A0A3Q0KNV0_SCHMA Loading...

Replication A protein, putative

AlphaFold DB , UniProt , Accession A0A3Q0KNV0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 436 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	39.8	Very low	46.5	Very low	238 Å²	238	140.3 Å²	140.3	100%	1.172	68%	0.677	S	S	*	*				0	118.9	0	-82.3	163.5	78.3	0	0	108
2	K	39.2	Very low	46.9	Very low	210 Å²	210	134.4 Å²	134.4	91%	0.913	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-81.2	116.8	172.3	-75.3	-178.3	176.2	179.5	0	107	L4	K2-L4 PolarHBondContact O-N 3.39Å
3	L	36.9	Very low	47.2	Very low	167 Å²	167	131.1 Å²	131.1	87%	0.874	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-63.5	118.8	172.3	-87.8	104.2	0	0	0	108.1	N5	L3-N5 PolarHBondContact O-N 2.75Å
4	L	42.1	Very low	46.7	Very low	99 Å²	99	130.3 Å²	130.3	52%	0.518	63%	0.633	S	S	.	*	P	Polyproline II helix	trans	-62	122.6	168.2	-76.7	145.4	0	0	0	107.3	K2 Q8	K2-L4 PolarHBondContact O-N 3.39Å; L4-Q8 HydrophobicContact CB-CB 4.14Å; L4-Q8 HydrophobicContact CD2-CB 3.31Å; L4-Q8 HydrophobicContact CD2-CG 4.21Å; L4-Q8 HydrophobicContact CG-CB 4.33Å
5	N	55	Low	46.4	Very low	104 Å²	104	129.1 Å²	129.1	56%	0.556	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-61.2	147.7	168.2	179.9	-40.8	0	0	0	107.8	L3 R7 Q8 L9	L3-N5 PolarHBondContact O-N 2.75Å; N5-R7 PolarHBondContact O-N 3.18Å; N5-R7 PolarHBondContact OD1-N 2.53Å; N5-Q8 WeakPolarHBondContact O-CA 3.48Å; N5-Q8 WeakPolarHBondContact O-CB 2.99Å; N5-Q8 PolarHBondContact O-N 3.1Å; N5-L9 PolarHBondContact O-N 3.07Å
6	I	56.1	Low	46.1	Very low	123 Å²	123	126.4 Å²	126.4	63%	0.631	62%	0.62	S	S	*	*	H	α-helix	trans	-43.7	-35.4	-179	-126.8	154.5	0	0	0	113.2	Q8 L9 I10	I6-Q8 PolarHBondContact O-N 2.91Å; I6-L9 PolarHBondContact O-N 3.46Å; I6-I10 HydrophobicContact CG2-CD1 4.41Å; I6-I10 WeakPolarHBondContact O-CD1 3.48Å; I6-I10 VanDerWaalsContact O-CG1 3.27Å; I6-I10 WeakPolarHBondContact O-CG1 3.4Å; I6-I10 PolarHBondContact O-N 2.98Å
7	R	45.3	Very low	45.7	Very low	203 Å²	203	124.4 Å²	124.4	77%	0.766	61%	0.611	S	S	*	*	H	α-helix	trans	-61.9	-40.2	174.3	-74.1	-173.1	172	-173.9	-2.9	113.9	N5 L11	N5-R7 PolarHBondContact O-N 3.18Å; N5-R7 PolarHBondContact OD1-N 2.53Å; R7-L11 PolarHBondContact O-N 2.69Å
