CB 3.45Å; S243-L247 PolarHBondContact O-N 3.35Å
244	L	98.8	Very high	96.6	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-60.4	-41.4	171.5	-174	72.8	0	0	0	111.8	L164 I167 L184 D240 W241 W242 A246 L247 M248 L292 I311	L164-L244 HydrophobicContact CD2-CD1 3.57Å; L164-L244 HydrophobicContact CD2-CG 4.3Å; I167-L244 HydrophobicContact CB-CD1 4.32Å; I167-L244 HydrophobicContact CG2-CD1 3.73Å; L184-L244 HydrophobicContact CD2-CB 4.12Å; L184-L244 HydrophobicContact CD2-CD1 4.23Å; D240-L244 WeakPolarHBondContact O-CB 3.25Å; D240-L244 PolarHBondContact O-N 3.47Å; W241-L244 HydrophobicContact CE3-CB 4.45Å; W241-L244 HydrophobicContact CE3-CD2 3.72Å; W241-L244 HydrophobicContact CZ3-CD2 3.85Å; W242-L244 VanDerWaalsContact C-N 3.28Å; W242-L244 PolarHBondContact O-N 2.99Å; L244-A246 VanDerWaalsContact C-N 3.33Å; L244-A246 PolarHBondContact O-N 3.04Å; L244-L247 PolarHBondContact O-N 3.31Å; L244-M248 VanDerWaalsContact O-CB 3.25Å; L244-M248 WeakPolarHBondContact O-CB 3.45Å; L244-M248 PolarHBondContact O-N 2.95Å; L244-L292 HydrophobicContact CD2-CD1 4.26Å; L244-L292 HydrophobicContact CG-CD1 4.38Å; L244-I311 HydrophobicContact CD2-CG2 4.18Å
245	G	98.7	Very high	96.9	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-66.2	-32.3	174.6	0	0	0	0	0	113.8	W241 W242 S243 H249	W241-G245 PolarHBondContact O-N 3.23Å; W242-G245 CarbonylContact O-C 3.57Å; W242-G245 WeakPolarHBondContact O-CA 3.23Å; W242-G245 PolarHBondContact O-N 3.31Å; S243-G245 VanDerWaalsContact C-N 3.34Å; S243-G245 PolarHBondContact O-N 3.36Å; G245-H249 PolarHBondContact O-N 2.93Å
246	A	98.6	Very high	97.1	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-74.3	-42.3	174.9	0	0	0	0	0	111.7	Y224 W242 S243 L244 H249 D250 P257 L293	Y224-A246 HydrophobicContact CD1-CB 3.84Å; W242-A246 PolarHBondContact O-N 3.07Å; S243-A246 PolarHBondContact O-N 3.48Å; L244-A246 VanDerWaalsContact C-N 3.33Å; L244-A246 PolarHBondContact O-N 3.04Å; A246-H249 PolarHBondContact O-N 2.89Å; A246-D250 PolarHBondContact O-N 3.2Å; A246-P257 HydrophobicContact CB-CG 3.92Å; A246-L293 HydrophobicContact CB-CD2 4.34Å
247	L	98.4	Very high	97.4	Very high	1 Å²	1	11.2 Å²	11.2	1%	0.005	7%	0.072	C	C	.	.	H	α-helix	trans	-63.5	-41.9	173.5	-179.7	67.4	0	0	0	112.3	L164 I167 L184 P186 I189 S243 L244 H249 D250 M251	L164-L247 HydrophobicContact CD2-CD2 4.32Å; L164-L247 HydrophobicContact CD2-CG 4.44Å; I167-L247 HydrophobicContact CD1-CD2 3.72Å; L184-L247 HydrophobicContact CD2-CD2 3.96Å; L184-L247 HydrophobicContact CG-CD2 4.14Å; P186-L247 HydrophobicContact CG-CD1 3.64Å; I189-L247 HydrophobicContact CD1-CD1 4.18Å; I189-L247 HydrophobicContact CD1-CD2 3.47Å; I189-L247 VanDerWaalsContact CD1-CD2 3.47Å; I189-L247 HydrophobicContact CD1-CG 4.49Å; S243-L247 WeakPolarHBondContact O-CB 3.45Å; S243-L247 PolarHBondContact O-N 3.35Å; L244-L247 PolarHBondContact O-N 3.31Å; L247-H249 VanDerWaalsContact C-N 3.31Å; L247-H249 PolarHBondContact O-N 2.95Å; L247-D250 WeakPolarHBondContact O-CB 3.44Å; L247-D250 PolarHBondContact O-N 3Å; L247-M251 HydrophobicContact CD1-CE 4.06Å; L247-M251 HydrophobicContact CD2-CE 4.08Å; L247-M251 HydrophobicContact CG-CE 3.94Å; L247-M251 WeakPolarHBondContact O-CG 3.47Å; L247-M251 PolarHBondContact O-N 3.04Å
248	M	98.6	Very high	97.6	Very high	0 Å²	0	9 Å²	9	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-61.2	-40.1	174.9	177.7	176.5	-170	0	0	111.8	L164 L244 L252 A285 M288 I289 F316	L164-M248 HydrophobicContact CD1-CB 3.7Å; L164-M248 HydrophobicContact CD1-CG 3.54Å; L164-M248 HydrophobicContact CD1-SD 4.15Å; L164-M248 HydrophobicContact CD2-CB 4.05Å; L244-M248 VanDerWaalsContact O-CB 3.25Å; L244-M248 WeakPolarHBondContact O-CB 3.45Å; L244-M248 PolarHBondContact O-N 2.95Å; M248-L252 HydrophobicContact CE-CD1 4.04Å; M248-L252 HydrophobicContact CG-CD1 4.06Å; M248-L252 WeakPolarHBondContact O-CB 3.48Å; M248-L252 VanDerWaalsContact O-CG 3.25Å; M248-L252 WeakPolarHBondContact O-CG 3.32Å; M248-L252 PolarHBondContact O-N 3.06Å; M248-A285 HydrophobicContact CE-CB 3.82Å; M248-M288 HydrophobicContact CE-CB 3.98Å; M248-M288 HydrophobicContact CE-CE 4.44Å; M248-M288 HydrophobicContact CE-CG 4.2Å; M248-M288 HydrophobicContact CE-SD 3.93Å; M248-M288 HydrophobicContact SD-CB 4.04Å; M248-M288 HydrophobicContact SD-CE 3.66Å; M248-M288 HydrophobicContact SD-CG 3.77Å; M248-M288 HydrophobicContact SD-SD 3.79Å; M248-I289 HydrophobicContact CB-CG1 4.33Å; M248-I289 HydrophobicContact CE-CG1 4.13Å; M248-I289 HydrophobicContact CG-CD1 4.08Å; M248-I289 HydrophobicContact CG-CG1 3.7Å; M248-I289 HydrophobicContact SD-CD1 4.43Å; M248-I289 HydrophobicContact SD-CG1 3.6Å; M248-F316 HydrophobicContact CE-CD1 3.92Å; M248-F316 HydrophobicContact CE-CD2 3.83Å; M248-F316 HydrophobicContact CE-CE1 3.68Å; M248-F316 HydrophobicContact CE-CE2 3.62Å; M248-F316 HydrophobicContact CE-CG 3.98Å; M248-F316 HydrophobicContact CE-CZ 3.54Å
249	H	98.5	Very high	97.6	Very high	11 Å²	11	11.6 Å²	11.6	5%	0.051	8%	0.08	C	C	.	.	H	α-helix	trans	-65.9	-41.9	173.1	-178.3	-68.2	0	0	0	111.8	G245 A246 L247 L252 T253 S255 P257 N276 I289	G245-H249 PolarHBondContact O-N 2.93Å; A246-H249 PolarHBondContact O-N 2.89Å; L247-H249 VanDerWaalsContact C-N 3.31Å; L247-H249 PolarHBondContact O-N 2.95Å; H249-L252 PolarHBondContact O-N 2.85Å; H249-T253 PolarHBondContact CE1-OG1 2.88Å; H249-T253 PolarHBondContact ND1-OG1 3Å; H249-T253 WeakPolarHBondContact O-CB 3.49Å; H249-T253 PolarHBondContact O-N 3.31Å; H249-T253 PolarHBondContact O-OG1 2.75Å; H249-S255 PolarHBondContact CE1-O 3.27Å; H249-S255 PolarHBondContact ND1-O 2.78Å; H249-P257 HydrophobicContact CB-CB 4.13Å; H249-P257 HydrophobicContact CB-CG 4.35Å; H249-N276 PolarHBondContact NE2-O 2.77Å; H249-I289 HydrophobicContact CB-CD1 4.47Å; H249-I289 HydrophobicContact CB-CG2 4.42Å
250	D	97.5	Very high	97.5	Very high	9 Å²	9	13.2 Å²	13.2	5%	0.048	9%	0.093	C	C	.	.	H	α-helix	trans	-61	-53.5	178.4	-169.6	46.3	0	0	0	111.7	L149 P186 Y224 A246 L247 L252 T253 G254 S255 P256	L149-D250 WeakPolarHBondContact CD2-OD2 3.49Å; P186-D250 WeakPolarHBondContact CG-OD2 3.35Å; Y224-D250 PolarHBondContact OH-OD2 2.94Å; A246-D250 PolarHBondContact O-N 3.2Å; L247-D250 WeakPolarHBondContact O-CB 3.44Å; L247-D250 PolarHBondContact O-N 3Å; D250-L252 VanDerWaalsContact C-N 3.27Å; D250-L252 PolarHBondContact O-N 3.09Å; D250-T253 PolarHBondContact O-N 3.39Å; D250-G254 WeakPolarHBondContact O-CA 3.23Å; D250-G254 PolarHBondContact O-N 3.34Å; D250-S255 WeakPolarHBondContact CA-O 3.48Å; D250-S255 WeakPolarHBondContact OD1-CA 3.19Å; D250-S255 PolarHBondContact OD1-N 3Å; D250-P256 HydrophobicContact CB-CG 4.49Å; D250-P256 WeakPolarHBondContact OD1-CD 3.44Å
251	M	97.9	Very high	97.3	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.01	13%	0.129	C	C	.	.	H	α-helix	trans	-52.1	-43.6	174.8	-72.3	-178.5	175.8	0	0	112.8	L145 L149 F155 A160 L164 I167 L247	L145-M251 HydrophobicContact CD2-CE 3.6Å; L149-M251 HydrophobicContact CD2-CG 4.43Å; F155-M251 HydrophobicContact CD2-CB 4.05Å; F155-M251 HydrophobicContact CD2-CG 3.87Å; F155-M251 HydrophobicContact CD2-SD 4.21Å; F155-M251 HydrophobicContact CE2-CG 4.26Å; F155-M251 PolarHBondContact N-O 3.39Å; A160-M251 HydrophobicContact CB-CB 4.26Å; A160-M251 HydrophobicContact CB-SD 4.25Å; L164-M251 HydrophobicContact CD1-SD 4.42Å; L164-M251 HydrophobicContact CD2-SD 4.08Å; L164-M251 HydrophobicContact CG-SD 3.98Å; I167-M251 HydrophobicContact CD1-CE 4.3Å; L247-M251 HydrophobicContact CD1-CE 4.06Å; L247-M251 HydrophobicContact CD2-CE 4.08Å; L247-M251 HydrophobicContact CG-CE 3.94Å; L247-M251 WeakPolarHBondContact O-CG 3.47Å; L247-M251 PolarHBondContact O-N 3.04Å
252	L	97.9	Very high	97.1	Very high	4 Å²	4	24.3 Å²	24.3	2%	0.021	15%	0.147	C	C	.	.	H	α-helix	trans	-88.3	-6.1	-173.3	-63.4	179.2	0	0	0	114.7	E157 A160 M248 H249 D250 I281 A285 I289	E157-L252 HydrophobicContact CB-CD2 4.4Å; E157-L252 HydrophobicContact CG-CD1 4.22Å; E157-L252 HydrophobicContact CG-CD2 3.71Å; A160-L252 HydrophobicContact CB-CD2 3.57Å; A160-L252 HydrophobicContact CB-CG 4.18Å; M248-L252 HydrophobicContact CE-CD1 4.04Å; M248-L252 HydrophobicContact CG-CD1 4.06Å; M248-L252 WeakPolarHBondContact O-CB 3.48Å; M248-L252 VanDerWaalsContact O-CG 3.25Å; M248-L252 WeakPolarHBondContact O-CG 3.32Å; M248-L252 PolarHBondContact O-N 3.06Å; H249-L252 PolarHBondContact O-N 2.85Å; D250-L252 VanDerWaalsContact C-N 3.27Å; D250-L252 PolarHBondContact O-N 3.09Å; L252-I281 HydrophobicContact CB-CD1 3.75Å; L252-I281 HydrophobicContact CD1-CD1 4.49Å; L252-A285 HydrophobicContact CD1-CB 4.13Å; L252-I289 HydrophobicContact CD1-CD1 4.38Å
253	T	96.7	Very high	97	Very high	22 Å²	22	33 Å²	33	14%	0.135	18%	0.18	C	C	.	.	H	α-helix	trans	-139.3	-6.7	-176	70.7	0	0	0	0	115.5	H249 D250 S255 P278 I281	H249-T253 PolarHBondContact CE1-OG1 2.88Å; H249-T253 PolarHBondContact ND1-OG1 3Å; H249-T253 WeakPolarHBondContact O-CB 3.49Å; H249-T253 PolarHBondContact O-N 3.31Å; H249-T253 PolarHBondContact O-OG1 2.75Å; D250-T253 PolarHBondContact O-N 3.39Å; T253-S255 VanDerWaalsContact C-N 3.31Å; T253-S255 PolarHBondContact OG1-O 3.02Å; T253-P278 HydrophobicContact CG2-CG 4.12Å; T253-I281 HydrophobicContact CG2-CD1 4.22Å
254	G	94.9	Very high	96.8	Very high	41 Å²	41	40.1 Å²	40.1	42%	0.423	21%	0.211	S	C	.	.	S	Bend	trans	75.6	17.2	-179.8	0	0	0	0	0	114	G153 D250	G153-G254 WeakPolarHBondContact O-CA 3.34Å; D250-G254 WeakPolarHBondContact O-CA 3.23Å; D250-G254 PolarHBondContact O-N 3.34Å
255	S	94.8	Very high	96.8	Very high	48 Å²	48	44.4 Å²	44.4	34%	0.336	23%	0.229	S	C	.	.	S	Bend	trans	-162.2	150.8	169.8	59.2	0	0	0	0	112.9	H249 D250 T253	H249-S255 PolarHBondContact CE1-O 3.27Å; H249-S255 PolarHBondContact ND1-O 2.78Å; D250-S255 WeakPolarHBondContact CA-O 3.48Å; D250-S255 WeakPolarHBondContact OD1-CA 3.19Å; D250-S255 PolarHBondContact OD1-N 3Å; T253-S255 VanDerWaalsContact C-N 3.31Å; T253-S255 PolarHBondContact OG1-O 3.02Å
256	P	96.2	Very high	96.7	Very high	17 Å²	17	44.4 Å²	44.4	11%	0.11	23%	0.229	C	C	.	.			trans	-60.3	153	173	-26	36.4	0	0	0	112.6	E223 Y224 D250 F258 T259	E223-P256 HydrophobicContact CB-CB 4.06Å; E223-P256 HydrophobicContact CB-CG 4.15Å; Y224-P256 HydrophobicContact CE1-CB 4.47Å; Y224-P256 HydrophobicContact CE1-CG 4.15Å; Y224-P256 HydrophobicContact CE2-CG 4.46Å; D250-P256 HydrophobicContact CB-CG 4.49Å; D250-P256 WeakPolarHBondContact OD1-CD 3.44Å; P256-F258 PolarHBondContact O-N 3.26Å; P256-T259 HydrophobicContact CB-CG2 4.02Å; P256-T259 HydrophobicContact CG-CG2 4.22Å
257	P	97.4	Very high	96.7	Very high	17 Å²	17	46.4 Å²	46.4	11%	0.11	24%	0.24	C	C	.	.	S	Bend	trans	-63.6	-19.8	-169.8	26.3	-35.7	0	0	0	114.2	A246 H249 V275 L293	A246-P257 HydrophobicContact CB-CG 3.92Å; H249-P257 HydrophobicContact CB-CB 4.13Å; H249-P257 HydrophobicContact CB-CG 4.35Å; P257-V275 HydrophobicContact CB-CG2 3.8Å; P257-L293 HydrophobicContact CB-CD1 3.71Å; P257-L293 HydrophobicContact CG-CD1 3.75Å; P257-L293 HydrophobicContact CG-CD2 4.44Å
258	F	97.7	Very high	96.6	Very high	8 Å²	8	48.9 Å²	48.9	4%	0.035	25%	0.253	C	S	.	.	S	Bend	trans	-138.8	96.8	-178.7	-53.4	-69.7	0	0	0	109.7	W242 P256 T266 K269 I270 C273 V275 L293	W242-F258 AromaticContact CH2-CE2 3.85Å; W242-F258 HydrophobicContact CH2-CE2 3.85Å; W242-F258 HydrophobicContact CZ2-CD2 4.14Å; W242-F258 AromaticContact CZ2-CE2 3.72Å; W242-F258 HydrophobicContact CZ2-CE2 3.72Å; P256-F258 PolarHBondContact O-N 3.26Å; F258-T266 VanDerWaalsContact O-CG2 3.3Å; F258-T266 WeakPolarHBondContact O-CG2 3.46Å; F258-K269 HydrophobicContact CB-CB 4.09Å; F258-K269 HydrophobicContact CD1-CB 4.17Å; F258-I270 HydrophobicContact CB-CD1 4.47Å; F258-I270 HydrophobicContact CB-CG1 3.48Å; F258-I270 VanDerWaalsContact CB-CG1 3.48Å; F258-I270 HydrophobicContact CD2-CB 4.38Å; F258-I270 HydrophobicContact CD2-CG1 3.79Å; F258-I270 HydrophobicContact CG-CB 4.49Å; F258-I270 HydrophobicContact CG-CG1 3.84Å; F258-C273 HydrophobicContact CD1-CB 4.36Å; F258-C273 HydrophobicContact CE1-CB 4.13Å; F258-V275 HydrophobicContact CZ-CB 4.2Å; F258-L293 HydrophobicContact CE2-CD1 4.45Å
259	T	95.2	Very high	96.6	Very high	57 Å²	57	53 Å²	53	35%	0.35	27%	0.271	S	S	.	.			trans	-123.1	150.2	175.6	53	0	0	0	0	111.1	E223 P256 K269	E223-T259 HydrophobicContact CG-CG2 4.42Å; P256-T259 HydrophobicContact CB-CG2 4.02Å; P256-T259 HydrophobicContact CG-CG2 4.22Å; T259-K269 VanDerWaalsContact O-CD 3.32Å; T259-K269 WeakPolarHBondContact O-CD 3.48Å; T259-K269 WeakPolarHBondContact O-CE 3.37Å; T259-K269 PolarHBondContact O-NZ 3.1Å
260	A	95.7	Very high	96.6	Very high	35 Å²	35	52.5 Å²	52.5	29%	0.289	27%	0.268	S	S	.	.			trans	-157.1	170.4	176.3	0	0	0	0	0	112.5	N262 K265 T266 K269	A260-N262 PolarHBondContact O-N 3.5Å; A260-K265 HydrophobicContact CB-CB 3.45Å; A260-K265 VanDerWaalsContact CB-CB 3.45Å; A260-T266 PolarHBondContact N-OG1 2.77Å; A260-K269 HydrophobicContact CB-CD 4.35Å
261	E	93.8	Very high	96.6	Very high	160 Å²	160	54.7 Å²	54.7	75%	0.748	28%	0.28	S	S	*	.	S	Bend	trans	-54.4	-23.3	179.5	-57.5	149	-120	0	0	115	K265	E261-K265 HydrophobicContact CB-CD 4.4Å; E261-K265 IonicContact OE1-NZ 2.87Å; E261-K265 PolarHBondContact OE1-NZ 3.36Å; E261-K265 IonicContact OE2-NZ 3.07Å; E261-K265 PolarHBondContact OE2-NZ 3.26Å
262	N	95.5	Very high	96.5	Very high	72 Å²	72	61.7 Å²	61.7	39%	0.385	31%	0.31	S	S	.	.	S	Bend	trans	-155.5	157	178.8	66	69.5	0	0	0	112.1	A260 K264 K265 T266	A260-N262 PolarHBondContact O-N 3.5Å; N262-K264 VanDerWaalsContact C-N 3.26Å; N262-K264 PolarHBondContact O-N 3.38Å; N262-K264 VanDerWaalsContact O-N 3.12Å; N262-K264 PolarHBondContact OD1-N 3.34Å; N262-K265 PolarHBondContact O-N 3.26Å; N262-K265 PolarHBondContact OD1-N 3.25Å; N262-T266 PolarHBondContact O-N 2.96Å; N262-T266 PolarHBondContact O-OG1 3.35Å
263	R	94.8	Very high	96.5	Very high	185 Å²	185	64.2 Å²	64.2	70%	0.698	33%	0.328	S	S	*	.	H	α-helix	trans	-49.9	-39.1	-177.3	-65.6	-178.6	169.9	-169.5	-3.5	114.1	I222 T266 I267	I222-R263 HydrophobicContact CD1-CB 3.95Å; I222-R263 HydrophobicContact CD1-CG 3.72Å; R263-T266 PolarHBondContact O-N 3.12Å; R263-I267 VanDerWaalsContact O-CG1 3.24Å; R263-I267 WeakPolarHBondContact O-CG1 3.47Å; R263-I267 PolarHBondContact O-N 2.93Å
264	K	96.1	Very high	96.4	Very high	154 Å²	154	72.7 Å²	72.7	67%	0.67	36%	0.362	S	S	*	.	H	α-helix	trans	-67	-47.9	178.3	-176.8	176.2	177.3	178.9	0	111.2	N262 T266 I267 D268	N262-K264 VanDerWaalsContact C-N 3.26Å; N262-K264 PolarHBondContact O-N 3.38Å; N262-K264 VanDerWaalsContact O-N 3.12Å; N262-K264 PolarHBondContact OD1-N 3.34Å; K264-T266 VanDerWaalsContact C-N 3.27Å; K264-T266 PolarHBondContact O-N 3.03Å; K264-I267 PolarHBondContact O-N 2.82Å; K264-D268 WeakPolarHBondContact O-CB 3.3Å; K264-D268 PolarHBondContact O-N 3.23Å
265	K	97.3	Very high	96.4	Very high	90 Å²	90	72.2 Å²	72.2	39%	0.391	35%	0.351	S	S	.	.	H	α-helix	trans	-60.2	-36.3	173.8	-72.7	-178.4	170.1	-178.9	0	111.9	A260 E261 N262 K269	A260-K265 HydrophobicContact CB-CB 3.45Å; A260-K265 VanDerWaalsContact CB-CB 3.45Å; E261-K265 HydrophobicContact CB-CD 4.4Å; E261-K265 IonicContact OE1-NZ 2.87Å; E261-K265 PolarHBondContact OE1-NZ 3.36Å; E261-K265 IonicContact OE2-NZ 3.07Å; E261-K265 PolarHBondContact OE2-NZ 3.26Å; N262-K265 PolarHBondContact O-N 3.26Å; N262-K265 PolarHBondContact OD1-N 3.25Å; K265-K269 WeakPolarHBondContact O-CG 3.5Å; K265-K269 PolarHBondContact O-N 3.11Å
266	T	97.6	Very high	96.4	Very high	0 Å²	0	76.4 Å²	76.4	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-63.4	-51	175.5	-56.2	0	0	0	0	111.1	I222 E223 F258 A260 N262 R263 K264 D268 K269 I270	I222-T266 HydrophobicContact CG2-CG2 3.93Å; E223-T266 HydrophobicContact CG-CG2 4.29Å; F258-T266 VanDerWaalsContact O-CG2 3.3Å; F258-T266 WeakPolarHBondContact O-CG2 3.46Å; A260-T266 PolarHBondContact N-OG1 2.77Å; N262-T266 PolarHBondContact O-N 2.96Å; N262-T266 PolarHBondContact O-OG1 3.35Å; R263-T266 PolarHBondContact O-N 3.12Å; K264-T266 VanDerWaalsContact C-N 3.27Å; K264-T266 PolarHBondContact O-N 3.03Å; T266-D268 PolarHBondContact O-N 2.96Å; T266-K269 WeakPolarHBondContact O-CB 3.24Å; T266-K269 PolarHBondContact O-N 3.14Å; T266-K269 VanDerWaalsContact O-N 3.12Å; T266-I270 HydrophobicContact CG2-CD1 4.09Å; T266-I270 WeakPolarHBondContact O-CG1 3.31Å; T266-I270 PolarHBondContact O-N 3.06Å
267	I	97.6	Very high	96.3	Very high	42 Å²	42	76.3 Å²	76.3	22%	0.215	37%	0.368	C	S	.	.	H	α-helix	trans	-59.6	-45.1	176.5	-67.9	167.9	0	0	0	111	I222 L230 R263 K264 K269 I270 L271	I222-I267 HydrophobicContact CG2-CD1 4.4Å; I222-I267 HydrophobicContact CG2-CG1 3.8Å; L230-I267 HydrophobicContact CB-CG2 4.4Å; L230-I267 HydrophobicContact CD1-CG1 4.22Å; L230-I267 HydrophobicContact CD1-CG2 4.28Å; L230-I267 HydrophobicContact CD2-CD1 4.22Å; L230-I267 HydrophobicContact CD2-CG1 3.94Å; R263-I267 VanDerWaalsContact O-CG1 3.24Å; R263-I267 WeakPolarHBondContact O-CG1 3.47Å; R263-I267 PolarHBondContact O-N 2.93Å; K264-I267 PolarHBondContact O-N 2.82Å; I267-K269 VanDerWaalsContact C-N 3.29Å; I267-K269 PolarHBondContact O-N 3.18Å; I267-I270 PolarHBondContact O-N 3.22Å; I267-L271 HydrophobicContact CG2-CD1 3.84Å; I267-L271 HydrophobicContact CG2-CG 4.25Å; I267-L271 WeakPolarHBondContact O-CB 3.42Å; I267-L271 WeakPolarHBondContact O-CG 3.26Å; I267-L271 PolarHBondContact O-N 2.92Å
268	D	97.7	Very high	96.2	Very high	53 Å²	53	77 Å²	77	28%	0.283	37%	0.373	S	S	.	.	H	α-helix	trans	-57.2	-40.7	175	-88.3	-51.9	0	0	0	112	K264 T266 K272	K264-D268 WeakPolarHBondContact O-CB 3.3Å; K264-D268 PolarHBondContact O-N 3.23Å; T266-D268 PolarHBondContact O-N 2.96Å; D268-K272 VanDerWaalsContact O-CB 3.24Å; D268-K272 WeakPolarHBondContact O-CB 3.42Å; D268-K272 WeakPolarHBondContact O-CG 3.34Å; D268-K272 PolarHBondContact O-N 3.02Å; D268-K272 WeakPolarHBondContact OD1-CE 3.41Å; D268-K272 IonicContact OD1-NZ 2.65Å; D268-K272 PolarHBondContact OD1-NZ 2.88Å
269	K	98.1	Very high	96.1	Very high	86 Å²	86	82.7 Å²	82.7	37%	0.374	41%	0.411	S	S	.	.	H	α-helix	trans	-64	-50.6	173.7	-77	-173.1	177.3	-173	0	112.1	F258 T259 A260 K265 T266 I267 L271 K272 C273	F258-K269 HydrophobicContact CB-CB 4.09Å; F258-K269 HydrophobicContact CD1-CB 4.17Å; T259-K269 VanDerWaalsContact O-CD 3.32Å; T259-K269 WeakPolarHBondContact O-CD 3.48Å; T259-K269 WeakPolarHBondContact O-CE 3.37Å; T259-K269 PolarHBondContact O-NZ 3.1Å; A260-K269 HydrophobicContact CB-CD 4.35Å; K265-K269 WeakPolarHBondContact O-CG 3.5Å; K265-K269 PolarHBondContact O-N 3.11Å; T266-K269 WeakPolarHBondContact O-CB 3.24Å; T266-K269 PolarHBondContact O-N 3.14Å; T266-K269 VanDerWaalsContact O-N 3.12Å; I267-K269 VanDerWaalsContact C-N 3.29Å; I267-K269 PolarHBondContact O-N 3.18Å; K269-L271 VanDerWaalsContact C-N 3.3Å; K269-L271 PolarHBondContact O-N 2.67Å; K269-K272 PolarHBondContact O-N 3.12Å; K269-C273 WeakPolarHBondContact O-CB 3.23Å; K269-C273 PolarHBondContact O-N 3.44Å
270	I	98.1	Very high	96.2	Very high	0 Å²	0	86.3 Å²	86.3	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-54.6	-48.2	179	-67.2	166.3	0	0	0	110.3	I222 P227 L230 W242 F258 T266 I267 K295	I222-I270 HydrophobicContact CG2-CD1 4.37Å; I222-I270 WeakPolarHBondContact O-CD1 3.43Å; P227-I270 HydrophobicContact CG-CG2 4Å; L230-I270 HydrophobicContact CD1-CB 3.9Å; L230-I270 HydrophobicContact CD1-CD1 3.72Å; L230-I270 HydrophobicContact CD1-CG1 4.41Å; L230-I270 HydrophobicContact CD1-CG2 3.56Å; W242-I270 HydrophobicContact CH2-CG2 4.37Å; W242-I270 HydrophobicContact CZ2-CG2 3.83Å; F258-I270 HydrophobicContact CB-CD1 4.47Å; F258-I270 HydrophobicContact CB-CG1 3.48Å; F258-I270 VanDerWaalsContact CB-CG1 3.48Å; F258-I270 HydrophobicContact CD2-CB 4.38Å; F258-I270 HydrophobicContact CD2-CG1 3.79Å; F258-I270 HydrophobicContact CG-CB 4.49Å; F258-I270 HydrophobicContact CG-CG1 3.84Å; T266-I270 HydrophobicContact CG2-CD1 4.09Å; T266-I270 WeakPolarHBondContact O-CG1 3.31Å; T266-I270 PolarHBondContact O-N 3.06Å; I267-I270 PolarHBondContact O-N 3.22Å; I270-K295 WeakPolarHBondContact O-CE 3.45Å; I270-K295 PolarHBondContact O-NZ 3.3Å
271	L	97.7	Very high	96.3	Very high	55 Å²	55	84.9 Å²	84.9	29%	0.288	41%	0.406	S	S	.	.	H	α-helix	trans	-70.6	-36.7	-178.8	-62.7	-179.1	0	0	0	113.2	P227 L230 T231 I267 K269 K295	P227-L271 HydrophobicContact CB-CD2 3.86Å; L230-L271 HydrophobicContact CB-CD2 4.33Å; T231-L271 HydrophobicContact CG2-CD1 4.33Å; T231-L271 HydrophobicContact CG2-CD2 3.87Å; I267-L271 HydrophobicContact CG2-CD1 3.84Å; I267-L271 HydrophobicContact CG2-CG 4.25Å; I267-L271 WeakPolarHBondContact O-CB 3.42Å; I267-L271 WeakPolarHBondContact O-CG 3.26Å; I267-L271 PolarHBondContact O-N 2.92Å; K269-L271 VanDerWaalsContact C-N 3.3Å; K269-L271 PolarHBondContact O-N 2.67Å; L271-K295 PolarHBondContact O-NZ 3.34Å
272	K	96.6	Very high	96.4	Very high	150 Å²	150	80.2 Å²	80.2	65%	0.652	39%	0.389	S	S	*	.	H	α-helix	trans	-111.3	-39.2	-167.6	-61.6	163.1	-179.6	168	0	115.7	D268 K269 K295	D268-K272 VanDerWaalsContact O-CB 3.24Å; D268-K272 WeakPolarHBondContact O-CB 3.42Å; D268-K272 WeakPolarHBondContact O-CG 3.34Å; D268-K272 PolarHBondContact O-N 3.02Å; D268-K272 WeakPolarHBondContact OD1-CE 3.41Å; D268-K272 IonicContact OD1-NZ 2.65Å; D268-K272 PolarHBondContact OD1-NZ 2.88Å; K269-K272 PolarHBondContact O-N 3.12Å; K272-K295 VanDerWaalsContact C-NZ 3.28Å
273	C	96.6	Very high	96.6	Very high	57 Å²	57	82.3 Å²	82.3	39%	0.385	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-73.7	162.8	-174.3	-65.4	0	0	0	0	113.6	F258 K269 K295	F258-C273 HydrophobicContact CD1-CB 4.36Å; F258-C273 HydrophobicContact CE1-CB 4.13Å; K269-C273 WeakPolarHBondContact O-CB 3.23Å; K269-C273 PolarHBondContact O-N 3.44Å; C273-K295 VanDerWaalsContact O-CE 3.27Å; C273-K295 WeakPolarHBondContact O-CE 3.4Å; C273-K295 PolarHBondContact O-NZ 3.35Å
274	K	95.1	Very high	96.7	Very high	199 Å²	199	75.4 Å²	75.4	87%	0.865	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-92.7	149.3	163.2	-63	178.8	-177.7	176.7	0	108.2	N276	K274-N276 PolarHBondContact O-N 2.95Å
275	V	95.6	Very high	96.9	Very high	32 Å²	32	68 Å²	68	19%	0.194	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-62.6	134.8	171.6	65.6	0	0	0	0	109.6	P257 F258 L277 I289 L293	P257-V275 HydrophobicContact CB-CG2 3.8Å; F258-V275 HydrophobicContact CZ-CB 4.2Å; V275-L277 HydrophobicContact CG1-CD1 4.18Å; V275-L277 HydrophobicContact CG1-CG 4.42Å; V275-L277 HydrophobicContact CG2-CD2 4.3Å; V275-L277 HydrophobicContact CG2-CG 4.16Å; V275-I289 HydrophobicContact CG2-CG2 4.34Å; V275-L293 HydrophobicContact CB-CD1 4.14Å; V275-L293 HydrophobicContact CG2-CD1 3.92Å
276	N	93.4	Very high	96.9	Very high	135 Å²	135	66.3 Å²	66.3	72%	0.722	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-99.9	130.7	173.3	-177.5	35.8	0	0	0	108.4	H249 K274	H249-N276 PolarHBondContact NE2-O 2.77Å; K274-N276 PolarHBondContact O-N 2.95Å
277	L	96	Very high	97	Very high	15 Å²	15	69.3 Å²	69.3	8%	0.079	36%	0.356	C	S	.	.			trans	-127.2	114.9	-173.3	-75.1	168.9	0	0	0	110.1	V275 R286 I289 K290	V275-L277 HydrophobicContact CG1-CD1 4.18Å; V275-L277 HydrophobicContact CG1-CG 4.42Å; V275-L277 HydrophobicContact CG2-CD2 4.3Å; V275-L277 HydrophobicContact CG2-CG 4.16Å; L277-R286 HydrophobicContact CD1-CB 4.37Å; L277-R286 HydrophobicContact CD1-CG 3.8Å; L277-R286 PolarHBondContact O-NH1 3.02Å; L277-I289 HydrophobicContact CD1-CB 4.27Å; L277-I289 HydrophobicContact CD1-CG2 4.22Å; L277-I289 HydrophobicContact CD2-CD1 3.74Å; L277-I289 HydrophobicContact CD2-CG2 4.19Å; L277-K290 HydrophobicContact CD1-CG 4.32Å
278	P	95.3	Very high	97	Very high	31 Å²	31	67.3 Å²	67.3	20%	0.201	35%	0.345	C	S	.	.			trans	-51.4	152.9	-179	-29.2	36.4	0	0	0	113.5	T253 Y280 I281 R286	T253-P278 HydrophobicContact CG2-CG 4.12Å; P278-Y280 HydrophobicContact CB-CD1 3.69Å; P278-Y280 HydrophobicContact CB-CD2 4.33Å; P278-Y280 HydrophobicContact CB-CE1 3.32Å; P278-Y280 HydrophobicContact CB-CE2 3.99Å; P278-Y280 HydrophobicContact CB-CG 4.19Å; P278-Y280 VanDerWaalsContact CB-CZ 3.49Å; P278-Y280 HydrophobicContact CG-CE1 3.99Å; P278-Y280 HydrophobicContact CG-CE2 4.37Å; P278-Y280 PolarHBondContact O-N 3.31Å; P278-Y280 VanDerWaalsContact O-N 3.16Å; P278-I281 PolarHBondContact O-N 3.43Å; P278-R286 PolarHBondContact O-NH2 2.89Å
279	P	95.2	Very high	97.1	Very high	128 Å²	128	64.8 Å²	64.8	83%	0.831	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-18.4	-174.3	27.2	-35.4	0	0	0	114.1
280	Y	96.1	Very high	97.1	Very high	133 Å²	133	65.6 Å²	65.6	52%	0.522	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-19.8	178.9	56.7	-110.3	0	0	0	114.4	P278	P278-Y280 HydrophobicContact CB-CD1 3.69Å; P278-Y280 HydrophobicContact CB-CD2 4.33Å; P278-Y280 HydrophobicContact CB-CE1 3.32Å; P278-Y280 HydrophobicContact CB-CE2 3.99Å; P278-Y280 HydrophobicContact CB-CG 4.19Å; P278-Y280 VanDerWaalsContact CB-CZ 3.49Å; P278-Y280 HydrophobicContact CG-CE1 3.99Å; P278-Y280 HydrophobicContact CG-CE2 4.37Å; P278-Y280 PolarHBondContact O-N 3.31Å; P278-Y280 VanDerWaalsContact O-N 3.16Å
281	I	97.4	Very high	97.1	Very high	6 Å²	6	68.7 Å²	68.7	3%	0.031	35%	0.349	C	S	.	.	S	Bend	trans	-67.6	130.6	177	-54.7	-65.7	0	0	0	109.8	E157 L252 T253 P278 A285 R286	E157-I281 WeakPolarHBondContact OE1-CA 3.42Å; L252-I281 HydrophobicContact CB-CD1 3.75Å; L252-I281 HydrophobicContact CD1-CD1 4.49Å; T253-I281 HydrophobicContact CG2-CD1 4.22Å; P278-I281 PolarHBondContact O-N 3.43Å; I281-A285 HydrophobicContact CG2-CB 3.74Å; I281-R286 HydrophobicContact CG2-CB 4.08Å; I281-R286 PolarHBondContact O-NH2 2.63Å
282	T	97.9	Very high	97.2	Very high	61 Å²	61	66.1 Å²	66.1	37%	0.374	34%	0.335	S	S	.	.			trans	-63.3	168.6	-178.1	68.7	0	0	0	0	112.7	E157 D284 A285 R286	E157-T282 PolarHBondContact OE1-N 3.22Å; E157-T282 PolarHBondContact OE1-OG1 3.36Å; E157-T282 VanDerWaalsContact OE2-CB 3.31Å; E157-T282 WeakPolarHBondContact OE2-CB 3.28Å; E157-T282 WeakPolarHBondContact OE2-CG2 3.13Å; E157-T282 PolarHBondContact OE2-OG1 3.04Å; T282-D284 VanDerWaalsContact C-N 3.34Å; T282-A285 WeakPolarHBondContact OG1-CB 3.38Å; T282-A285 PolarHBondContact OG1-N 3.01Å; T282-R286 WeakPolarHBondContact O-CB 3.41Å; T282-R286 PolarHBondContact O-N 3.38Å
283	V	98.2	Very high	97.3	Very high	116 Å²	116	59.7 Å²	59.7	70%	0.703	31%	0.308	S	S	*	.	H	α-helix	trans	-62.6	-42.4	177.1	-178.7	0	0	0	0	111.1	R286 D287	V283-R286 PolarHBondContact O-N 2.95Å; V283-D287 WeakPolarHBondContact O-CB 3.28Å; V283-D287 PolarHBondContact O-N 2.86Å
284	D	98.4	Very high	97.3	Very high	40 Å²	40	61 Å²	61	21%	0.214	31%	0.307	C	S	.	.	H	α-helix	trans	-70	-47.1	-176.3	-57.3	-65.7	0	0	0	112.2	T282 R286 D287 M288 P315 F316 R318	T282-D284 VanDerWaalsContact C-N 3.34Å; D284-R286 VanDerWaalsContact C-N 3.34Å; D284-R286 PolarHBondContact O-N 2.87Å; D284-D287 PolarHBondContact O-N 3.23Å; D284-M288 PolarHBondContact O-N 3.01Å; D284-P315 WeakPolarHBondContact OD1-CB 3.09Å; D284-F316 HydrophobicContact CB-CB 4.43Å; D284-R318 VanDerWaalsContact CG-NH1 3.28Å; D284-R318 IonicContact OD1-NH1 3.06Å; D284-R318 IonicContact OD2-CZ 3.3Å; D284-R318 IonicContact OD2-NH1 2.67Å; D284-R318 PolarHBondContact OD2-NH1 3.38Å; D284-R318 IonicContact OD2-NH2 3.67Å