8	Q	54.9	Low	44.9	Very low	104 Å²	104	126.9 Å²	126.9	49%	0.486	61%	0.613	S	S	.	*	H	α-helix	trans	-75.5	-29.5	178.5	-59	176.6	-44.2	0	0	111.6	L4 N5 I6 V12	L4-Q8 HydrophobicContact CB-CB 4.14Å; L4-Q8 HydrophobicContact CD2-CB 3.31Å; L4-Q8 HydrophobicContact CD2-CG 4.21Å; L4-Q8 HydrophobicContact CG-CB 4.33Å; N5-Q8 WeakPolarHBondContact O-CA 3.48Å; N5-Q8 WeakPolarHBondContact O-CB 2.99Å; N5-Q8 PolarHBondContact O-N 3.1Å; I6-Q8 PolarHBondContact O-N 2.91Å; Q8-V12 WeakPolarHBondContact O-CG2 3.25Å; Q8-V12 PolarHBondContact O-N 2.9Å
9	L	47.2	Very low	44.2	Very low	88 Å²	88	123.9 Å²	123.9	46%	0.461	61%	0.606	S	S	.	*	H	α-helix	trans	-67.3	-45.8	174.1	-167.7	79.8	0	0	0	111.4	N5 I6 L11 V12 I13	N5-L9 PolarHBondContact O-N 3.07Å; I6-L9 PolarHBondContact O-N 3.46Å; L9-L11 VanDerWaalsContact C-N 3.26Å; L9-L11 PolarHBondContact O-N 2.81Å; L9-V12 PolarHBondContact O-N 3.02Å; L9-I13 HydrophobicContact CG-CD1 4.28Å; L9-I13 WeakPolarHBondContact O-CG1 3.44Å; L9-I13 PolarHBondContact O-N 3.41Å
10	I	51.8	Low	43.3	Very low	98 Å²	98	124.3 Å²	124.3	50%	0.503	61%	0.607	S	S	.	*	H	α-helix	trans	-58.3	-42.3	175.8	-67.6	163.4	0	0	0	110.4	I6 V12 I13 F14	I6-I10 HydrophobicContact CG2-CD1 4.41Å; I6-I10 WeakPolarHBondContact O-CD1 3.48Å; I6-I10 VanDerWaalsContact O-CG1 3.27Å; I6-I10 WeakPolarHBondContact O-CG1 3.4Å; I6-I10 PolarHBondContact O-N 2.98Å; I10-V12 PolarHBondContact O-N 2.81Å; I10-I13 PolarHBondContact O-N 3.45Å; I10-F14 WeakPolarHBondContact O-CB 3.48Å; I10-F14 PolarHBondContact O-N 3.31Å
11	L	43.6	Very low	42.6	Very low	109 Å²	109	122.1 Å²	122.1	57%	0.571	60%	0.603	S	S	*	*	H	α-helix	trans	-66.2	-35.5	-179.2	-149.7	140.8	0	0	0	112.8	R7 L9 L15	R7-L11 PolarHBondContact O-N 2.69Å; L9-L11 VanDerWaalsContact C-N 3.26Å; L9-L11 PolarHBondContact O-N 2.81Å; L11-L15 HydrophobicContact CD2-CD1 3.82Å; L11-L15 WeakPolarHBondContact O-CB 3.3Å; L11-L15 WeakPolarHBondContact O-CG 3.47Å; L11-L15 PolarHBondContact O-N 3.08Å; L11-L15 VanDerWaalsContact O-N 3.08Å
12	V	51	Low	41.9	Very low	70 Å²	70	116 Å²	116	42%	0.424	57%	0.574	S	S	.	*	H	α-helix	trans	-71.4	-36.9	174.6	171.4	0	0	0	0	112	Q8 L9 I10 N16	Q8-V12 WeakPolarHBondContact O-CG2 3.25Å; Q8-V12 PolarHBondContact O-N 2.9Å; L9-V12 PolarHBondContact O-N 3.02Å; I10-V12 PolarHBondContact O-N 2.81Å; V12-N16 PolarHBondContact O-N 2.69Å; V12-N16 PolarHBondContact O-ND2 3.37Å