285	A	98.4	Very high	97.5	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62.5	-42.5	175	0	0	0	0	0	111.4	E157 M248 L252 I281 T282 D287 M288 I289 F316	E157-A285 WeakPolarHBondContact OE2-CB 3.37Å; M248-A285 HydrophobicContact CE-CB 3.82Å; L252-A285 HydrophobicContact CD1-CB 4.13Å; I281-A285 HydrophobicContact CG2-CB 3.74Å; T282-A285 WeakPolarHBondContact OG1-CB 3.38Å; T282-A285 PolarHBondContact OG1-N 3.01Å; A285-D287 VanDerWaalsContact C-N 3.32Å; A285-D287 PolarHBondContact O-N 3.41Å; A285-M288 PolarHBondContact O-N 2.74Å; A285-I289 WeakPolarHBondContact O-CG1 3.33Å; A285-I289 PolarHBondContact O-N 2.66Å; A285-F316 HydrophobicContact CB-CD2 3.86Å; A285-F316 HydrophobicContact CB-CE2 3.86Å
286	R	98.6	Very high	97.5	Very high	53 Å²	53	56.9 Å²	56.9	20%	0.2	29%	0.291	C	S	.	.	H	α-helix	trans	-63.3	-35.4	177.2	-178.9	-174.9	-55.3	-83.1	-4.7	112.9	L277 P278 I281 T282 V283 D284 K290	L277-R286 HydrophobicContact CD1-CB 4.37Å; L277-R286 HydrophobicContact CD1-CG 3.8Å; L277-R286 PolarHBondContact O-NH1 3.02Å; P278-R286 PolarHBondContact O-NH2 2.89Å; I281-R286 HydrophobicContact CG2-CB 4.08Å; I281-R286 PolarHBondContact O-NH2 2.63Å; T282-R286 WeakPolarHBondContact O-CB 3.41Å; T282-R286 PolarHBondContact O-N 3.38Å; V283-R286 PolarHBondContact O-N 2.95Å; D284-R286 VanDerWaalsContact C-N 3.34Å; D284-R286 PolarHBondContact O-N 2.87Å; R286-K290 HydrophobicContact CG-CD 4.45Å; R286-K290 WeakPolarHBondContact O-CB 3.49Å; R286-K290 VanDerWaalsContact O-CD 3.3Å; R286-K290 WeakPolarHBondContact O-CD 3.18Å; R286-K290 WeakPolarHBondContact O-CG 3.3Å; R286-K290 PolarHBondContact O-N 3.38Å
287	D	98.6	Very high	97.6	Very high	63 Å²	63	52.3 Å²	52.3	34%	0.337	27%	0.268	S	S	.	.	H	α-helix	trans	-74.5	-42.1	176	-169.9	38.4	0	0	0	111.3	V283 D284 A285 I289 K290 K291 H314	V283-D287 WeakPolarHBondContact O-CB 3.28Å; V283-D287 PolarHBondContact O-N 2.86Å; D284-D287 PolarHBondContact O-N 3.23Å; A285-D287 VanDerWaalsContact C-N 3.32Å; A285-D287 PolarHBondContact O-N 3.41Å; D287-I289 PolarHBondContact O-N 3.11Å; D287-K290 PolarHBondContact O-N 2.81Å; D287-K291 WeakPolarHBondContact O-CB 3.39Å; D287-K291 WeakPolarHBondContact O-CG 3.4Å; D287-K291 PolarHBondContact O-N 3.26Å; D287-K291 WeakPolarHBondContact OD2-CE 3.49Å; D287-K291 IonicContact OD2-NZ 3.81Å; D287-K291 PolarHBondContact OD2-NZ 3.36Å; D287-H314 IonicContact OD2-NE2 3.8Å
288	M	98.6	Very high	97.5	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-58.3	-50	175.5	-170	168	151	0	0	112.1	M248 D284 A285 K290 K291 L292 I311 F316 F317	M248-M288 HydrophobicContact CE-CB 3.98Å; M248-M288 HydrophobicContact CE-CE 4.44Å; M248-M288 HydrophobicContact CE-CG 4.2Å; M248-M288 HydrophobicContact CE-SD 3.93Å; M248-M288 HydrophobicContact SD-CB 4.04Å; M248-M288 HydrophobicContact SD-CE 3.66Å; M248-M288 HydrophobicContact SD-CG 3.77Å; M248-M288 HydrophobicContact SD-SD 3.79Å; D284-M288 PolarHBondContact O-N 3.01Å; A285-M288 PolarHBondContact O-N 2.74Å; M288-K290 VanDerWaalsContact C-N 3.3Å; M288-K290 PolarHBondContact O-N 2.99Å; M288-K291 WeakPolarHBondContact O-CB 3.25Å; M288-K291 PolarHBondContact O-N 3.49Å; M288-L292 HydrophobicContact CE-CD1 3.68Å; M288-L292 HydrophobicContact CG-CD1 3.86Å; M288-L292 HydrophobicContact CG-CG 4.42Å; M288-L292 WeakPolarHBondContact O-CG 3.05Å; M288-L292 PolarHBondContact O-N 2.99Å; M288-I311 HydrophobicContact CE-CG2 4.28Å; M288-F316 HydrophobicContact CE-CD1 4.2Å; M288-F316 HydrophobicContact SD-CB 3.74Å; M288-F316 HydrophobicContact SD-CD1 3.39Å; M288-F316 WeakPolarHBondContact SD-CD1 3.48Å; M288-F316 HydrophobicContact SD-CE1 4.21Å; M288-F316 HydrophobicContact SD-CG 3.77Å; M288-F317 HydrophobicContact CE-CE2 3.4Å; M288-F317 VanDerWaalsContact CE-CE2 3.4Å; M288-F317 HydrophobicContact CE-CZ 3.61Å; M288-F317 HydrophobicContact SD-CD2 4.31Å; M288-F317 HydrophobicContact SD-CE2 3.7Å; M288-F317 HydrophobicContact SD-CZ 4.25Å
289	I	98.7	Very high	97.6	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-59.3	-41.6	177	-63.7	166.9	0	0	0	110.9	M248 H249 L252 V275 L277 A285 D287 K291 L292 L293	M248-I289 HydrophobicContact CB-CG1 4.33Å; M248-I289 HydrophobicContact CE-CG1 4.13Å; M248-I289 HydrophobicContact CG-CD1 4.08Å; M248-I289 HydrophobicContact CG-CG1 3.7Å; M248-I289 HydrophobicContact SD-CD1 4.43Å; M248-I289 HydrophobicContact SD-CG1 3.6Å; H249-I289 HydrophobicContact CB-CD1 4.47Å; H249-I289 HydrophobicContact CB-CG2 4.42Å; L252-I289 HydrophobicContact CD1-CD1 4.38Å; V275-I289 HydrophobicContact CG2-CG2 4.34Å; L277-I289 HydrophobicContact CD1-CB 4.27Å; L277-I289 HydrophobicContact CD1-CG2 4.22Å; L277-I289 HydrophobicContact CD2-CD1 3.74Å; L277-I289 HydrophobicContact CD2-CG2 4.19Å; A285-I289 WeakPolarHBondContact O-CG1 3.33Å; A285-I289 PolarHBondContact O-N 2.66Å; D287-I289 PolarHBondContact O-N 3.11Å; I289-K291 VanDerWaalsContact C-N 3.28Å; I289-K291 PolarHBondContact O-N 3.07Å; I289-L292 PolarHBondContact O-N 3.12Å; I289-L293 HydrophobicContact CG2-CD1 3.58Å; I289-L293 HydrophobicContact CG2-CG 4.14Å; I289-L293 VanDerWaalsContact O-CB 3.28Å; I289-L293 WeakPolarHBondContact O-CB 3.31Å; I289-L293 WeakPolarHBondContact O-CG 3.39Å; I289-L293 PolarHBondContact O-N 2.94Å
290	K	98.5	Very high	97.7	Very high	104 Å²	104	54.9 Å²	54.9	45%	0.452	28%	0.281	S	S	.	.	H	α-helix	trans	-67.7	-24.3	176.9	-75.3	170.4	-175.9	174	0	114	L277 R286 D287 M288 K294	L277-K290 HydrophobicContact CD1-CG 4.32Å; R286-K290 HydrophobicContact CG-CD 4.45Å; R286-K290 WeakPolarHBondContact O-CB 3.49Å; R286-K290 VanDerWaalsContact O-CD 3.3Å; R286-K290 WeakPolarHBondContact O-CD 3.18Å; R286-K290 WeakPolarHBondContact O-CG 3.3Å; R286-K290 PolarHBondContact O-N 3.38Å; D287-K290 PolarHBondContact O-N 2.81Å; M288-K290 VanDerWaalsContact C-N 3.3Å; M288-K290 PolarHBondContact O-N 2.99Å; K290-K294 VanDerWaalsContact O-CE 3.3Å; K290-K294 WeakPolarHBondContact O-CE 3.49Å; K290-K294 WeakPolarHBondContact O-CG 3.21Å
291	K	98.6	Very high	97.8	Very high	65 Å²	65	50.2 Å²	50.2	28%	0.283	27%	0.265	S	S	.	.	H	α-helix	trans	-85.8	-33.5	178.3	-81.7	168.6	167.9	169.6	0	112.5	D287 M288 I289 K294 L301 H314	D287-K291 WeakPolarHBondContact O-CB 3.39Å; D287-K291 WeakPolarHBondContact O-CG 3.4Å; D287-K291 PolarHBondContact O-N 3.26Å; D287-K291 WeakPolarHBondContact OD2-CE 3.49Å; D287-K291 IonicContact OD2-NZ 3.81Å; D287-K291 PolarHBondContact OD2-NZ 3.36Å; M288-K291 WeakPolarHBondContact O-CB 3.25Å; M288-K291 PolarHBondContact O-N 3.49Å; I289-K291 VanDerWaalsContact C-N 3.28Å; I289-K291 PolarHBondContact O-N 3.07Å; K291-K294 WeakPolarHBondContact O-CG 3.41Å; K291-L301 HydrophobicContact CB-CB 3.98Å; K291-L301 HydrophobicContact CB-CD2 4.26Å; K291-L301 HydrophobicContact CD-CD2 4.46Å; K291-L301 PolarHBondContact O-N 3.3Å; K291-H314 VanDerWaalsContact CD-NE2 3.33Å; K291-H314 WeakPolarHBondContact CD-NE2 3.46Å; K291-H314 PolarHBondContact NZ-NE2 2.71Å
292	L	98.7	Very high	97.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-80.2	-39.7	174	-66.3	171.7	0	0	0	112.3	W241 L244 M288 I289 K294 R300 L301 I311	W241-L292 HydrophobicContact CB-CD2 4.11Å; W241-L292 WeakPolarHBondContact O-CB 3.34Å; W241-L292 WeakPolarHBondContact O-CD2 3.47Å; L244-L292 HydrophobicContact CD2-CD1 4.26Å; L244-L292 HydrophobicContact CG-CD1 4.38Å; M288-L292 HydrophobicContact CE-CD1 3.68Å; M288-L292 HydrophobicContact CG-CD1 3.86Å; M288-L292 HydrophobicContact CG-CG 4.42Å; M288-L292 WeakPolarHBondContact O-CG 3.05Å; M288-L292 PolarHBondContact O-N 2.99Å; I289-L292 PolarHBondContact O-N 3.12Å; L292-K294 PolarHBondContact O-N 3.31Å; L292-R300 VanDerWaalsContact O-CD 3.25Å; L292-R300 WeakPolarHBondContact O-CD 3.27Å; L292-R300 WeakPolarHBondContact O-CG 3.48Å; L292-L301 HydrophobicContact CD2-CB 4.21Å; L292-I311 HydrophobicContact CD2-CD1 3.8Å
293	L	98.6	Very high	97.6	Very high	15 Å²	15	48.9 Å²	48.9	8%	0.079	26%	0.259	C	S	.	.	S	Bend	trans	-83.3	37.3	176.3	-59.4	-178.8	0	0	0	113.2	W242 A246 P257 F258 V275 I289	W242-L293 HydrophobicContact CD2-CD2 3.77Å; W242-L293 HydrophobicContact CE3-CB 4.41Å; W242-L293 HydrophobicContact CE3-CD2 4.05Å; W242-L293 HydrophobicContact CG-CD2 4.26Å; W242-L293 HydrophobicContact CH2-CB 4.34Å; W242-L293 HydrophobicContact CH2-CD2 4.23Å; W242-L293 HydrophobicContact CZ2-CD2 3.96Å; W242-L293 HydrophobicContact CZ3-CB 4.1Å; W242-L293 HydrophobicContact CZ3-CD2 4.28Å; W242-L293 WeakPolarHBondContact CZ3-O 3.43Å; A246-L293 HydrophobicContact CB-CD2 4.34Å; P257-L293 HydrophobicContact CB-CD1 3.71Å; P257-L293 HydrophobicContact CG-CD1 3.75Å; P257-L293 HydrophobicContact CG-CD2 4.44Å; F258-L293 HydrophobicContact CE2-CD1 4.45Å; V275-L293 HydrophobicContact CB-CD1 4.14Å; V275-L293 HydrophobicContact CG2-CD1 3.92Å; I289-L293 HydrophobicContact CG2-CD1 3.58Å; I289-L293 HydrophobicContact CG2-CG 4.14Å; I289-L293 VanDerWaalsContact O-CB 3.28Å; I289-L293 WeakPolarHBondContact O-CB 3.31Å; I289-L293 WeakPolarHBondContact O-CG 3.39Å; I289-L293 PolarHBondContact O-N 2.94Å
294	K	98.3	Very high	97.2	Very high	84 Å²	84	44.8 Å²	44.8	37%	0.365	24%	0.24	S	C	.	.			trans	-81	121.2	170.8	-70.1	-82.7	-174.7	165.4	0	109.3	K290 K291 L292 Q299 R300	K290-K294 VanDerWaalsContact O-CE 3.3Å; K290-K294 WeakPolarHBondContact O-CE 3.49Å; K290-K294 WeakPolarHBondContact O-CG 3.21Å; K291-K294 WeakPolarHBondContact O-CG 3.41Å; L292-K294 PolarHBondContact O-N 3.31Å; K294-Q299 VanDerWaalsContact CG-O 3.3Å; K294-Q299 WeakPolarHBondContact CG-O 3.32Å; K294-R300 HydrophobicContact CB-CB 3.88Å; K294-R300 HydrophobicContact CB-CG 4.23Å; K294-R300 PolarHBondContact O-NE 3.04Å; K294-R300 PolarHBondContact O-NH2 3.16Å
295	K	97.5	Very high	96.9	Very high	68 Å²	68	52.4 Å²	52.4	30%	0.296	27%	0.271	S	S	.	.	S	Bend	trans	-70.9	-32.2	-174.6	-60.1	-172.9	-175.9	-166.5	0	113.9	P227 W242 I270 L271 K272 C273 P297	P227-K295 HydrophobicContact CG-CB 4.1Å; P227-K295 HydrophobicContact CG-CG 4.07Å; W242-K295 HydrophobicContact CH2-CG 4.21Å; W242-K295 HydrophobicContact CZ3-CG 4.02Å; I270-K295 WeakPolarHBondContact O-CE 3.45Å; I270-K295 PolarHBondContact O-NZ 3.3Å; L271-K295 PolarHBondContact O-NZ 3.34Å; K272-K295 VanDerWaalsContact C-NZ 3.28Å; C273-K295 VanDerWaalsContact O-CE 3.27Å; C273-K295 WeakPolarHBondContact O-CE 3.4Å; C273-K295 PolarHBondContact O-NZ 3.35Å; K295-P297 WeakPolarHBondContact O-CD 3.18Å
296	N	96.3	Very high	96.7	Very high	78 Å²	78	56.6 Å²	56.6	42%	0.417	29%	0.294	S	S	.	.	S	Bend	trans	-82.1	115.5	166.9	-179.8	-4.5	0	0	0	108	A298 Q299	N296-A298 PolarHBondContact O-N 2.92Å; N296-A298 WeakPolarHBondContact OD1-CB 3.48Å; N296-A298 PolarHBondContact OD1-N 3.39Å; N296-Q299 HydrophobicContact CB-CB 4.43Å; N296-Q299 HydrophobicContact CB-CG 4.42Å; N296-Q299 PolarHBondContact O-N 3.07Å
297	P	95.3	Very high	96.5	Very high	38 Å²	38	54.6 Å²	54.6	25%	0.247	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-59.7	-33.6	178.4	22.3	-31.9	0	0	0	112.3	A238 K295 Q299 R300 S303	A238-P297 HydrophobicContact CB-CB 3.79Å; K295-P297 WeakPolarHBondContact O-CD 3.18Å; P297-Q299 PolarHBondContact O-N 3.3Å; P297-R300 VanDerWaalsContact O-CB 3.3Å; P297-R300 WeakPolarHBondContact O-CB 3.25Å; P297-R300 PolarHBondContact O-N 3.07Å; P297-S303 WeakPolarHBondContact O-CB 3.34Å; P297-S303 PolarHBondContact O-OG 2.66Å
298	A	94.1	Very high	96.5	Very high	90 Å²	90	52.1 Å²	52.1	74%	0.744	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-66.8	-4.5	176.7	0	0	0	0	0	114.4	N296	N296-A298 PolarHBondContact O-N 2.92Å; N296-A298 WeakPolarHBondContact OD1-CB 3.48Å; N296-A298 PolarHBondContact OD1-N 3.39Å
299	Q	96.6	Very high	96.5	Very high	130 Å²	130	53.6 Å²	53.6	61%	0.607	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-117.1	7.8	172.5	-65.1	-174.3	-18.7	0	0	112.9	K294 N296 P297	K294-Q299 VanDerWaalsContact CG-O 3.3Å; K294-Q299 WeakPolarHBondContact CG-O 3.32Å; N296-Q299 HydrophobicContact CB-CB 4.43Å; N296-Q299 HydrophobicContact CB-CG 4.42Å; N296-Q299 PolarHBondContact O-N 3.07Å; P297-Q299 PolarHBondContact O-N 3.3Å
300	R	97.9	Very high	96.4	Very high	8 Å²	8	55.7 Å²	55.7	3%	0.03	30%	0.299	C	S	.	.	S	Bend	trans	-93.4	135.5	-175.3	-170.9	-177.5	-56.9	149.3	5.7	110.6	E228 A238 L292 K294 P297 S303	E228-R300 IonicContact OE1-CZ 2.74Å; E228-R300 VanDerWaalsContact OE1-CZ 3.3Å; E228-R300 IonicContact OE1-NH1 2.66Å; E228-R300 PolarHBondContact OE1-NH1 2.94Å; E228-R300 IonicContact OE1-NH2 3.44Å; E228-R300 PolarHBondContact OE1-NH2 3.28Å; E228-R300 IonicContact OE2-CZ 2.63Å; E228-R300 IonicContact OE2-NH1 3.83Å; E228-R300 IonicContact OE2-NH2 2.89Å; E228-R300 PolarHBondContact OE2-NH2 2.85Å; A238-R300 VanDerWaalsContact C-NH1 3.34Å; A238-R300 WeakPolarHBondContact O-CD 3.47Å; A238-R300 PolarHBondContact O-NH1 2.99Å; L292-R300 VanDerWaalsContact O-CD 3.25Å; L292-R300 WeakPolarHBondContact O-CD 3.27Å; L292-R300 WeakPolarHBondContact O-CG 3.48Å; K294-R300 HydrophobicContact CB-CB 3.88Å; K294-R300 HydrophobicContact CB-CG 4.23Å; K294-R300 PolarHBondContact O-NE 3.04Å; K294-R300 PolarHBondContact O-NH2 3.16Å; P297-R300 VanDerWaalsContact O-CB 3.3Å; P297-R300 WeakPolarHBondContact O-CB 3.25Å; P297-R300 PolarHBondContact O-N 3.07Å; R300-S303 VanDerWaalsContact O-CB 3.26Å; R300-S303 WeakPolarHBondContact O-CB 3.34Å; R300-S303 PolarHBondContact O-N 3.15Å; R300-S303 PolarHBondContact O-OG 2.87Å
301	L	98.4	Very high	96.4	Very high	35 Å²	35	50.8 Å²	50.8	18%	0.183	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	140.8	175.8	-167.8	72.6	0	0	0	109.9	K291 L292 S303 D310 I311	K291-L301 HydrophobicContact CB-CB 3.98Å; K291-L301 HydrophobicContact CB-CD2 4.26Å; K291-L301 HydrophobicContact CD-CD2 4.46Å; K291-L301 PolarHBondContact O-N 3.3Å; L292-L301 HydrophobicContact CD2-CB 4.21Å; L301-S303 PolarHBondContact O-N 3.01Å; L301-D310 HydrophobicContact CD1-CB 4.22Å; L301-I311 HydrophobicContact CB-CD1 4.3Å; L301-I311 HydrophobicContact CD2-CD1 4.09Å; L301-I311 HydrophobicContact CG-CD1 3.84Å
302	G	96.4	Very high	96.4	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	-3.7	-172.8	0	0	0	0	0	115.3	W241 G304 D307	W241-G302 PolarHBondContact NE1-O 2.82Å; G302-G304 VanDerWaalsContact C-N 3.26Å; G302-G304 PolarHBondContact O-N 3.48Å; G302-D307 WeakPolarHBondContact CA-O 3.1Å; G302-D307 WeakPolarHBondContact O-CA 3.4Å; G302-D307 VanDerWaalsContact O-OD1 3.09Å
303	S	93.8	Very high	96.4	Very high	39 Å²	39	56.2 Å²	56.2	27%	0.273	30%	0.302	S	S	.	.			trans	-87.6	7	175	-54	0	0	0	0	113.7	A238 P297 R300 L301	A238-S303 WeakPolarHBondContact CB-OG 3.44Å; P297-S303 WeakPolarHBondContact O-CB 3.34Å; P297-S303 PolarHBondContact O-OG 2.66Å; R300-S303 VanDerWaalsContact O-CB 3.26Å; R300-S303 WeakPolarHBondContact O-CB 3.34Å; R300-S303 PolarHBondContact O-N 3.15Å; R300-S303 PolarHBondContact O-OG 2.87Å; L301-S303 PolarHBondContact O-N 3.01Å
304	G	91.2	Very high	96.4	Very high	31 Å²	31	55.9 Å²	55.9	32%	0.32	30%	0.3	S	S	.	.	S	Bend	trans	-81.1	-174.7	172.2	0	0	0	0	0	113.1	R237 G302 D307	R237-G304 PolarHBondContact NH2-O 2.86Å; G302-G304 VanDerWaalsContact C-N 3.26Å; G302-G304 PolarHBondContact O-N 3.48Å; G304-D307 PolarHBondContact O-N 2.91Å
305	K	91	Very high	96.4	Very high	199 Å²	199	54.7 Å²	54.7	87%	0.865	30%	0.301	S	S	*	.	S	Bend	trans	-65.8	-44.2	174.4	-68.6	-170.1	175.4	-170.8	0	111.5	R237 D307	R237-K305 PolarHBondContact NH2-O 3.2Å; K305-D307 PolarHBondContact O-N 3.47Å
306	D	94.1	Very high	96.4	Very high	88 Å²	88	52.1 Å²	52.1	47%	0.471	29%	0.29	S	S	.	.	S	Bend	trans	-61.2	-21	177.8	-70	48.7	0	0	0	114.3	A308 A309 D310 K313	D306-A308 PolarHBondContact O-N 2.99Å; D306-A309 HydrophobicContact CB-CB 4.28Å; D306-A309 VanDerWaalsContact O-CB 3.3Å; D306-A309 WeakPolarHBondContact O-CB 3.33Å; D306-A309 PolarHBondContact O-N 3.49Å; D306-D310 WeakPolarHBondContact CB-OD1 3.44Å; D306-K313 IonicContact OD2-NZ 3.61Å; D306-K313 PolarHBondContact OD2-NZ 3.44Å
307	D	96.3	Very high	96.5	Very high	12 Å²	12	48.6 Å²	48.6	6%	0.064	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	-118.4	170.8	-168.9	71.6	0	0	0	113.5	H175 R237 W241 G302 G304 K305 A309 D310	H175-D307 WeakPolarHBondContact CB-OD2 3.22Å; H175-D307 IonicContact CE1-OD1 3.84Å; H175-D307 IonicContact CE1-OD2 2.65Å; H175-D307 IonicContact CG-OD2 3.23Å; H175-D307 VanDerWaalsContact ND1-CG 3.33Å; H175-D307 IonicContact ND1-OD1 2.7Å; H175-D307 PolarHBondContact ND1-OD1 2.83Å; H175-D307 VanDerWaalsContact ND1-OD1 3.13Å; H175-D307 IonicContact ND1-OD2 2.68Å; H175-D307 PolarHBondContact ND1-OD2 3.36Å; R237-D307 VanDerWaalsContact CD-OD1 3.23Å; R237-D307 WeakPolarHBondContact CD-OD1 3.38Å; R237-D307 IonicContact CZ-OD1 3.18Å; R237-D307 IonicContact NE-OD1 2.7Å; R237-D307 PolarHBondContact NE-OD1 3.06Å; W241-D307 WeakPolarHBondContact CZ2-OD2 3.19Å; W241-D307 PolarHBondContact NE1-OD1 3.46Å; G302-D307 WeakPolarHBondContact CA-O 3.1Å; G302-D307 WeakPolarHBondContact O-CA 3.4Å; G302-D307 VanDerWaalsContact O-OD1 3.09Å; G304-D307 PolarHBondContact O-N 2.91Å; K305-D307 PolarHBondContact O-N 3.47Å; D307-A309 PolarHBondContact O-N 3Å; D307-A309 VanDerWaalsContact O-N 3.12Å; D307-D310 PolarHBondContact O-N 2.95Å
308	A	97.5	Very high	96.6	Very high	10 Å²	10	54.1 Å²	54.1	8%	0.083	29%	0.286	C	S	.	.	H	α-helix	trans	-53.2	-30.7	176.4	0	0	0	0	0	113.6	T168 W241 D306 D310 I311 Q312	T168-A308 HydrophobicContact CG2-CB 4.43Å; W241-A308 HydrophobicContact CH2-CB 3.71Å; W241-A308 HydrophobicContact CZ2-CB 3.74Å; D306-A308 PolarHBondContact O-N 2.99Å; A308-D310 VanDerWaalsContact C-N 3.28Å; A308-D310 PolarHBondContact O-N 3.19Å; A308-I311 WeakPolarHBondContact O-CA 3.35Å; A308-I311 VanDerWaalsContact O-CB 3.28Å; A308-I311 WeakPolarHBondContact O-CB 3.14Å; A308-I311 PolarHBondContact O-N 2.93Å; A308-Q312 VanDerWaalsContact O-CG 3.31Å; A308-Q312 WeakPolarHBondContact O-CG 3.49Å; A308-Q312 PolarHBondContact O-N 2.96Å
309	A	97.8	Very high	96.6	Very high	32 Å²	32	56.8 Å²	56.8	26%	0.264	28%	0.283	S	S	.	.	H	α-helix	trans	-66.9	-28.2	178.2	0	0	0	0	0	112.4	D306 D307 I311 Q312 K313	D306-A309 HydrophobicContact CB-CB 4.28Å; D306-A309 VanDerWaalsContact O-CB 3.3Å; D306-A309 WeakPolarHBondContact O-CB 3.33Å; D306-A309 PolarHBondContact O-N 3.49Å; D307-A309 PolarHBondContact O-N 3Å; D307-A309 VanDerWaalsContact O-N 3.12Å; A309-I311 VanDerWaalsContact C-N 3.3Å; A309-Q312 PolarHBondContact O-N 2.94Å; A309-K313 VanDerWaalsContact O-CD 3.28Å; A309-K313 WeakPolarHBondContact O-CD 3.32Å; A309-K313 VanDerWaalsContact O-CE 3.23Å; A309-K313 WeakPolarHBondContact O-CE 3.13Å; A309-K313 WeakPolarHBondContact O-CG 3.26Å; A309-K313 PolarHBondContact O-N 3.32Å; A309-K313 VanDerWaalsContact O-N 3.11Å
310	D	97.6	Very high	96.5	Very high	44 Å²	44	52.1 Å²	52.1	24%	0.235	26%	0.262	C	S	.	.	H	α-helix	trans	-70.8	-27.8	172	-75.9	-17.1	0	0	0	112.6	L301 D306 D307 A308 K313	L301-D310 HydrophobicContact CD1-CB 4.22Å; D306-D310 WeakPolarHBondContact CB-OD1 3.44Å; D307-D310 PolarHBondContact O-N 2.95Å; A308-D310 VanDerWaalsContact C-N 3.28Å; A308-D310 PolarHBondContact O-N 3.19Å; D310-K313 IonicContact OD1-NZ 2.8Å; D310-K313 PolarHBondContact OD1-NZ 2.82Å
311	I	98.4	Very high	96.5	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-70.4	-47.3	170.5	-45.4	-52.8	0	0	0	109.7	T168 W241 L244 M288 L292 L301 A308 A309 K313 H314 F317	T168-I311 HydrophobicContact CG2-CB 3.71Å; T168-I311 HydrophobicContact CG2-CG1 4.31Å; T168-I311 HydrophobicContact CG2-CG2 3.6Å; W241-I311 HydrophobicContact CD2-CD1 4.03Å; W241-I311 HydrophobicContact CD2-CG1 3.98Å; W241-I311 HydrophobicContact CE3-CD1 4.02Å; W241-I311 HydrophobicContact CE3-CG1 3.73Å; W241-I311 HydrophobicContact CG-CD1 4.37Å; W241-I311 HydrophobicContact CH2-CG1 4.01Å; W241-I311 HydrophobicContact CZ2-CG1 4.21Å; W241-I311 HydrophobicContact CZ3-CG1 3.75Å; L244-I311 HydrophobicContact CD2-CG2 4.18Å; M288-I311 HydrophobicContact CE-CG2 4.28Å; L292-I311 HydrophobicContact CD2-CD1 3.8Å; L301-I311 HydrophobicContact CB-CD1 4.3Å; L301-I311 HydrophobicContact CD2-CD1 4.09Å; L301-I311 HydrophobicContact CG-CD1 3.84Å; A308-I311 WeakPolarHBondContact O-CA 3.35Å; A308-I311 VanDerWaalsContact O-CB 3.28Å; A308-I311 WeakPolarHBondContact O-CB 3.14Å; A308-I311 PolarHBondContact O-N 2.93Å; A309-I311 VanDerWaalsContact C-N 3.3Å; I311-K313 VanDerWaalsContact C-N 3.31Å; I311-K313 PolarHBondContact O-N 2.84Å; I311-H314 WeakPolarHBondContact O-CB 3.41Å; I311-H314 PolarHBondContact O-N 2.98Å; I311-F317 HydrophobicContact CG2-CE2 3.73Å; I311-F317 HydrophobicContact CG2-CZ 4.45Å; I311-F317 WeakPolarHBondContact O-CD2 3.47Å
312	Q	98.4	Very high	96.5	Very high	55 Å²	55	54.7 Å²	54.7	26%	0.257	28%	0.277	S	S	.	.	H	α-helix	trans	-63.9	-31.5	-175.8	-69.5	171.4	-5.5	0	0	113.8	T168 A308 A309 H314 W322	T168-Q312 HydrophobicContact CG2-CG 4.21Å; A308-Q312 VanDerWaalsContact O-CG 3.31Å; A308-Q312 WeakPolarHBondContact O-CG 3.49Å; A308-Q312 PolarHBondContact O-N 2.96Å; A309-Q312 PolarHBondContact O-N 2.94Å; Q312-H314 PolarHBondContact O-N 2.85Å; Q312-W322 VanDerWaalsContact CA-CZ2 3.49Å; Q312-W322 HydrophobicContact CB-CD2 4.29Å; Q312-W322 HydrophobicContact CB-CH2 4.34Å; Q312-W322 HydrophobicContact CB-CZ2 3.7Å; Q312-W322 HydrophobicContact CG-CD2 3.87Å; Q312-W322 HydrophobicContact CG-CE3 4Å; Q312-W322 HydrophobicContact CG-CH2 3.77Å; Q312-W322 HydrophobicContact CG-CZ2 3.61Å; Q312-W322 HydrophobicContact CG-CZ3 3.95Å
313	K	98.1	Very high	96.5	Very high	125 Å²	125	60.6 Å²	60.6	54%	0.543	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-6.7	174.4	-65.5	159.3	-153.9	166.2	0	113.7	D306 A309 D310 I311	D306-K313 IonicContact OD2-NZ 3.61Å; D306-K313 PolarHBondContact OD2-NZ 3.44Å; A309-K313 VanDerWaalsContact O-CD 3.28Å; A309-K313 WeakPolarHBondContact O-CD 3.32Å; A309-K313 VanDerWaalsContact O-CE 3.23Å; A309-K313 WeakPolarHBondContact O-CE 3.13Å; A309-K313 WeakPolarHBondContact O-CG 3.26Å; A309-K313 PolarHBondContact O-N 3.32Å; A309-K313 VanDerWaalsContact O-N 3.11Å; D310-K313 IonicContact OD1-NZ 2.8Å; D310-K313 PolarHBondContact OD1-NZ 2.82Å; I311-K313 VanDerWaalsContact C-N 3.31Å; I311-K313 PolarHBondContact O-N 2.84Å
314	H	98.7	Very high	96.7	Very high	8 Å²	8	63 Å²	63	4%	0.037	31%	0.311	C	S	.	.	S	Bend	trans	-73.8	136.7	-171.6	-158.3	-95.2	0	0	0	112.6	D287 K291 I311 Q312 F316 F317	D287-H314 IonicContact OD2-NE2 3.8Å; K291-H314 VanDerWaalsContact CD-NE2 3.33Å; K291-H314 WeakPolarHBondContact CD-NE2 3.46Å; K291-H314 PolarHBondContact NZ-NE2 2.71Å; I311-H314 WeakPolarHBondContact O-CB 3.41Å; I311-H314 PolarHBondContact O-N 2.98Å; Q312-H314 PolarHBondContact O-N 2.85Å; H314-F316 PolarHBondContact O-N 3.24Å; H314-F317 HydrophobicContact CB-CD2 4.38Å; H314-F317 PolarHBondContact O-N 3.34Å
315	P	98.5	Very high	97	Very high	58 Å²	58	61.6 Å²	61.6	38%	0.377	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-55.5	-17.8	-179	-31.1	37.3	0	0	0	116.9	D284 F317 R318	D284-P315 WeakPolarHBondContact OD1-CB 3.09Å; P315-F317 VanDerWaalsContact C-N 3.31Å; P315-R318 WeakPolarHBondContact O-CB 3.46Å; P315-R318 WeakPolarHBondContact O-CD 3.32Å; P315-R318 WeakPolarHBondContact O-CG 3.38Å; P315-R318 PolarHBondContact O-N 3Å
316	F	98.6	Very high	97.4	Very high	15 Å²	15	55 Å²	55	7%	0.066	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-62.7	-36.1	171.6	178.4	-107.1	0	0	0	112.2	E157 C161 L164 M248 D284 A285 M288 H314	E157-F316 HydrophobicContact CB-CE2 4.41Å; C161-F316 HydrophobicContact CB-CE1 3.77Å; C161-F316 HydrophobicContact CB-CE2 4.38Å; C161-F316 HydrophobicContact CB-CZ 3.66Å; C161-F316 PolarHBondContact SG-O 2.84Å; C161-F316 VanDerWaalsContact SG-O 3.36Å; L164-F316 HydrophobicContact CD1-CE1 4.05Å; L164-F316 HydrophobicContact CD1-CZ 4.31Å; M248-F316 HydrophobicContact CE-CD1 3.92Å; M248-F316 HydrophobicContact CE-CD2 3.83Å; M248-F316 HydrophobicContact CE-CE1 3.68Å; M248-F316 HydrophobicContact CE-CE2 3.62Å; M248-F316 HydrophobicContact CE-CG 3.98Å; M248-F316 HydrophobicContact CE-CZ 3.54Å; D284-F316 HydrophobicContact CB-CB 4.43Å; A285-F316 HydrophobicContact CB-CD2 3.86Å; A285-F316 HydrophobicContact CB-CE2 3.86Å; M288-F316 HydrophobicContact CE-CD1 4.2Å; M288-F316 HydrophobicContact SD-CB 3.74Å; M288-F316 HydrophobicContact SD-CD1 3.39Å; M288-F316 WeakPolarHBondContact SD-CD1 3.48Å; M288-F316 HydrophobicContact SD-CE1 4.21Å; M288-F316 HydrophobicContact SD-CG 3.77Å; H314-F316 PolarHBondContact O-N 3.24Å
317	F	98.4	Very high	97.5	Very high	3 Å²	3	54.7 Å²	54.7	1%	0.013	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-93.9	12.7	179	-62.2	-70.3	0	0	0	113.8	C161 L164 M288 I311 H314 P315 H319 I320 W322	C161-F317 VanDerWaalsContact SG-CD1 3.52Å; L164-F317 HydrophobicContact CB-CE1 4.17Å; L164-F317 HydrophobicContact CB-CZ 4.11Å; M288-F317 HydrophobicContact CE-CE2 3.4Å; M288-F317 VanDerWaalsContact CE-CE2 3.4Å; M288-F317 HydrophobicContact CE-CZ 3.61Å; M288-F317 HydrophobicContact SD-CD2 4.31Å; M288-F317 HydrophobicContact SD-CE2 3.7Å; M288-F317 HydrophobicContact SD-CZ 4.25Å; I311-F317 HydrophobicContact CG2-CE2 3.73Å; I311-F317 HydrophobicContact CG2-CZ 4.45Å; I311-F317 WeakPolarHBondContact O-CD2 3.47Å; H314-F317 HydrophobicContact CB-CD2 4.38Å; H314-F317 PolarHBondContact O-N 3.34Å; P315-F317 VanDerWaalsContact C-N 3.31Å; F317-H319 PolarHBondContact O-N 3.01Å; F317-I320 HydrophobicContact CB-CB 4.45Å; F317-I320 HydrophobicContact CB-CG1 4.34Å; F317-I320 HydrophobicContact CD1-CG1 4.06Å; F317-I320 PolarHBondContact O-N 3.3Å; F317-W322 HydrophobicContact CB-CH2 4.17Å; F317-W322 HydrophobicContact CB-CZ2 3.49Å; F317-W322 VanDerWaalsContact CB-CZ2 3.49Å; F317-W322 AromaticContact CD1-CH2 3.73Å; F317-W322 HydrophobicContact CD1-CH2 3.73Å; F317-W322 AromaticContact CD1-CZ2 3.96Å; F317-W322 HydrophobicContact CD1-CZ2 3.96Å; F317-W322 HydrophobicContact CD2-CH2 4.08Å; F317-W322 AromaticContact CD2-CZ2 3.98Å; F317-W322 HydrophobicContact CD2-CZ2 3.98Å; F317-W322 HydrophobicContact CE1-CH2 4.04Å; F317-W322 HydrophobicContact CE2-CH2 4.35Å; F317-W322 AromaticContact CG-CH2 3.74Å; F317-W322 HydrophobicContact CG-CH2 3.74Å; F317-W322 AromaticContact CG-CZ2 3.56Å; F317-W322 HydrophobicContact CG-CZ2 3.56Å; F317-W322 HydrophobicContact CZ-CH2 4.32Å
318	R	96.7	Very high	97.6	Very high	154 Å²	154	57.4 Å²	57.4	58%	0.581	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-12.8	-175.5	70.7	-176.2	169.8	-120.8	-10.5	115.6	D284 P315	D284-R318 VanDerWaalsContact CG-NH1 3.28Å; D284-R318 IonicContact OD1-NH1 3.06Å; D284-R318 IonicContact OD2-CZ 3.3Å; D284-R318 IonicContact OD2-NH1 2.67Å; D284-R318 PolarHBondContact OD2-NH1 3.38Å; D284-R318 IonicContact OD2-NH2 3.67Å; P315-R318 WeakPolarHBondContact O-CB 3.46Å; P315-R318 WeakPolarHBondContact O-CD 3.32Å; P315-R318 WeakPolarHBondContact O-CG 3.38Å; P315-R318 PolarHBondContact O-N 3Å
319	H	93.7	Very high	97.5	Very high	147 Å²	147	64 Å²	64	68%	0.681	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	-1.1	178.8	-58.5	-57.7	0	0	0	113.1	F317	F317-H319 PolarHBondContact O-N 3.01Å