13	I	50.7	Low	41.1	Very low	91 Å²	91	108 Å²	108	47%	0.467	55%	0.552	S	S	.	*	H	α-helix	trans	-66	-45.2	174.9	-67.1	165.9	0	0	0	109.8	L9 I10 L15 N16 I17	L9-I13 HydrophobicContact CG-CD1 4.28Å; L9-I13 WeakPolarHBondContact O-CG1 3.44Å; L9-I13 PolarHBondContact O-N 3.41Å; I10-I13 PolarHBondContact O-N 3.45Å; I13-L15 PolarHBondContact O-N 3.12Å; I13-N16 PolarHBondContact O-N 3.33Å; I13-I17 HydrophobicContact CG2-CD1 3.71Å; I13-I17 HydrophobicContact CG2-CG1 4.47Å; I13-I17 WeakPolarHBondContact O-CG1 3.43Å; I13-I17 PolarHBondContact O-N 2.94Å
14	F	40.7	Very low	40.4	Very low	120 Å²	120	110.1 Å²	110.1	53%	0.526	55%	0.55	S	S	.	*	H	α-helix	trans	-60.5	-45.2	178.8	-143.8	-89.1	0	0	0	112.2	I10 N16 I17 W18	I10-F14 WeakPolarHBondContact O-CB 3.48Å; I10-F14 PolarHBondContact O-N 3.31Å; F14-N16 PolarHBondContact O-N 2.84Å; F14-I17 PolarHBondContact O-N 3.16Å; F14-W18 WeakPolarHBondContact O-CB 3.3Å; F14-W18 PolarHBondContact O-N 2.77Å
15	L	42.3	Very low	39.5	Very low	112 Å²	112	110.9 Å²	110.9	59%	0.586	56%	0.559	S	S	*	*	H	α-helix	trans	-63.8	-36.2	176.9	-77.6	166.9	0	0	0	113	L11 I13 S19	L11-L15 HydrophobicContact CD2-CD1 3.82Å; L11-L15 WeakPolarHBondContact O-CB 3.3Å; L11-L15 WeakPolarHBondContact O-CG 3.47Å; L11-L15 PolarHBondContact O-N 3.08Å; L11-L15 VanDerWaalsContact O-N 3.08Å; I13-L15 PolarHBondContact O-N 3.12Å; L15-S19 PolarHBondContact O-N 3.41Å; L15-S19 VanDerWaalsContact O-N 3.1Å
16	N	40.7	Very low	37.9	Very low	87 Å²	87	111.3 Å²	111.3	47%	0.465	57%	0.565	S	S	.	*	H	α-helix	trans	-70.3	-43.1	177.5	-85.9	-66.6	0	0	0	112.1	V12 I13 F14 W18 S19 Q20	V12-N16 PolarHBondContact O-N 2.69Å; V12-N16 PolarHBondContact O-ND2 3.37Å; I13-N16 PolarHBondContact O-N 3.33Å; F14-N16 PolarHBondContact O-N 2.84Å; N16-W18 VanDerWaalsContact C-N 3.35Å; N16-S19 PolarHBondContact O-N 3.49Å; N16-S19 PolarHBondContact O-OG 3.09Å; N16-Q20 WeakPolarHBondContact O-CG 3.22Å; N16-Q20 PolarHBondContact O-N 3.14Å; N16-Q20 VanDerWaalsContact O-N 3.16Å
17	I	40.2	Very low	36.1	Very low	92 Å²	92	112.6 Å²	112.6	47%	0.472	57%	0.572	S	S	.	*	H	α-helix	trans	-62.2	-43.2	176.2	-65.5	167	0	0	0	110.3	I13 F14 S19 Q20 C21	I13-I17 HydrophobicContact CG2-CD1 3.71Å; I13-I17 HydrophobicContact CG2-CG1 4.47Å; I13-I17 WeakPolarHBondContact O-CG1 3.43Å; I13-I17 PolarHBondContact O-N 2.94Å; F14-I17 PolarHBondContact O-N 3.16Å; I17-S19 PolarHBondContact O-N 2.81Å; I17-Q20 PolarHBondContact O-N 3.43Å; I17-C21 PolarHBondContact O-N 2.96Å; I17-C21 VanDerWaalsContact O-N 3.08Å; I17-C21 PolarHBondContact O-SG 2.95Å