320	I	95.6	Very high	97.4	Very high	31 Å²	31	64.5 Å²	64.5	16%	0.159	30%	0.302	C	S	.	.			trans	-90.3	121	178.9	-61.9	-59.1	0	0	0	110.4	F317 W322 L325	F317-I320 HydrophobicContact CB-CB 4.45Å; F317-I320 HydrophobicContact CB-CG1 4.34Å; F317-I320 HydrophobicContact CD1-CG1 4.06Å; F317-I320 PolarHBondContact O-N 3.3Å; I320-W322 HydrophobicContact CG2-CD2 3.88Å; I320-W322 HydrophobicContact CG2-CE3 4.02Å; I320-W322 HydrophobicContact CG2-CG 4.33Å; I320-W322 HydrophobicContact CG2-CH2 4.45Å; I320-W322 HydrophobicContact CG2-CZ2 4.32Å; I320-W322 HydrophobicContact CG2-CZ3 4.31Å; I320-W322 PolarHBondContact O-N 2.82Å; I320-L325 HydrophobicContact CG2-CB 4.4Å; I320-L325 HydrophobicContact CG2-CD2 3.86Å
321	S	97.1	Very high	97.3	Very high	48 Å²	48	69.5 Å²	69.5	34%	0.336	33%	0.329	S	S	.	.			trans	-82.4	103.4	161.3	177.6	0	0	0	0	109	E323 E324 L325	S321-E323 VanDerWaalsContact C-N 3.26Å; S321-E323 PolarHBondContact O-N 3.01Å; S321-E324 WeakPolarHBondContact CB-OE2 3.46Å; S321-E324 PolarHBondContact O-N 3.12Å; S321-E324 WeakPolarHBondContact OG-CG 3.41Å; S321-E324 PolarHBondContact OG-OE2 2.65Å; S321-E324 VanDerWaalsContact OG-OE2 3.14Å; S321-L325 WeakPolarHBondContact O-CB 3.18Å; S321-L325 PolarHBondContact O-N 3.39Å
322	W	97.8	Very high	97.2	Very high	50 Å²	50	70.6 Å²	70.6	19%	0.189	34%	0.336	C	S	.	.	H	α-helix	trans	-62.6	-30.6	-176.5	-62.9	101.6	0	0	0	113.3	M169 Q312 F317 I320 L325 L326	M169-W322 HydrophobicContact CG-CE3 3.81Å; M169-W322 HydrophobicContact CG-CZ3 3.94Å; M169-W322 HydrophobicContact SD-CE3 3.79Å; M169-W322 HydrophobicContact SD-CZ3 4.39Å; Q312-W322 VanDerWaalsContact CA-CZ2 3.49Å; Q312-W322 HydrophobicContact CB-CD2 4.29Å; Q312-W322 HydrophobicContact CB-CH2 4.34Å; Q312-W322 HydrophobicContact CB-CZ2 3.7Å; Q312-W322 HydrophobicContact CG-CD2 3.87Å; Q312-W322 HydrophobicContact CG-CE3 4Å; Q312-W322 HydrophobicContact CG-CH2 3.77Å; Q312-W322 HydrophobicContact CG-CZ2 3.61Å; Q312-W322 HydrophobicContact CG-CZ3 3.95Å; F317-W322 HydrophobicContact CB-CH2 4.17Å; F317-W322 HydrophobicContact CB-CZ2 3.49Å; F317-W322 VanDerWaalsContact CB-CZ2 3.49Å; F317-W322 AromaticContact CD1-CH2 3.73Å; F317-W322 HydrophobicContact CD1-CH2 3.73Å; F317-W322 AromaticContact CD1-CZ2 3.96Å; F317-W322 HydrophobicContact CD1-CZ2 3.96Å; F317-W322 HydrophobicContact CD2-CH2 4.08Å; F317-W322 AromaticContact CD2-CZ2 3.98Å; F317-W322 HydrophobicContact CD2-CZ2 3.98Å; F317-W322 HydrophobicContact CE1-CH2 4.04Å; F317-W322 HydrophobicContact CE2-CH2 4.35Å; F317-W322 AromaticContact CG-CH2 3.74Å; F317-W322 HydrophobicContact CG-CH2 3.74Å; F317-W322 AromaticContact CG-CZ2 3.56Å; F317-W322 HydrophobicContact CG-CZ2 3.56Å; F317-W322 HydrophobicContact CZ-CH2 4.32Å; I320-W322 HydrophobicContact CG2-CD2 3.88Å; I320-W322 HydrophobicContact CG2-CE3 4.02Å; I320-W322 HydrophobicContact CG2-CG 4.33Å; I320-W322 HydrophobicContact CG2-CH2 4.45Å; I320-W322 HydrophobicContact CG2-CZ2 4.32Å; I320-W322 HydrophobicContact CG2-CZ3 4.31Å; I320-W322 PolarHBondContact O-N 2.82Å; W322-L325 HydrophobicContact CE3-CD2 4.45Å; W322-L325 HydrophobicContact CZ3-CD2 4.45Å; W322-L326 WeakPolarHBondContact O-CB 3.11Å; W322-L326 PolarHBondContact O-N 3.17Å
323	E	97.8	Very high	97	Very high	123 Å²	123	70.9 Å²	70.9	58%	0.575	34%	0.343	S	S	*	.	H	α-helix	trans	-69.5	-46.1	174	-170.8	-163.2	135.4	0	0	111.4	S321 L325 L326 N327 R329	S321-E323 VanDerWaalsContact C-N 3.26Å; S321-E323 PolarHBondContact O-N 3.01Å; E323-L325 VanDerWaalsContact C-N 3.32Å; E323-L325 PolarHBondContact O-N 3.19Å; E323-L326 PolarHBondContact O-N 2.62Å; E323-N327 WeakPolarHBondContact O-CB 3.33Å; E323-N327 PolarHBondContact O-N 3.31Å; E323-N327 PolarHBondContact O-ND2 2.92Å; E323-R329 IonicContact OE1-NH1 3.63Å; E323-R329 PolarHBondContact OE1-NH1 2.8Å
324	E	97.9	Very high	96.8	Very high	91 Å²	91	67.1 Å²	67.1	43%	0.425	33%	0.325	S	S	.	.	H	α-helix	trans	-67.3	-36	179.7	-69.7	173.7	155.9	0	0	111.5	S321 N327 K328 R329 V330	S321-E324 WeakPolarHBondContact CB-OE2 3.46Å; S321-E324 PolarHBondContact O-N 3.12Å; S321-E324 WeakPolarHBondContact OG-CG 3.41Å; S321-E324 PolarHBondContact OG-OE2 2.65Å; S321-E324 VanDerWaalsContact OG-OE2 3.14Å; E324-N327 CarbonylContact O-C 3.57Å; E324-N327 PolarHBondContact O-N 3.07Å; E324-K328 PolarHBondContact O-N 3.24Å; E324-K328 VanDerWaalsContact O-N 3.11Å; E324-R329 HydrophobicContact CB-CB 4.07Å; E324-R329 HydrophobicContact CG-CB 4.41Å; E324-R329 PolarHBondContact O-N 2.71Å; E324-V330 HydrophobicContact CB-CG2 3.85Å
325	L	97.8	Very high	96.6	Very high	0 Å²	0	72.6 Å²	72.6	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-63.4	-52.5	173.9	-167.8	63	0	0	0	110.6	F119 F162 E166 M169 I320 S321 W322 E323 N327 K328 V330	F119-L325 HydrophobicContact CZ-CG 4.29Å; F119-L325 WeakPolarHBondContact CZ-O 3.5Å; F162-L325 HydrophobicContact CD2-CD1 4Å; F162-L325 HydrophobicContact CE2-CD1 3.66Å; F162-L325 HydrophobicContact CZ-CD1 4.08Å; E166-L325 HydrophobicContact CG-CD1 3.79Å; E166-L325 HydrophobicContact CG-CD2 4.12Å; E166-L325 HydrophobicContact CG-CG 4.01Å; M169-L325 HydrophobicContact SD-CB 4.47Å; M169-L325 HydrophobicContact SD-CD2 4.27Å; M169-L325 HydrophobicContact SD-CG 4.47Å; I320-L325 HydrophobicContact CG2-CB 4.4Å; I320-L325 HydrophobicContact CG2-CD2 3.86Å; S321-L325 WeakPolarHBondContact O-CB 3.18Å; S321-L325 PolarHBondContact O-N 3.39Å; W322-L325 HydrophobicContact CE3-CD2 4.45Å; W322-L325 HydrophobicContact CZ3-CD2 4.45Å; E323-L325 VanDerWaalsContact C-N 3.32Å; E323-L325 PolarHBondContact O-N 3.19Å; L325-N327 VanDerWaalsContact C-N 3.27Å; L325-N327 PolarHBondContact O-N 3.44Å; L325-K328 PolarHBondContact O-N 2.68Å; L325-V330 HydrophobicContact CB-CG2 4.46Å; L325-V330 HydrophobicContact CD1-CB 4.28Å; L325-V330 HydrophobicContact CD1-CG2 4.47Å
326	L	97.6	Very high	96.3	Very high	61 Å²	61	70.2 Å²	70.2	32%	0.319	33%	0.334	S	S	.	.	H	α-helix	trans	-54.4	-42.1	176.7	-179.2	60.5	0	0	0	112.9	P118 M169 W322 E323 K328	P118-L326 HydrophobicContact CG-CD1 3.91Å; M169-L326 HydrophobicContact CE-CB 3.73Å; M169-L326 HydrophobicContact CE-CD1 4.19Å; M169-L326 HydrophobicContact CE-CD2 4.35Å; M169-L326 HydrophobicContact CE-CG 4.31Å; M169-L326 HydrophobicContact SD-CB 4.32Å; W322-L326 WeakPolarHBondContact O-CB 3.11Å; W322-L326 PolarHBondContact O-N 3.17Å; E323-L326 PolarHBondContact O-N 2.62Å; L326-K328 PolarHBondContact O-N 3.23Å
327	N	97.4	Very high	95.9	Very high	81 Å²	81	76.5 Å²	76.5	43%	0.433	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	6.3	179.1	-73.2	-82.3	0	0	0	113.6	E323 E324 L325 R329	E323-N327 WeakPolarHBondContact O-CB 3.33Å; E323-N327 PolarHBondContact O-N 3.31Å; E323-N327 PolarHBondContact O-ND2 2.92Å; E324-N327 CarbonylContact O-C 3.57Å; E324-N327 PolarHBondContact O-N 3.07Å; L325-N327 VanDerWaalsContact C-N 3.27Å; L325-N327 PolarHBondContact O-N 3.44Å; N327-R329 HydrophobicContact CB-CG 4.02Å; N327-R329 PolarHBondContact O-N 3.21Å
328	K	97.3	Very high	95.6	Very high	70 Å²	70	78 Å²	78	30%	0.304	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	39.8	179.6	-63.9	-176.5	172.6	179.3	0	113.4	P118 F119 H196 E324 L325 L326	P118-K328 WeakPolarHBondContact O-CE 2.9Å; P118-K328 PolarHBondContact O-NZ 2.91Å; F119-K328 HydrophobicContact CE1-CD 4.46Å; F119-K328 VanDerWaalsContact CE1-CE 3.43Å; F119-K328 HydrophobicContact CE1-CG 4.18Å; H196-K328 HydrophobicContact CB-CD 4.45Å; E324-K328 PolarHBondContact O-N 3.24Å; E324-K328 VanDerWaalsContact O-N 3.11Å; L325-K328 PolarHBondContact O-N 2.68Å; L326-K328 PolarHBondContact O-N 3.23Å
329	R	96.6	Very high	95.4	Very high	149 Å²	149	79 Å²	79	56%	0.562	38%	0.382	S	S	*	.			trans	-94.2	-13.9	175	-58.9	-178.5	-172.3	144.7	6.1	113.2	E323 E324 N327	E323-R329 IonicContact OE1-NH1 3.63Å; E323-R329 PolarHBondContact OE1-NH1 2.8Å; E324-R329 HydrophobicContact CB-CB 4.07Å; E324-R329 HydrophobicContact CG-CB 4.41Å; E324-R329 PolarHBondContact O-N 2.71Å; N327-R329 HydrophobicContact CB-CG 4.02Å; N327-R329 PolarHBondContact O-N 3.21Å
330	V	95.2	Very high	95.4	Very high	41 Å²	41	74.8 Å²	74.8	25%	0.248	37%	0.369	C	S	.	.	S	Bend	trans	-86.8	123.6	171.6	-173.6	0	0	0	0	108.6	F162 E324 L325 P332	F162-V330 HydrophobicContact CD2-CG1 3.89Å; F162-V330 HydrophobicContact CE2-CB 4.03Å; F162-V330 HydrophobicContact CE2-CG1 3.75Å; E324-V330 HydrophobicContact CB-CG2 3.85Å; L325-V330 HydrophobicContact CB-CG2 4.46Å; L325-V330 HydrophobicContact CD1-CB 4.28Å; L325-V330 HydrophobicContact CD1-CG2 4.47Å; V330-P332 WeakPolarHBondContact O-CD 3.36Å
331	D	94.8	Very high	95.1	Very high	149 Å²	149	79 Å²	79	80%	0.797	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-63.2	128	178.4	-81.5	-51.4	0	0	0	111.7
332	P	96.4	Very high	94.9	Very high	24 Å²	24	80.4 Å²	80.4	16%	0.156	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-64.2	141.6	176.6	-26.8	36.9	0	0	0	113.9	F162 Q194 G195 V330 Y334	F162-P332 HydrophobicContact CE1-CB 4.09Å; F162-P332 HydrophobicContact CE1-CG 4.43Å; F162-P332 HydrophobicContact CZ-CB 3.93Å; F162-P332 HydrophobicContact CZ-CG 3.89Å; Q194-P332 WeakPolarHBondContact O-CG 3.47Å; G195-P332 WeakPolarHBondContact O-CB 3.33Å; V330-P332 WeakPolarHBondContact O-CD 3.36Å; P332-Y334 PolarHBondContact O-N 3.48Å
333	P	95.3	Very high	94.7	Very high	61 Å²	61	78.9 Å²	78.9	40%	0.396	39%	0.385	S	S	.	.	S	Bend	trans	-69.3	-18	-177.5	29.4	-36.8	0	0	0	113.6	T159 F162 Y163	T159-P333 HydrophobicContact CG2-CB 4.02Å; T159-P333 HydrophobicContact CG2-CG 3.84Å; F162-P333 HydrophobicContact CB-CG 4.23Å; F162-P333 HydrophobicContact CD1-CG 4Å; F162-P333 HydrophobicContact CG-CG 4.16Å; Y163-P333 HydrophobicContact CE1-CG 4.36Å; Y163-P333 HydrophobicContact CE2-CG 3.93Å
334	Y	94	Very high	94.5	Very high	46 Å²	46	74.3 Å²	74.3	18%	0.18	37%	0.366	C	S	.	.			trans	-139	134.3	169.4	162.5	-94.7	0	0	0	109.3	Q148 L191 G195 P332 P336 Q346	Q148-Y334 HydrophobicContact CG-CD1 4.16Å; Q148-Y334 HydrophobicContact CG-CE1 4.43Å; Q148-Y334 HydrophobicContact CG-CG 4.23Å; L191-Y334 HydrophobicContact CD1-CD1 3.81Å; L191-Y334 HydrophobicContact CD1-CE1 3.82Å; G195-Y334 WeakPolarHBondContact CA-O 3.39Å; P332-Y334 PolarHBondContact O-N 3.48Å; Y334-P336 HydrophobicContact CE1-CG 3.9Å; Y334-Q346 PolarHBondContact OH-OE1 3.42Å
335	K	94	Very high	94.3	Very high	123 Å²	123	73.2 Å²	73.2	54%	0.535	37%	0.368	S	S	.	.			trans	-121.7	118.7	177.9	-175.3	165.1	-175.1	169.7	0	110.1	Q337	K335-Q337 PolarHBondContact O-N 3.29Å; K335-Q337 PolarHBondContact O-NE2 3.33Å
336	P	91.9	Very high	94	Very high	8 Å²	8	75.7 Å²	75.7	5%	0.052	38%	0.379	C	S	.	.			trans	-51.2	134.3	178.5	-28.9	34.7	0	0	0	113	Y334 L338	Y334-P336 HydrophobicContact CE1-CG 3.9Å; P336-L338 HydrophobicContact CB-CD1 4.41Å; P336-L338 HydrophobicContact CB-CD2 4.28Å; P336-L338 HydrophobicContact CB-CG 4.04Å; P336-L338 PolarHBondContact O-N 3.05Å
337	Q	91.1	Very high	93.7	Very high	146 Å²	146	73.5 Å²	73.5	68%	0.682	37%	0.367	S	S	*	.			trans	-92.9	98	174.2	-60.3	-58	-64.9	0	0	108.1	K335	K335-Q337 PolarHBondContact O-N 3.29Å; K335-Q337 PolarHBondContact O-NE2 3.33Å
338	L	92.6	Very high	93.4	Very high	34 Å²	34	72 Å²	72	18%	0.178	36%	0.359	C	S	.	.			trans	-115.6	139.1	-177.3	-56.3	-177.4	0	0	0	110.8	S141 Q193 P336 D343 Q346	S141-L338 WeakPolarHBondContact O-CD2 3.31Å; Q193-L338 HydrophobicContact CB-CD1 4.2Å; Q193-L338 HydrophobicContact CG-CD1 4.07Å; P336-L338 HydrophobicContact CB-CD1 4.41Å; P336-L338 HydrophobicContact CB-CD2 4.28Å; P336-L338 HydrophobicContact CB-CG 4.04Å; P336-L338 PolarHBondContact O-N 3.05Å; L338-D343 WeakPolarHBondContact CA-OD2 3.47Å; L338-D343 HydrophobicContact CB-CB 4.11Å; L338-D343 HydrophobicContact CD2-CB 4.19Å; L338-Q346 HydrophobicContact CD2-CG 3.76Å
339	H	91.9	Very high	93.1	Very high	177 Å²	177	72.3 Å²	72.3	82%	0.819	37%	0.367	S	S	*	.	S	Bend	trans	-85.6	-23.5	179.3	-61.3	-66.1	0	0	0	113.5	D343	H339-D343 WeakPolarHBondContact CB-OD2 3.41Å; H339-D343 IonicContact CD2-OD2 3.68Å; H339-D343 PolarHBondContact CD2-OD2 3.35Å; H339-D343 VanDerWaalsContact CD2-OD2 3.24Å; H339-D343 IonicContact CG-OD2 2.64Å; H339-D343 PolarHBondContact N-OD2 2.92Å
340	S	93.3	Very high	93	Very high	58 Å²	58	72.9 Å²	72.9	41%	0.406	37%	0.369	S	S	.	.	S	Bend	trans	-160.6	175.1	176.9	68.5	0	0	0	0	111.3	E342 D343	S340-E342 PolarHBondContact O-N 3.27Å; S340-E342 PolarHBondContact OG-N 3.12Å; S340-D343 VanDerWaalsContact O-CB 3.26Å; S340-D343 WeakPolarHBondContact O-CB 3.3Å; S340-D343 PolarHBondContact O-N 2.82Å; S340-D343 PolarHBondContact OG-N 3.11Å
341	E	88.8	Confident	92.9	Very high	119 Å²	119	72.2 Å²	72.2	56%	0.556	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-23.4	170.1	-61.8	-172.5	-176.5	0	0	112.9	I84 D343	I84-E341 HydrophobicContact CG1-CB 4.01Å; E341-D343 VanDerWaalsContact C-N 3.32Å
342	E	93.5	Very high	92.8	Very high	77 Å²	77	66.7 Å²	66.7	36%	0.36	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-2.5	177.9	-68.7	174.1	-119.4	0	0	112.7	L59 Q72 R74 I84 S340 V344	L59-E342 HydrophobicContact CD1-CG 4Å; Q72-E342 VanDerWaalsContact NE2-C 3.26Å; Q72-E342 PolarHBondContact NE2-O 2.96Å; R74-E342 IonicContact CZ-OE1 2.87Å; R74-E342 IonicContact CZ-OE2 2.66Å; R74-E342 VanDerWaalsContact NH1-CD 3.32Å; R74-E342 IonicContact NH1-OE1 2.74Å; R74-E342 PolarHBondContact NH1-OE1 3.33Å; R74-E342 IonicContact NH1-OE2 2.78Å; R74-E342 VanDerWaalsContact NH2-CD 3.28Å; R74-E342 IonicContact NH2-OE1 2.73Å; R74-E342 PolarHBondContact NH2-OE1 2.81Å; R74-E342 IonicContact NH2-OE2 3.56Å; R74-E342 PolarHBondContact NH2-OE2 3.01Å; I84-E342 HydrophobicContact CD1-CG 3.66Å; I84-E342 HydrophobicContact CG1-CG 4.05Å; S340-E342 PolarHBondContact O-N 3.27Å; S340-E342 PolarHBondContact OG-N 3.12Å; E342-V344 PolarHBondContact O-N 3.49Å
343	D	94.3	Very high	92.7	Very high	18 Å²	18	75.4 Å²	75.4	10%	0.096	36%	0.364	C	S	.	.			trans	-66.4	121.2	-177.7	-165.6	-29.2	0	0	0	112.2	L338 H339 S340 E341 S345	L338-D343 WeakPolarHBondContact CA-OD2 3.47Å; L338-D343 HydrophobicContact CB-CB 4.11Å; L338-D343 HydrophobicContact CD2-CB 4.19Å; H339-D343 WeakPolarHBondContact CB-OD2 3.41Å; H339-D343 IonicContact CD2-OD2 3.68Å; H339-D343 PolarHBondContact CD2-OD2 3.35Å; H339-D343 VanDerWaalsContact CD2-OD2 3.24Å; H339-D343 IonicContact CG-OD2 2.64Å; H339-D343 PolarHBondContact N-OD2 2.92Å; S340-D343 VanDerWaalsContact O-CB 3.26Å; S340-D343 WeakPolarHBondContact O-CB 3.3Å; S340-D343 PolarHBondContact O-N 2.82Å; S340-D343 PolarHBondContact OG-N 3.11Å; E341-D343 VanDerWaalsContact C-N 3.32Å; D343-S345 WeakPolarHBondContact OD1-CB 3.49Å; D343-S345 PolarHBondContact OD1-N 2.7Å; D343-S345 PolarHBondContact OD1-OG 3.38Å
344	V	93.5	Very high	92.6	Very high	28 Å²	28	75.7 Å²	75.7	17%	0.17	36%	0.36	C	S	.	.			trans	-112.7	16.6	179.1	-63.7	0	0	0	0	113.2	T60 L62 Q72 E342 Q346 F347 T352	T60-V344 HydrophobicContact CG2-CB 4.5Å; T60-V344 HydrophobicContact CG2-CG1 4.14Å; T60-V344 HydrophobicContact CG2-CG2 4.21Å; L62-V344 HydrophobicContact CD2-CB 4.41Å; L62-V344 HydrophobicContact CD2-CG1 3.68Å; Q72-V344 VanDerWaalsContact NE2-CG1 3.35Å; E342-V344 PolarHBondContact O-N 3.49Å; V344-Q346 PolarHBondContact O-N 3.06Å; V344-F347 HydrophobicContact CB-CD2 4.06Å; V344-F347 HydrophobicContact CG1-CD2 4.38Å; V344-F347 PolarHBondContact O-N 2.93Å; V344-T352 HydrophobicContact CB-CG2 3.89Å; V344-T352 HydrophobicContact CG2-CG2 3.91Å
345	S	92.6	Very high	92.4	Very high	68 Å²	68	78.7 Å²	78.7	48%	0.476	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-25.1	-179.5	56.1	0	0	0	0	114.1	D343 F347	D343-S345 WeakPolarHBondContact OD1-CB 3.49Å; D343-S345 PolarHBondContact OD1-N 2.7Å; D343-S345 PolarHBondContact OD1-OG 3.38Å; S345-F347 VanDerWaalsContact C-N 3.3Å
346	Q	91.9	Very high	92.3	Very high	52 Å²	52	74.7 Å²	74.7	24%	0.243	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	10.6	176.7	-45.9	-51.6	-63.9	0	0	113.3	G143 M147 Y334 L338 V344	G143-Q346 WeakPolarHBondContact CA-O 3.5Å; M147-Q346 WeakPolarHBondContact CE-O 3.3Å; Y334-Q346 PolarHBondContact OH-OE1 3.42Å; L338-Q346 HydrophobicContact CD2-CG 3.76Å; V344-Q346 PolarHBondContact O-N 3.06Å
347	F	91.5	Very high	92.1	Very high	15 Å²	15	77.8 Å²	77.8	7%	0.066	39%	0.389	C	S	.	.	S	Bend	trans	-113	149.4	174.5	-66.4	-95.7	0	0	0	111.7	L62 L140 M190 V344 S345 T349 T352	L62-F347 HydrophobicContact CB-CD1 4.03Å; L62-F347 HydrophobicContact CB-CE1 4.02Å; L62-F347 HydrophobicContact CD1-CE1 4.1Å; L62-F347 HydrophobicContact CD1-CZ 4.07Å; L62-F347 HydrophobicContact CD2-CD1 3.88Å; L62-F347 HydrophobicContact CD2-CD2 3.84Å; L62-F347 HydrophobicContact CD2-CE1 3.9Å; L62-F347 HydrophobicContact CD2-CE2 3.85Å; L62-F347 HydrophobicContact CD2-CG 3.85Å; L62-F347 HydrophobicContact CD2-CZ 3.89Å; L62-F347 HydrophobicContact CG-CD1 4.43Å; L62-F347 HydrophobicContact CG-CE1 4.22Å; L62-F347 HydrophobicContact CG-CZ 4.44Å; L140-F347 WeakPolarHBondContact O-CZ 3.34Å; M190-F347 HydrophobicContact CE-CE1 3.66Å; M190-F347 HydrophobicContact CE-CZ 3.96Å; V344-F347 HydrophobicContact CB-CD2 4.06Å; V344-F347 HydrophobicContact CG1-CD2 4.38Å; V344-F347 PolarHBondContact O-N 2.93Å; S345-F347 VanDerWaalsContact C-N 3.3Å; F347-T349 PolarHBondContact O-N 3.34Å; F347-T352 HydrophobicContact CB-CG2 3.67Å
348	D	90.9	Very high	91.8	Very high	49 Å²	49	72.6 Å²	72.6	26%	0.262	37%	0.366	S	S	.	.			trans	-59.5	122.2	-177.7	-173.4	-26.5	0	0	0	112.5	R350 F351 T352	D348-R350 HydrophobicContact CB-CG 4.49Å; D348-R350 PolarHBondContact O-N 3.19Å; D348-R350 WeakPolarHBondContact OD1-CB 3.34Å; D348-R350 VanDerWaalsContact OD1-CG 3.31Å; D348-R350 WeakPolarHBondContact OD1-CG 3.37Å; D348-R350 PolarHBondContact OD1-N 3.48Å; D348-R350 IonicContact OD1-NE 3.73Å; D348-R350 WeakPolarHBondContact OD2-CD 3.12Å; D348-R350 IonicContact OD2-CZ 3.61Å; D348-R350 IonicContact OD2-NE 2.77Å; D348-R350 PolarHBondContact OD2-NE 2.98Å; D348-R350 IonicContact OD2-NH2 3.57Å; D348-R350 PolarHBondContact OD2-NH2 2.82Å; D348-F351 HydrophobicContact CB-CD2 3.96Å; D348-F351 HydrophobicContact CB-CE2 4.31Å; D348-F351 PolarHBondContact O-N 3.32Å; D348-T352 PolarHBondContact O-N 2.87Å
349	T	92.1	Very high	91.2	Very high	76 Å²	76	73.9 Å²	73.9	47%	0.466	38%	0.378	S	S	.	.	H	α-helix	trans	-61.2	-15.6	-178.3	68.8	0	0	0	0	114.7	F347 F351 T352 R353	F347-T349 PolarHBondContact O-N 3.34Å; T349-F351 PolarHBondContact O-N 3.36Å; T349-T352 WeakPolarHBondContact CA-OG1 3.32Å; T349-R353 WeakPolarHBondContact O-CB 3.47Å; T349-R353 WeakPolarHBondContact O-CD 3.28Å; T349-R353 VanDerWaalsContact O-CG 3.26Å; T349-R353 WeakPolarHBondContact O-CG 3.43Å; T349-R353 PolarHBondContact O-N 3.22Å
350	R	92.8	Very high	90.5	Very high	161 Å²	161	70.1 Å²	70.1	61%	0.608	37%	0.369	S	S	*	.	H	α-helix	trans	-67.2	-21.7	170	84.5	-172.1	149.7	174.2	-19.1	112.6	D348 Q354	D348-R350 HydrophobicContact CB-CG 4.49Å; D348-R350 PolarHBondContact O-N 3.19Å; D348-R350 WeakPolarHBondContact OD1-CB 3.34Å; D348-R350 VanDerWaalsContact OD1-CG 3.31Å; D348-R350 WeakPolarHBondContact OD1-CG 3.37Å; D348-R350 PolarHBondContact OD1-N 3.48Å; D348-R350 IonicContact OD1-NE 3.73Å; D348-R350 WeakPolarHBondContact OD2-CD 3.12Å; D348-R350 IonicContact OD2-CZ 3.61Å; D348-R350 IonicContact OD2-NE 2.77Å; D348-R350 PolarHBondContact OD2-NE 2.98Å; D348-R350 IonicContact OD2-NH2 3.57Å; D348-R350 PolarHBondContact OD2-NH2 2.82Å; R350-Q354 PolarHBondContact O-NE2 3.17Å
351	F	93.2	Very high	89.6	Confident	28 Å²	28	68.8 Å²	68.8	12%	0.123	36%	0.357	C	S	.	.	H	α-helix	trans	-98.4	-52.5	175.7	-56.9	-51	0	0	0	111.2	V61 L62 K64 D348 T349 R353 Q354	V61-F351 HydrophobicContact CG1-CB 4.46Å; V61-F351 CarbonylContact O-C 3.11Å; V61-F351 WeakPolarHBondContact O-CB 3.18Å; L62-F351 WeakPolarHBondContact O-CD2 3.47Å; K64-F351 HydrophobicContact CB-CD1 4.22Å; K64-F351 HydrophobicContact CB-CE1 3.81Å; D348-F351 HydrophobicContact CB-CD2 3.96Å; D348-F351 HydrophobicContact CB-CE2 4.31Å; D348-F351 PolarHBondContact O-N 3.32Å; T349-F351 PolarHBondContact O-N 3.36Å; F351-R353 PolarHBondContact O-N 3.34Å; F351-Q354 VanDerWaalsContact O-CB 3.29Å; F351-Q354 WeakPolarHBondContact O-CB 3.33Å; F351-Q354 WeakPolarHBondContact O-CG 3.46Å; F351-Q354 PolarHBondContact O-N 3.24Å
352	T	93.7	Very high	88.6	Confident	33 Å²	33	70.1 Å²	70.1	20%	0.202	37%	0.369	C	S	.	.	H	α-helix	trans	-64.7	-19.5	-172.2	61.5	0	0	0	0	114.3	T60 V61 V344 F347 D348 T349	T60-T352 HydrophobicContact CG2-CG2 3.92Å; V61-T352 WeakPolarHBondContact O-CA 3.49Å; V61-T352 PolarHBondContact O-N 3.44Å; V344-T352 HydrophobicContact CB-CG2 3.89Å; V344-T352 HydrophobicContact CG2-CG2 3.91Å; F347-T352 HydrophobicContact CB-CG2 3.67Å; D348-T352 PolarHBondContact O-N 2.87Å; T349-T352 WeakPolarHBondContact CA-OG1 3.32Å
353	R	93.4	Very high	87.8	Confident	206 Å²	206	69.7 Å²	69.7	78%	0.777	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-1.3	172.5	-64.5	177	176.8	-179.2	1.4	114.6	T349 F351	T349-R353 WeakPolarHBondContact O-CB 3.47Å; T349-R353 WeakPolarHBondContact O-CD 3.28Å; T349-R353 VanDerWaalsContact O-CG 3.26Å; T349-R353 WeakPolarHBondContact O-CG 3.43Å; T349-R353 PolarHBondContact O-N 3.22Å; F351-R353 PolarHBondContact O-N 3.34Å
354	Q	93.3	Very high	86.9	Confident	67 Å²	67	80.1 Å²	80.1	31%	0.313	41%	0.409	S	S	.	.	S	Bend	trans	-84.3	138.6	175.6	-61.3	179.5	33.1	0	0	110.5	V61 R350 F351	V61-Q354 HydrophobicContact CB-CB 4.24Å; V61-Q354 HydrophobicContact CG2-CB 4.01Å; R350-Q354 PolarHBondContact O-NE2 3.17Å; F351-Q354 VanDerWaalsContact O-CB 3.29Å; F351-Q354 WeakPolarHBondContact O-CB 3.33Å; F351-Q354 WeakPolarHBondContact O-CG 3.46Å; F351-Q354 PolarHBondContact O-N 3.24Å
355	T	90.8	Very high	86.3	Confident	109 Å²	109	80.2 Å²	80.2	67%	0.669	41%	0.409	S	S	*	.			trans	-55.9	130.2	174.5	-36.6	0	0	0	0	110.4	V357	T355-V357 HydrophobicContact CG2-CG2 3.79Å; T355-V357 PolarHBondContact O-N 3.35Å
356	P	91.5	Very high	85.8	Confident	40 Å²	40	80.1 Å²	80.1	26%	0.26	41%	0.408	S	S	.	.			trans	-76.6	56.6	-173.8	34.9	-41.1	0	0	0	112.7	L58 L59	L58-P356 HydrophobicContact CB-CB 4.22Å; L58-P356 WeakPolarHBondContact CB-O 3.43Å; L58-P356 VanDerWaalsContact CD1-O 3.26Å; L58-P356 WeakPolarHBondContact CD1-O 3.4Å; L59-P356 WeakPolarHBondContact O-CB 3.25Å; L59-P356 WeakPolarHBondContact O-CG 3.39Å
357	V	88.3	Confident	85.3	Confident	72 Å²	72	83.8 Å²	83.8	44%	0.436	43%	0.425	S	S	.	.			trans	-99.1	120.6	179.8	-171.5	0	0	0	0	110.5	K69 T355 S359	K69-V357 PolarHBondContact NZ-O 3.43Å; T355-V357 HydrophobicContact CG2-CG2 3.79Å; T355-V357 PolarHBondContact O-N 3.35Å; V357-S359 PolarHBondContact O-N 3.49Å
358	D	84.4	Confident	84.8	Confident	38 Å²	38	87.2 Å²	87.2	20%	0.203	45%	0.45	C	S	.	.			trans	-81.9	93	159.5	-177.9	24.2	0	0	0	109.3	L58 F71 K132 Y134	L58-D358 HydrophobicContact CD1-CB 3.75Å; F71-D358 HydrophobicContact CE2-CB 4.26Å; F71-D358 HydrophobicContact CZ-CB 3.99Å; K132-D358 IonicContact NZ-OD1 2.66Å; K132-D358 PolarHBondContact NZ-OD1 3.4Å; K132-D358 IonicContact NZ-OD2 3.28Å; K132-D358 PolarHBondContact NZ-OD2 3.49Å; Y134-D358 PolarHBondContact OH-OD2 2.76Å
359	S	80.4	Confident	84.2	Confident	60 Å²	60	85.4 Å²	85.4	42%	0.42	44%	0.442	S	S	.	.			trans	-56.6	140.4	-176.3	-48.9	0	0	0	0	111.8	K132 V357	K132-S359 WeakPolarHBondContact CE-O 3.48Å; K132-S359 PolarHBondContact NZ-O 3.42Å; V357-S359 PolarHBondContact O-N 3.49Å
360	P	75.9	Confident	83.7	Confident	99 Å²	99	85.4 Å²	85.4	64%	0.643	44%	0.437	S	S	*	.			trans	-48.2	157	172.4	-30.3	36.7	0	0	0	113.7	K91	K91-P360 PolarHBondContact NZ-O 2.83Å
361	D	74	Confident	83.3	Confident	29 Å²	29	82.4 Å²	82.4	16%	0.155	43%	0.432	C	S	.	.			trans	-145.4	81.6	177.7	-155.1	-21.4	0	0	0	110.4	K91 K132 T363	K91-D361 VanDerWaalsContact CD-OD2 3.23Å; K91-D361 WeakPolarHBondContact CD-OD2 3.47Å; K91-D361 WeakPolarHBondContact CE-OD2 3.39Å; K91-D361 VanDerWaalsContact CG-OD2 3.24Å; K91-D361 WeakPolarHBondContact CG-OD2 3.4Å; K91-D361 IonicContact NZ-OD1 2.72Å; K91-D361 IonicContact NZ-OD2 2.65Å; K91-D361 PolarHBondContact NZ-OD2 3.19Å; K132-D361 HydrophobicContact CG-CB 4.27Å; D361-T363 PolarHBondContact O-N 3.28Å; D361-T363 VanDerWaalsContact O-N 3.13Å; D361-T363 VanDerWaalsContact OD1-CB 3.24Å; D361-T363 WeakPolarHBondContact OD1-CB 3.41Å; D361-T363 PolarHBondContact OD1-N 3.08Å; D361-T363 PolarHBondContact OD1-OG1 3.06Å
362	D	69.3	Low	82.9	Confident	148 Å²	148	81.9 Å²	81.9	79%	0.791	43%	0.434	S	S	*	.			trans	-76.8	11.9	-179.6	-43.6	-64.4	0	0	0	112.4	R364	D362-R364 PolarHBondContact O-N 2.68Å
363	T	75.8	Confident	82.7	Confident	67 Å²	67	80.4 Å²	80.4	41%	0.411	42%	0.424	S	S	.	.			trans	-69.1	97.5	179.4	-47.7	0	0	0	0	110.3	A93 D361 L365	A93-T363 HydrophobicContact CB-CG2 3.67Å; D361-T363 PolarHBondContact O-N 3.28Å; D361-T363 VanDerWaalsContact O-N 3.13Å; D361-T363 VanDerWaalsContact OD1-CB 3.24Å; D361-T363 WeakPolarHBondContact OD1-CB 3.41Å; D361-T363 PolarHBondContact OD1-N 3.08Å; D361-T363 PolarHBondContact OD1-OG1 3.06Å; T363-L365 PolarHBondContact O-N 3.04Å
364	R	75.4	Confident	82.3	Confident	238 Å²	238	74 Å²	74	90%	0.898	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-58.9	131.2	163.9	-72.9	-173.5	168.1	-159.3	-6.5	109.8	D362	D362-R364 PolarHBondContact O-N 2.68Å
365	L	80.6	Confident	81.9	Confident	30 Å²	30	74 Å²	74	16%	0.157	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-98.1	168.1	177.7	-63.9	172.7	0	0	0	109.8	K92 A93 V96 G130 T363 A369 E370	K92-L365 HydrophobicContact CB-CD1 3.65Å; K92-L365 HydrophobicContact CD-CD1 3.56Å; K92-L365 HydrophobicContact CG-CD1 4.28Å; A93-L365 HydrophobicContact CB-CD2 4.02Å; V96-L365 HydrophobicContact CG2-CD2 4.41Å; G130-L365 WeakPolarHBondContact O-CD1 3.43Å; T363-L365 PolarHBondContact O-N 3.04Å; L365-A369 HydrophobicContact CB-CB 4.2Å; L365-E370 HydrophobicContact CB-CG 3.85Å; L365-E370 HydrophobicContact CD1-CG 4.12Å
366	S	81.7	Confident	81.9	Confident	66 Å²	66	69 Å²	69	46%	0.462	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-74.8	150.1	162.3	60.5	0	0	0	0	109.6	S368 A369 E370	S366-S368 PolarHBondContact O-N 2.83Å; S366-S368 VanDerWaalsContact O-N 3.15Å; S366-S368 PolarHBondContact OG-OG 3.34Å; S366-A369 WeakPolarHBondContact O-CA 3.18Å; S366-A369 WeakPolarHBondContact O-CB 3.03Å; S366-A369 PolarHBondContact O-N 3Å; S366-A369 WeakPolarHBondContact OG-CB 3.18Å; S366-A369 PolarHBondContact OG-N 3.12Å; S366-E370 PolarHBondContact O-N 3.26Å; S366-E370 VanDerWaalsContact O-N 3.15Å
367	H	81.8	Confident	81.8	Confident	129 Å²	129	71 Å²	71	60%	0.597	42%	0.417	S	S	*	.	H	α-helix	trans	-53.8	-37.6	176.2	-173.1	59.9	0	0	0	112.3	A369 E370 L371	H367-A369 VanDerWaalsContact C-N 3.31Å; H367-A369 PolarHBondContact O-N 3.19Å; H367-E370 PolarHBondContact O-N 2.8Å; H367-E370 VanDerWaalsContact O-N 3.12Å; H367-L371 WeakPolarHBondContact O-CG 3.45Å; H367-L371 PolarHBondContact O-N 3.23Å
368	S	81.1	Confident	81.9	Confident	86 Å²	86	68.8 Å²	68.8	60%	0.601	40%	0.402	S	S	*	.	H	α-helix	trans	-60	-33.6	172.6	53.7	0	0	0	0	114.5	S366 A372	S366-S368 PolarHBondContact O-N 2.83Å; S366-S368 VanDerWaalsContact O-N 3.15Å; S366-S368 PolarHBondContact OG-OG 3.34Å; S368-A372 PolarHBondContact O-N 3.48Å
369	A	79.4	Confident	82.1	Confident	11 Å²	11	69.5 Å²	69.5	9%	0.091	41%	0.408	C	S	.	.	H	α-helix	trans	-81.6	-16.4	176.8	0	0	0	0	0	113	V96 L365 S366 H367 F373	V96-A369 HydrophobicContact CB-CB 4.17Å; V96-A369 HydrophobicContact CG1-CB 4.02Å; V96-A369 HydrophobicContact CG2-CB 4.08Å; L365-A369 HydrophobicContact CB-CB 4.2Å; S366-A369 WeakPolarHBondContact O-CA 3.18Å; S366-A369 WeakPolarHBondContact O-CB 3.03Å; S366-A369 PolarHBondContact O-N 3Å; S366-A369 WeakPolarHBondContact OG-CB 3.18Å; S366-A369 PolarHBondContact OG-N 3.12Å; H367-A369 VanDerWaalsContact C-N 3.31Å; H367-A369 PolarHBondContact O-N 3.19Å; A369-F373 WeakPolarHBondContact O-CD2 3.34Å
370	E	81.5	Confident	82.4	Confident	77 Å²	77	66.9 Å²	66.9	36%	0.36	39%	0.39	S	S	.	.	H	α-helix	trans	-85.6	-47	171.7	-64.5	175.9	153.1	0	0	110.7	L365 S366 H367 A372 F373	L365-E370 HydrophobicContact CB-CG 3.85Å; L365-E370 HydrophobicContact CD1-CG 4.12Å; S366-E370 PolarHBondContact O-N 3.26Å; S366-E370 VanDerWaalsContact O-N 3.15Å; H367-E370 PolarHBondContact O-N 2.8Å; H367-E370 VanDerWaalsContact O-N 3.12Å; E370-A372 PolarHBondContact O-N 2.89Å; E370-A372 VanDerWaalsContact O-N 3.17Å; E370-F373 PolarHBondContact O-N 3.2Å
371	L	84.6	Confident	82.9	Confident	97 Å²	97	66.3 Å²	66.3	51%	0.508	39%	0.386	S	S	.	.	H	α-helix	trans	-55.9	-28.8	171	-70.1	176.3	0	0	0	112.6	H367 F373 A374	H367-L371 WeakPolarHBondContact O-CG 3.45Å; H367-L371 PolarHBondContact O-N 3.23Å; L371-F373 PolarHBondContact O-N 3.14Å; L371-A374 WeakPolarHBondContact O-CB 3.23Å; L371-A374 PolarHBondContact O-N 2.92Å
372	A	84.7	Confident	83.4	Confident	18 Å²	18	66.3 Å²	66.3	15%	0.149	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-19.9	172.7	0	0	0	0	0	114	T102 R106 S368 E370	T102-A372 HydrophobicContact CG2-CB 4.07Å; R106-A372 PolarHBondContact NE-O 2.74Å; R106-A372 PolarHBondContact NH2-O 3.38Å; S368-A372 PolarHBondContact O-N 3.48Å; E370-A372 PolarHBondContact O-N 2.89Å; E370-A372 VanDerWaalsContact O-N 3.17Å
373	F	88.2	Confident	84.1	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.009	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.3	24.5	175.4	-51	-71.9	0	0	0	113.1	K92 I95 V96 T102 T105 Q128 L133 A369 E370 L371 F376	K92-F373 HydrophobicContact CB-CE2 4.17Å; K92-F373 HydrophobicContact CD-CD2 4.01Å; K92-F373 HydrophobicContact CD-CE2 4.35Å; K92-F373 HydrophobicContact CG-CD2 3.96Å; K92-F373 HydrophobicContact CG-CE2 3.87Å; I95-F373 HydrophobicContact CB-CZ 4.34Å; I95-F373 HydrophobicContact CG2-CE1 4.38Å; I95-F373 HydrophobicContact CG2-CZ 3.82Å; V96-F373 HydrophobicContact CG1-CE2 3.54Å; V96-F373 HydrophobicContact CG1-CZ 3.95Å; T102-F373 HydrophobicContact CG2-CE1 4.14Å; T102-F373 HydrophobicContact CG2-CZ 3.97Å; T105-F373 HydrophobicContact CG2-CE1 4.47Å; Q128-F373 PolarHBondContact NE2-O 3.39Å; L133-F373 HydrophobicContact CD1-CD1 3.63Å; L133-F373 HydrophobicContact CD1-CD2 4.49Å; L133-F373 HydrophobicContact CD1-CE1 3.65Å; L133-F373 HydrophobicContact CD1-CE2 4.49Å; L133-F373 HydrophobicContact CD1-CG 4.08Å; L133-F373 HydrophobicContact CD1-CZ 4.09Å; L133-F373 HydrophobicContact CD2-CB 3.94Å; L133-F373 HydrophobicContact CD2-CD1 4.21Å; L133-F373 HydrophobicContact CD2-CD2 4.38Å; L133-F373 HydrophobicContact CD2-CG 3.91Å; A369-F373 WeakPolarHBondContact O-CD2 3.34Å; E370-F373 PolarHBondContact O-N 3.2Å; L371-F373 PolarHBondContact O-N 3.14Å; F373-F376 HydrophobicContact CB-CB 4.4Å; F373-F376 VanDerWaalsContact O-CB 3.32Å; F373-F376 WeakPolarHBondContact O-CB 3.04Å; F373-F376 PolarHBondContact O-N 2.91Å
374	A	86.1	Confident	84.4	Confident	70 Å²	70	59.9 Å²	59.9	58%	0.579	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	142.3	164.7	0	0	0	0	0	110.2	L371 F376	L371-A374 WeakPolarHBondContact O-CB 3.23Å; L371-A374 PolarHBondContact O-N 2.92Å; A374-F376 VanDerWaalsContact C-N 3.29Å; A374-F376 PolarHBondContact O-N 2.89Å
375	G	85.5	Confident	84.7	Confident	69 Å²	69	53.8 Å²	53.8	71%	0.711	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	9.7	-177.8	0	0	0	0	0	116.2	S377	G375-S377 VanDerWaalsContact C-N 3.28Å; G375-S377 PolarHBondContact O-N 2.9Å
376	F	89.1	Confident	84.4	Confident	4 Å²	4	54.3 Å²	54.3	2%	0.018	34%	0.339	C	S	.	.			trans	-68.4	-20.9	-178.8	-170.3	-92.2	0	0	0	114.7	R109 A126 F127 Q128 L133 L135 F373 A374	R109-F376 HydrophobicContact CB-CD2 4.34Å; R109-F376 HydrophobicContact CB-CE2 3.85Å; R109-F376 HydrophobicContact CB-CZ 4.47Å; R109-F376 HydrophobicContact CG-CD2 4.12Å; R109-F376 HydrophobicContact CG-CE2 3.88Å; R109-F376 HydrophobicContact CG-CZ 4.28Å; A126-F376 HydrophobicContact CB-CD1 4.24Å; A126-F376 HydrophobicContact CB-CE1 3.95Å; A126-F376 WeakPolarHBondContact CB-O 3.36Å; F127-F376 WeakPolarHBondContact O-CE1 3.42Å; Q128-F376 HydrophobicContact CB-CD1 4.39Å; L133-F376 HydrophobicContact CB-CE1 3.84Å; L133-F376 HydrophobicContact CB-CE2 4.41Å; L133-F376 HydrophobicContact CB-CZ 3.77Å; L133-F376 HydrophobicContact CD1-CD2 4.43Å; L133-F376 HydrophobicContact CD1-CE2 4.01Å; L133-F376 HydrophobicContact CD1-CZ 4.21Å; L133-F376 HydrophobicContact CD2-CD1 3.92Å; L133-F376 HydrophobicContact CD2-CD2 4.16Å; L133-F376 HydrophobicContact CD2-CE1 4.07Å; L133-F376 HydrophobicContact CD2-CE2 4.31Å; L133-F376 HydrophobicContact CD2-CG 3.97Å; L133-F376 HydrophobicContact CD2-CZ 4.26Å; L133-F376 HydrophobicContact CG-CE1 4.44Å; L133-F376 HydrophobicContact CG-CE2 4.47Å; L133-F376 HydrophobicContact CG-CZ 4.3Å; L135-F376 HydrophobicContact CD2-CE1 4.1Å; L135-F376 HydrophobicContact CD2-CE2 4.42Å; L135-F376 HydrophobicContact CD2-CZ 3.59Å; L135-F376 HydrophobicContact CG-CZ 4.01Å; F373-F376 HydrophobicContact CB-CB 4.4Å; F373-F376 VanDerWaalsContact O-CB 3.32Å; F373-F376 WeakPolarHBondContact O-CB 3.04Å; F373-F376 PolarHBondContact O-N 2.91Å; A374-F376 VanDerWaalsContact C-N 3.29Å; A374-F376 PolarHBondContact O-N 2.89Å
377	S	89.3	Confident	83.9	Confident	81 Å²	81	53.9 Å²	53.9	57%	0.566	33%	0.331	S	S	*	.			trans	-75.2	132.1	-175.7	-57	0	0	0	0	112.3	A126 G375	A126-S377 CarbonylContact O-C 3.56Å; A126-S377 VanDerWaalsContact O-CA 3.29Å; A126-S377 WeakPolarHBondContact O-CA 3.38Å; G375-S377 VanDerWaalsContact C-N 3.28Å; G375-S377 PolarHBondContact O-N 2.9Å
378	F	91.1	Very high	83.2	Confident	26 Å²	26	55.2 Å²	55.2	11%	0.114	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	147.9	-173.3	169.4	-101.9	0	0	0	111.5	E113 L123 Y125 A126 A380	E113-F378 HydrophobicContact CB-CD2 4.42Å; E113-F378 HydrophobicContact CB-CE2 4.03Å; E113-F378 HydrophobicContact CB-CZ 4.2Å; E113-F378 HydrophobicContact CG-CD2 4.09Å; E113-F378 HydrophobicContact CG-CE2 3.55Å; E113-F378 HydrophobicContact CG-CZ 4.1Å; E113-F378 VanDerWaalsContact OE1-CD2 3.31Å; E113-F378 WeakPolarHBondContact OE1-CD2 3.23Å; E113-F378 VanDerWaalsContact OE1-CE2 3.3Å; E113-F378 WeakPolarHBondContact OE1-CE2 3.47Å; L123-F378 HydrophobicContact CD2-CD1 3.9Å; L123-F378 HydrophobicContact CD2-CE1 4.05Å; L123-F378 HydrophobicContact CG-CD1 4.06Å; L123-F378 HydrophobicContact CG-CE1 4.03Å; Y125-F378 CarbonylContact C-O 3.55Å; Y125-F378 WeakPolarHBondContact CA-O 3.13Å; A126-F378 HydrophobicContact CB-CB 3.96Å; A126-F378 PolarHBondContact N-O 2.95Å; A126-F378 PolarHBondContact O-N 2.64Å; F378-A380 HydrophobicContact CE1-CB 3.93Å; F378-A380 HydrophobicContact CZ-CB 4.06Å
379	V	89.1	Confident	82.2	Confident	53 Å²	53	57.5 Å²	57.5	32%	0.321	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	126.2	169.6	-177.9	0	0	0	0	107.9	Y125 V383 L384	Y125-V379 HydrophobicContact CD1-CG1 4.06Å; Y125-V379 HydrophobicContact CD1-CG2 4.27Å; Y125-V379 HydrophobicContact CE1-CG1 4.13Å; V379-V383 HydrophobicContact CG1-CB 3.96Å; V379-V383 HydrophobicContact CG1-CG1 3.97Å; V379-L384 HydrophobicContact CB-CD2 4.47Å; V379-L384 HydrophobicContact CG1-CD2 3.87Å; V379-L384 HydrophobicContact CG1-CG 4.17Å
380	A	87.3	Confident	81.1	Confident	5 Å²	5	60.1 Å²	60.1	4%	0.041	37%	0.365	C	S	.	.			trans	-67.2	143.3	-172.7	0	0	0	0	0	112.8	L123 L124 F378 S382 V383 L384	L123-A380 WeakPolarHBondContact O-CB 3.3Å; L124-A380 HydrophobicContact CD1-CB 4.38Å; L124-A380 WeakPolarHBondContact O-CB 3.16Å; L124-A380 PolarHBondContact O-N 3.32Å; F378-A380 HydrophobicContact CE1-CB 3.93Å; F378-A380 HydrophobicContact CZ-CB 4.06Å; A380-S382 PolarHBondContact O-N 3.49Å; A380-S382 VanDerWaalsContact O-N 3.1Å; A380-V383 HydrophobicContact CB-CG2 4.31Å; A380-V383 WeakPolarHBondContact O-CB 2.96Å; A380-V383 PolarHBondContact O-N 3.36Å; A380-L384 PolarHBondContact O-N 3Å
381	P	86.4	Confident	79.5	Confident	86 Å²	86	64.3 Å²	64.3	56%	0.558	38%	0.382	S	S	*	.	H	α-helix	trans	-53.6	-33.4	177.3	-29.3	36	0	0	0	114.1	V383 L384 E385	P381-V383 VanDerWaalsContact C-N 3.32Å; P381-V383 PolarHBondContact O-N 3.46Å; P381-L384 CarbonylContact O-C 3.43Å; P381-L384 PolarHBondContact O-N 3.33Å; P381-E385 VanDerWaalsContact O-CB 3.31Å; P381-E385 WeakPolarHBondContact O-CB 3.47Å; P381-E385 PolarHBondContact O-N 2.94Å
382	S	83.4	Confident	77.4	Confident	30 Å²	30	64.2 Å²	64.2	21%	0.21	39%	0.39	C	S	.	.	H	α-helix	trans	-65.5	-29.5	176	51.8	0	0	0	0	113.8	A380 S386	A380-S382 PolarHBondContact O-N 3.49Å; A380-S382 VanDerWaalsContact O-N 3.1Å; S382-S386 PolarHBondContact O-N 3.27Å; S382-S386 VanDerWaalsContact O-N 3.14Å; S382-S386 PolarHBondContact O-OG 2.8Å
383	V	83.1	Confident	75.4	Confident	2 Å²	2	72.3 Å²	72.3	1%	0.012	42%	0.422	C	S	.	.	H	α-helix	trans	-71.2	-47.3	171.2	179.7	0	0	0	0	109.4	L124 Y125 V379 A380 P381 E385 S386 L387	L124-V383 HydrophobicContact CB-CG2 4.27Å; Y125-V383 HydrophobicContact CE1-CG1 3.79Å; Y125-V383 HydrophobicContact CE1-CG2 4.17Å; Y125-V383 HydrophobicContact CE2-CG2 4.22Å; Y125-V383 WeakPolarHBondContact OH-CG1 3.42Å; V379-V383 HydrophobicContact CG1-CB 3.96Å; V379-V383 HydrophobicContact CG1-CG1 3.97Å; A380-V383 HydrophobicContact CB-CG2 4.31Å; A380-V383 WeakPolarHBondContact O-CB 2.96Å; A380-V383 PolarHBondContact O-N 3.36Å; P381-V383 VanDerWaalsContact C-N 3.32Å; P381-V383 PolarHBondContact O-N 3.46Å; V383-E385 PolarHBondContact O-N 3.41Å; V383-S386 PolarHBondContact O-N 3.26Å; V383-S386 PolarHBondContact O-OG 3.48Å; V383-L387 PolarHBondContact O-N 2.94Å
384	L	82.3	Confident	73.2	Confident	78 Å²	78	80 Å²	80	41%	0.408	46%	0.458	S	S	.	.	H	α-helix	trans	-64.5	-25.2	178.6	-56.8	178.3	0	0	0	113.1	V379 A380 P381 L387 K388	V379-L384 HydrophobicContact CB-CD2 4.47Å; V379-L384 HydrophobicContact CG1-CD2 3.87Å; V379-L384 HydrophobicContact CG1-CG 4.17Å; A380-L384 PolarHBondContact O-N 3Å; P381-L384 CarbonylContact O-C 3.43Å; P381-L384 PolarHBondContact O-N 3.33Å; L384-L387 HydrophobicContact CD2-CD1 4.24Å; L384-K388 WeakPolarHBondContact O-CG 3.2Å
385	E	82.1	Confident	70.9	Confident	109 Å²	109	81.8 Å²	81.8	51%	0.509	46%	0.463	S	S	.	.	H	α-helix	trans	-75.8	-49.8	172.6	-171.8	160.8	-128.3	0	0	111.2	P381 V383 L387 K388 E389	P381-E385 VanDerWaalsContact O-CB 3.31Å; P381-E385 WeakPolarHBondContact O-CB 3.47Å; P381-E385 PolarHBondContact O-N 2.94Å; V383-E385 PolarHBondContact O-N 3.41Å; E385-L387 PolarHBondContact O-N 3.5Å; E385-L387 VanDerWaalsContact O-N 3.16Å; E385-K388 WeakPolarHBondContact O-CA 3.44Å; E385-K388 WeakPolarHBondContact O-CB 3.36Å; E385-K388 PolarHBondContact O-N 3.22Å; E385-E389 PolarHBondContact O-N 3.02Å; E385-E389 VanDerWaalsContact O-N 3.07Å
386	S	75.3	Confident	68.7	Low	41 Å²	41	89.3 Å²	89.3	29%	0.287	47%	0.47	S	S	.	.	H	α-helix	trans	-59.8	-27.6	175	69	0	0	0	0	113.6	S382 V383 G390	S382-S386 PolarHBondContact O-N 3.27Å; S382-S386 VanDerWaalsContact O-N 3.14Å; S382-S386 PolarHBondContact O-OG 2.8Å; V383-S386 PolarHBondContact O-N 3.26Å; V383-S386 PolarHBondContact O-OG 3.48Å; S386-G390 PolarHBondContact O-N 3.04Å
387	L	71.3	Confident	66.5	Low	58 Å²	58	93.9 Å²	93.9	30%	0.304	50%	0.502	S	S	.	.	H	α-helix	trans	-61.1	-48.9	168.2	-99.6	163.5	0	0	0	112	P79 V383 L384 E385 G390 F391	P79-L387 HydrophobicContact CB-CG 4.26Å; P79-L387 HydrophobicContact CG-CD1 3.94Å; P79-L387 HydrophobicContact CG-CD2 3.54Å; P79-L387 HydrophobicContact CG-CG 3.54Å; V383-L387 PolarHBondContact O-N 2.94Å; L384-L387 HydrophobicContact CD2-CD1 4.24Å; E385-L387 PolarHBondContact O-N 3.5Å; E385-L387 VanDerWaalsContact O-N 3.16Å; L387-G390 PolarHBondContact O-N 3.12Å; L387-F391 HydrophobicContact CD2-CE2 4.26Å; L387-F391 WeakPolarHBondContact O-CD2 3.08Å; L387-F391 PolarHBondContact O-N 3.25Å
388	K	66.6	Low	64	Low	156 Å²	156	101.2 Å²	101.2	68%	0.678	52%	0.518	S	S	*	.	H	α-helix	trans	-67	-38.2	-178.4	-67.4	167.6	-174.2	175.3	0	112.1	L384 E385 G390 F391	L384-K388 WeakPolarHBondContact O-CG 3.2Å; E385-K388 WeakPolarHBondContact O-CA 3.44Å; E385-K388 WeakPolarHBondContact O-CB 3.36Å; E385-K388 PolarHBondContact O-N 3.22Å; K388-G390 VanDerWaalsContact C-N 3.28Å; K388-G390 PolarHBondContact O-N 3.22Å; K388-F391 CarbonylContact O-C 3.59Å; K388-F391 WeakPolarHBondContact O-CA 3.36Å; K388-F391 PolarHBondContact O-N 3.4Å
389	E	60.5	Low	61.7	Low	134 Å²	134	108.4 Å²	108.4	63%	0.626	55%	0.552	S	S	*	*	H	α-helix	trans	-59.9	-39.3	174.7	-66.2	-178.5	144	0	0	111.5	E385 F391 S392	E385-E389 PolarHBondContact O-N 3.02Å; E385-E389 VanDerWaalsContact O-N 3.07Å; E389-F391 PolarHBondContact O-N 2.81Å; E389-S392 VanDerWaalsContact O-CB 3.27Å; E389-S392 WeakPolarHBondContact O-CB 3.31Å; E389-S392 PolarHBondContact O-N 2.8Å; E389-S392 VanDerWaalsContact O-N 3.09Å; E389-S392 PolarHBondContact O-OG 2.72Å
390	G	55.1	Low	59.5	Low	67 Å²	67	112.3 Å²	112.3	69%	0.691	58%	0.575	S	S	*	*	H	α-helix	trans	-63.5	-18	173	0	0	0	0	0	115	S386 L387 K388	S386-G390 PolarHBondContact O-N 3.04Å; L387-G390 PolarHBondContact O-N 3.12Å; K388-G390 VanDerWaalsContact C-N 3.28Å; K388-G390 PolarHBondContact O-N 3.22Å
391	F	48.7	Very low	57.2	Low	165 Å²	165	123.2 Å²	123.2	72%	0.724	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	16.4	174.2	-70.8	-69	0	0	0	113.6	L387 K388 E389 F393	L387-F391 HydrophobicContact CD2-CE2 4.26Å; L387-F391 WeakPolarHBondContact O-CD2 3.08Å; L387-F391 PolarHBondContact O-N 3.25Å; K388-F391 CarbonylContact O-C 3.59Å; K388-F391 WeakPolarHBondContact O-CA 3.36Å; K388-F391 PolarHBondContact O-N 3.4Å; E389-F391 PolarHBondContact O-N 2.81Å; F391-F393 VanDerWaalsContact C-N 3.29Å; F391-F393 PolarHBondContact O-N 3Å
392	S	40.9	Very low	54.9	Low	95 Å²	95	130.5 Å²	130.5	66%	0.664	63%	0.631	S	S	*	*			trans	-67.1	82.4	175.1	53.7	0	0	0	0	112.2	E389 E394	E389-S392 VanDerWaalsContact O-CB 3.27Å; E389-S392 WeakPolarHBondContact O-CB 3.31Å; E389-S392 PolarHBondContact O-N 2.8Å; E389-S392 VanDerWaalsContact O-N 3.09Å; E389-S392 PolarHBondContact O-OG 2.72Å; S392-E394 VanDerWaalsContact C-N 3.31Å; S392-E394 PolarHBondContact O-N 3.41Å
393	F	41.9	Very low	52.8	Low	188 Å²	188	137.9 Å²	137.9	83%	0.825	66%	0.662	S	S	*	*			trans	-75.2	81.2	-178.7	-154.3	-80.5	0	0	0	110.8	F391 P395	F391-F393 VanDerWaalsContact C-N 3.29Å; F391-F393 PolarHBondContact O-N 3Å; F393-P395 VanDerWaalsContact O-CD 3.26Å; F393-P395 WeakPolarHBondContact O-CD 3.48Å
394	E	42.8	Very low	50.5	Low	163 Å²	163	145.5 Å²	145.5	76%	0.762	70%	0.703	S	S	*	*			trans	-41	109	163.4	-100.5	-78.2	135.6	0	0	109.1	S392 R396	S392-E394 VanDerWaalsContact C-N 3.31Å; S392-E394 PolarHBondContact O-N 3.41Å; E394-R396 VanDerWaalsContact C-N 3.32Å; E394-R396 PolarHBondContact O-N 2.82Å
395	P	37.7	Very low	48.2	Very low	107 Å²	107	147.3 Å²	147.3	70%	0.695	72%	0.722	S	S	*	*			trans	-75.1	89.8	-171.1	29	-33.5	0	0	0	108.5	F393 S397	F393-P395 VanDerWaalsContact O-CD 3.26Å; F393-P395 WeakPolarHBondContact O-CD 3.48Å; P395-S397 PolarHBondContact O-N 2.57Å
396	R	38.1	Very low	46	Very low	227 Å²	227	147.8 Å²	147.8	86%	0.857	74%	0.738	S	S	*	*			trans	-47.4	98.5	-178.4	-80.2	-172.3	172.3	-175.2	-1.1	111	E394 R398	E394-R396 VanDerWaalsContact C-N 3.32Å; E394-R396 PolarHBondContact O-N 2.82Å; R396-R398 PolarHBondContact O-N 2.73Å
397	S	42.7	Very low	45	Very low	100 Å²	100	151.5 Å²	151.5	70%	0.699	76%	0.76	S	S	*	*			trans	-53.6	111.6	174.4	180	0	0	0	0	108.2	P395 H399	P395-S397 PolarHBondContact O-N 2.57Å; S397-H399 VanDerWaalsContact C-N 3.35Å; S397-H399 PolarHBondContact O-N 2.72Å
398	R	38.7	Very low	43.2	Very low	235 Å²	235	160.5 Å²	160.5	89%	0.887	79%	0.791	S	S	*	*			trans	-68.3	97	178.7	-73.7	-177.6	176.1	175.1	-0.7	107.6	R396 V400	R396-R398 PolarHBondContact O-N 2.73Å; R398-V400 PolarHBondContact O-N 2.84Å
399	H	42.1	Very low	41.7	Very low	178 Å²	178	159.6 Å²	159.6	82%	0.824	80%	0.798	S	S	*	*			trans	-48.8	115	173.1	-75.5	-68.4	0	0	0	109.6	S397 R401	S397-H399 VanDerWaalsContact C-N 3.35Å; S397-H399 PolarHBondContact O-N 2.72Å; H399-R401 PolarHBondContact O-N 3.16Å
400	V	41.8	Very low	41.4	Very low	134 Å²	134	159 Å²	159	81%	0.812	81%	0.806	S	S	*	*			trans	-59	122	179.3	177	0	0	0	0	108.2	R398 R402	R398-V400 PolarHBondContact O-N 2.84Å; V400-R402 PolarHBondContact O-N 3.28Å
401	R	39.2	Very low	40.2	Very low	235 Å²	235	163.7 Å²	163.7	89%	0.887	81%	0.814	S	S	*	*			trans	-58	101.9	174.1	-82.9	-178.4	168.2	171.9	-4	109.3	H399	H399-R401 PolarHBondContact O-N 3.16Å
402	R	39.6	Very low	39.5	Very low	238 Å²	238	161 Å²	161	90%	0.898	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-68.5	131.9	160.8	-77.2	-172.4	168.2	-171.8	-3.5	108.1	V400	V400-R402 PolarHBondContact O-N 3.28Å
403	H	38.4	Very low	40	Very low	186 Å²	186	161.7 Å²	161.7	86%	0.861	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-67.5	142	174.8	-110.6	-103.8	0	0	0	110.5
404	N	35	Very low	39.5	Very low	161 Å²	161	160.7 Å²	160.7	86%	0.861	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-72.2	135.4	171.7	-81.2	-8.8	0	0	0	110.8
405	S	34	Very low	39.3	Very low	117 Å²	117	162 Å²	162	82%	0.818	82%	0.823	S	S	*	*			trans	-134.3	133.6	156.1	57.2	0	0	0	0	109.2
406	S	36.5	Very low	38.9	Very low	119 Å²	119	166.9 Å²	166.9	83%	0.832	83%	0.833	S	S	*	*			trans	-78.5	162.3	-167.2	-95.3	0	0	0	0	114.8
407	P	52.8	Low	38.8	Very low	118 Å²	118	161 Å²	161	77%	0.766	83%	0.827	S	S	*	*			trans	-86.9	157.9	-162	34.4	-37.8	0	0	0	115.2
408	R	33.3	Very low	38.7	Very low	248 Å²	248	162.6 Å²	162.6	94%	0.936	84%	0.835	S	S	*	*			trans	-139.8	167.1	156.9	-76.8	-159.6	171.9	-154.6	-3.1	111.6
409	T	36.7	Very low	38.4	Very low	137 Å²	137	156.2 Å²	156.2	84%	0.84	83%	0.833	S	S	*	*			trans	-85.4	166.8	-159.5	28.2	0	0	0	0	115.5
410	P	52.8	Low	38	Very low	121 Å²	121	151.1 Å²	151.1	79%	0.786	83%	0.828	S	S	*	*			trans	-91.6	155.5	-163.4	36.1	-36.8	0	0	0	115.1
411	I	31.4	Very low	38.4	Very low	166 Å²	166	150 Å²	150	85%	0.851	82%	0.824	S	S	*	*			trans	-140.9	134.9	168.4	-60.8	-178.6	0	0	0	109.8
412	S	33.9	Very low	37.9	Very low	109 Å²	109	148.5 Å²	148.5	76%	0.762	82%	0.824	S	S	*	*			trans	-117.3	172.9	163.7	-55.6	0	0	0	0	107.7
413	P	51.2	Low	37.6	Very low	109 Å²	109	146.8 Å²	146.8	71%	0.708	82%	0.823	S	S	*	*			cis	-138.3	-171.1	5.8	29.5	-4.5	0	0	0	114.4
414	L	30.1	Very low	37.3	Very low	167 Å²	167	143 Å²	143	87%	0.874	82%	0.817	S	S	*	*				146.4	160.5	129.4	-77.4	172.5	0	0	0	114.9
415	K	39.3	Very low	37.2	Very low	190 Å²	190	140.2 Å²	140.2	83%	0.826	81%	0.811	S	S	*	*			trans	-96.2	161.2	-174.3	-52.7	172.3	179.9	177.3	0	111.7
416	F	29.4	Very low	37.2	Very low	209 Å²	209	142.2 Å²	142.2	92%	0.917	81%	0.809	S	S	*	*			trans	-154.4	154.8	133	-115.6	-76.7	0	0	0	112
417	S	35.4	Very low	37.1	Very low	103 Å²	103	143.3 Å²	143.3	72%	0.72	81%	0.805	S	S	*	*			trans	-139.5	148.4	173.8	-58.3	0	0	0	0	109.9
418	P	40.5	Very low	36.1	Very low	134 Å²	134	140.8 Å²	140.8	87%	0.87	80%	0.801	S	S	*	*			trans	-108.9	172.2	152.5	2.9	19.1	0	0	0	111.7
419	A	33	Very low	36.1	Very low	102 Å²	102	138.7 Å²	138.7	84%	0.843	80%	0.802	S	S	*	*			trans	-107.5	179.6	-169.8	0	0	0	0	0	114.4
420	G	33.1	Very low	36	Very low	70 Å²	70	135.7 Å²	135.7	72%	0.722	79%	0.791	S	S	*	*			trans	-76.2	-143.4	172.7	0	0	0	0	0	113.7
421	P	50.3	Low	35	Very low	112 Å²	112	136.6 Å²	136.6	73%	0.727	79%	0.79	S	S	*	*			cis	-144.5	-178	36.2	42.1	-23	0	0	0	116.4
422	F	29.8	Very low	35.1	Very low	203 Å²	203	135.4 Å²	135.4	89%	0.89	78%	0.784	S	S	*	*				-173.4	175.5	115.5	-112.2	-82.5	0	0	0	112.4
423	K	33.8	Very low	35.2	Very low	202 Å²	202	139.6 Å²	139.6	88%	0.878	79%	0.789	S	S	*	*			trans	-134.4	151	-166.4	-72.6	-177.8	172.4	-175	0	114.7
424	S	30.2	Very low	34.3	Very low	105 Å²	105	138.9 Å²	138.9	73%	0.734	79%	0.787	S	S	*	*			trans	-169.7	120.9	135.7	50.8	0	0	0	0	108.8
425	S	33.4	Very low	34.5	Very low	103 Å²	103	135.5 Å²	135.5	72%	0.72	78%	0.777	S	S	*	*				61.7	137.3	63.8	68.8	0	0	0	0	114.2
426	M	35.1	Very low	34.2	Very low	159 Å²	159	132.7 Å²	132.7	78%	0.783	78%	0.776	S	S	*	*			cis	-171.9	159.7	-3.1	-95.4	156.7	70	0	0	104.9
427	D	33.8	Very low	34.7	Very low	142 Å²	142	128 Å²	128	76%	0.759	77%	0.769	S	S	*	*			cis	-161.4	-169.8	-9.7	-83.3	-19.6	0	0	0	105.7
428	G	32	Very low	35.6	Very low	66 Å²	66	128.8 Å²	128.8	68%	0.68	77%	0.772	S	S	*	*			cis	171.3	176.2	2.8	0	0	0	0	0	111
429	E	33.4	Very low	36.2	Very low	203 Å²	203	128.3 Å²	128.3	95%	0.949	77%	0.768	S	S	*	*			trans	61.4	154	171.3	-68.1	-167.1	116	0	0	119.3
430	A	33.5	Very low	36.7	Very low	74 Å²	74	128.2 Å²	128.2	61%	0.612	77%	0.768	S	S	*	*			cis	-163.6	178.5	-23	0	0	0	0	0	111.5
431	D	33	Very low	37.2	Very low	141 Å²	141	129.5 Å²	129.5	75%	0.754	77%	0.772	S	S	*	*			trans	72.1	98.5	159.9	-67.2	-8.8	0	0	0	123.6
432	L	34.1	Very low	37.1	Very low	140 Å²	140	130.1 Å²	130.1	73%	0.733	78%	0.775	S	S	*	*				49.6	118.1	115.2	-65.1	164.4	0	0	0	120.8
433	F	35.7	Very low	38.6	Very low	197 Å²	197	126.2 Å²	126.2	86%	0.864	77%	0.77	S	S	*	*				-164.1	163.7	97.7	-107.6	-72.5	0	0	0	113.7
434	S	32.4	Very low	39.5	Very low	95 Å²	95	122.6 Å²	122.6	66%	0.664	77%	0.768	S	S	*	*			trans	-88.4	167.1	-175.3	52.1	0	0	0	0	113.3
435	S	33.2	Very low	39.9	Very low	95 Å²	95	120.9 Å²	120.9	66%	0.664	77%	0.767	S	S	*	*			cis	-175.8	153.1	-6.8	42.3	0	0	0	0	112.8
436	T	33.8	Very low	41.2	Very low	132 Å²	132	121.8 Å²	121.8	81%	0.81	77%	0.77	S	S	*	*			trans	47.3	121.4	141.8	62.3	0	0	0	0	123.2
437	S	39.8	Very low	41.4	Very low	111 Å²	111	121.7 Å²	121.7	78%	0.776	77%	0.772	S	S	*	*			trans	-68.5	174.3	142	-28.1	0	0	0	0	110.7
438	P	53.8	Low	41.5	Very low	119 Å²	119	122.1 Å²	122.1	77%	0.773	77%	0.769	S	S	*	*			cis	-140.6	-138	30.8	40.5	-15.5	0	0	0	110.7
439	P	52.5	Low	41.6	Very low	123 Å²	123	125.7 Å²	125.7	80%	0.799	77%	0.773	S	S	*	*			cis	-129.8	-167.2	-19	38.8	-18.4	0	0	0	114.9
440	A	44.4	Very low	41.6	Very low	100 Å²	100	119.7 Å²	119.7	83%	0.826	77%	0.766	S	S	*	*			trans	-96.4	165.7	179.2	0	0	0	0	0	114.5
441	A	42.4	Very low	41.6	Very low	98 Å²	98	121 Å²	121	81%	0.81	78%	0.777	S	S	*	*			trans	-145	165.8	-178.8	0	0	0	0	0	112.4
442	P	50	Low	41.7	Very low	124 Å²	124	118.5 Å²	118.5	81%	0.805	78%	0.776	S	S	*	*			trans	-108.9	-178.4	-151.5	43.1	-37.1	0	0	0	115.7
443	P	59.6	Low	41.8	Very low	121 Å²	121	117.2 Å²	117.2	79%	0.786	78%	0.778	S	S	*	*			trans	-99.6	168.2	-167.7	39.3	-35.7	0	0	0	115.3
444	P	52.7	Low	42	Very low	126 Å²	126	119.5 Å²	119.5	82%	0.818	78%	0.781	S	S	*	*			trans	-107.8	157.9	163.3	37.7	-29.8	0	0	0	114
445	G	39.3	Very low	42.7	Very low	69 Å²	69	120.9 Å²	120.9	71%	0.711	79%	0.788	S	S	*	*			trans	-92	-167.4	174.8	0	0	0	0	0	114.9
446	P	61.5	Low	43.1	Very low	123 Å²	123	124.4 Å²	124.4	80%	0.799	80%	0.798	S	S	*	*			trans	-97.3	168.2	-161.6	38.3	-37.6	0	0	0	115.2
447	L	37.5	Very low	43.4	Very low	156 Å²	156	127.7 Å²	127.7	82%	0.817	80%	0.801	S	S	*	*			trans	-166.8	118.3	136.4	-105.1	166.5	0	0	0	113.7
448	E	36.2	Very low	43.4	Very low	151 Å²	151	128.7 Å²	128.7	71%	0.706	80%	0.802	S	S	*	*			trans	32.9	138	141.3	-74.9	-162.2	117.6	0	0	127.3
449	N	35.1	Very low	43.1	Very low	141 Å²	141	129.1 Å²	129.1	75%	0.754	81%	0.805	S	S	*	*			trans	68.8	127.2	134.3	-60.6	-25	0	0	0	122.6
450	G	32.5	Very low	42.4	Very low	78 Å²	78	129 Å²	129	80%	0.804	81%	0.807	S	S	*	*			trans	-170.3	24	-177.8	0	0	0	0	0	121
451	A	34.4	Very low	42.3	Very low	102 Å²	102	136 Å²	136	84%	0.843	81%	0.812	S	S	*	*			trans	60.5	124.9	159	0	0	0	0	0	123.8
452	A	35.9	Very low	42.1	Very low	88 Å²	88	139.1 Å²	139.1	73%	0.727	82%	0.816	S	S	*	*				80.5	99.4	127.7	0	0	0	0	0	124.3
453	S	36.2	Very low	41.4	Very low	113 Å²	113	143 Å²	143	79%	0.79	82%	0.82	S	S	*	*				71	116.9	113.8	-56.7	0	0	0	0	123.1
454	R	38.3	Very low	40.5	Very low	244 Å²	244	147.1 Å²	147.1	92%	0.921	83%	0.825	S	S	*	*				-164.7	137.3	126.2	-105.6	162.1	-162	-142.5	3.1	112.4
455	P	46.9	Very low	39.7	Very low	124 Å²	124	150.7 Å²	150.7	81%	0.805	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-90.7	151.7	-178.2	35.1	-35	0	0	0	114
456	I	43.4	Very low	39.9	Very low	170 Å²	170	156.9 Å²	156.9	87%	0.872	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-92.5	143.9	175.3	-64.6	175	0	0	0	110.4
457	K	39.2	Very low	38.8	Very low	200 Å²	200	158.9 Å²	158.9	87%	0.87	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-85.9	140.9	-177.3	-68.6	175.8	177.3	176.5	0	112.5
458	T	40.3	Very low	39.2	Very low	133 Å²	133	160.7 Å²	160.7	82%	0.816	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-88.7	145	166.3	49	0	0	0	0	111.6
459	P	47.4	Very low	39.8	Very low	128 Å²	128	164.3 Å²	164.3	83%	0.831	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-83.7	139	175.1	32.4	-33.3	0	0	0	112.1
460	S	38.3	Very low	40.4	Very low	121 Å²	121	172.8 Å²	172.8	85%	0.846	87%	0.866	S	S	*	*	P	Polyproline II helix	trans	-89.8	136.6	-176	39.7	0	0	0	0	113.6	N462	S460-N462 PolarHBondContact O-N 3.33Å
461	R	40.8	Very low	40.8	Very low	245 Å²	245	177.6 Å²	177.6	93%	0.925	87%	0.87	S	S	*	*			trans	-88.7	104.8	-172.7	-173	175.3	179.9	177.4	0.7	112	K463	R461-K463 PolarHBondContact O-N 3.47Å
462	N	38.4	Very low	41.2	Very low	165 Å²	165	181.5 Å²	181.5	88%	0.882	87%	0.871	S	S	*	*			trans	-63.5	120	179.4	-97.4	-35.7	0	0	0	113.1	S460	S460-N462 PolarHBondContact O-N 3.33Å
463	K	36.7	Very low	41.5	Very low	206 Å²	206	186.7 Å²	186.7	90%	0.896	88%	0.879	S	S	*	*			trans	-91.2	105.3	166.1	-76.1	-176.6	176.9	178.3	0	110.1	R461	R461-K463 PolarHBondContact O-N 3.47Å
464	K	40.5	Very low	41.8	Very low	207 Å²	207	191.1 Å²	191.1	90%	0.9	88%	0.884	S	S	*	*			trans	-85.1	116.5	161.3	-88.6	-175.7	171.9	178.6	0	109.6
465	K	35	Very low	42	Very low	200 Å²	200	187.8 Å²	187.8	87%	0.87	88%	0.882	S	S	*	*			trans	-61.9	148.9	158.6	-73.1	-178.4	175.6	-179	0	108.6
466	K	42.9	Very low	41.7	Very low	200 Å²	200	192 Å²	192	87%	0.87	89%	0.887	S	S	*	*			trans	-134	106.5	158.5	-148	-177.1	-175.4	-170.6	0	107.7
467	E	39.1	Very low	41.6	Very low	165 Å²	165	193.6 Å²	193.6	77%	0.771	89%	0.888	S	S	*	*			trans	-67.8	147.7	162.1	-66.9	165.8	94.2	0	0	108.6
468	H	45.1	Very low	41.7	Very low	194 Å²	194	193.1 Å²	193.1	90%	0.898	89%	0.89	S	S	*	*			trans	-144.2	156.8	136.1	-109.7	46.8	0	0	0	108.9
469	R	49.7	Very low	41.9	Very low	226 Å²	226	198.1 Å²	198.1	85%	0.853	90%	0.896	S	S	*	*			trans	-137.7	130.7	-163.3	-156.4	-176.6	-175.1	-164.8	2	107.9
470	R	48.5	Very low	41.4	Very low	320 Å²	320	204.5 Å²	204.5	100%	1.208	90%	0.902	S	S	*	*			trans	73	0	-173.5	-57.3	179.9	169.7	177.5	-4.9	114.1

Retrieved 470 of 470 residues in 461.8 ms (Link to these results)

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