18	W	31.5	Very low	35.1	Very low	170 Å²	170	112.2 Å²	112.2	64%	0.644	58%	0.582	S	S	*	*	H	α-helix	trans	-61.7	-39.7	175.9	-118.7	57.9	0	0	0	113	F14 N16 Q20 C21 L22	F14-W18 WeakPolarHBondContact O-CB 3.3Å; F14-W18 PolarHBondContact O-N 2.77Å; N16-W18 VanDerWaalsContact C-N 3.35Å; W18-Q20 VanDerWaalsContact C-N 3.31Å; W18-Q20 PolarHBondContact O-N 2.84Å; W18-C21 PolarHBondContact O-N 3.14Å; W18-L22 HydrophobicContact CE3-CD1 3.99Å; W18-L22 HydrophobicContact CZ3-CD1 4.42Å; W18-L22 PolarHBondContact O-N 3.32Å; W18-L22 VanDerWaalsContact O-N 3.08Å
19	S	30.1	Very low	33.4	Very low	69 Å²	69	112.5 Å²	112.5	48%	0.483	60%	0.595	S	S	.	*	H	α-helix	trans	-67.5	-30.8	177.7	84.7	0	0	0	0	113.1	L15 N16 I17 G23	L15-S19 PolarHBondContact O-N 3.41Å; L15-S19 VanDerWaalsContact O-N 3.1Å; N16-S19 PolarHBondContact O-N 3.49Å; N16-S19 PolarHBondContact O-OG 3.09Å; I17-S19 PolarHBondContact O-N 2.81Å; S19-G23 PolarHBondContact O-N 2.65Å
20	Q	27.8	Very low	32.1	Very low	132 Å²	132	117.4 Å²	117.4	62%	0.617	62%	0.616	S	S	*	*	H	α-helix	trans	-75.3	-36.8	176.6	-69.9	-179	1	0	0	111.6	N16 I17 W18 G23 Y24	N16-Q20 WeakPolarHBondContact O-CG 3.22Å; N16-Q20 PolarHBondContact O-N 3.14Å; N16-Q20 VanDerWaalsContact O-N 3.16Å; I17-Q20 PolarHBondContact O-N 3.43Å; W18-Q20 VanDerWaalsContact C-N 3.31Å; W18-Q20 PolarHBondContact O-N 2.84Å; Q20-G23 PolarHBondContact O-N 3.4Å; Q20-Y24 WeakPolarHBondContact O-CD2 3.4Å
21	C	26.9	Very low	30.6	Very low	78 Å²	78	121 Å²	121	53%	0.527	63%	0.63	S	S	.	*	H	α-helix	trans	-67.7	-34.3	173.5	-68.1	0	0	0	0	113	I17 W18 V25	I17-C21 PolarHBondContact O-N 2.96Å; I17-C21 VanDerWaalsContact O-N 3.08Å; I17-C21 PolarHBondContact O-SG 2.95Å; W18-C21 PolarHBondContact O-N 3.14Å; C21-V25 WeakPolarHBondContact O-CG2 3.49Å
22	L	26.7	Very low	29.7	Very low	109 Å²	109	122.3 Å²	122.3	57%	0.571	64%	0.638	S	S	*	*	H	α-helix	trans	-70.3	-28.6	176	-86.5	155.1	0	0	0	113.1	W18 T26	W18-L22 HydrophobicContact CE3-CD1 3.99Å; W18-L22 HydrophobicContact CZ3-CD1 4.42Å; W18-L22 PolarHBondContact O-N 3.32Å; W18-L22 VanDerWaalsContact O-N 3.08Å; L22-T26 PolarHBondContact O-OG1 3.14Å
23	G	21.7	Very low	28.2	Very low	44 Å²	44	125.9 Å²	125.9	45%	0.454	66%	0.655	S	S	.	*	H	α-helix	trans	-76.6	-21.8	177.9	0	0	0	0	0	115.1	S19 Q20	S19-G23 PolarHBondContact O-N 2.65Å; Q20-G23 PolarHBondContact O-N 3.4Å
24	Y	22.8	Very low	26.8	Very low	211 Å²	211	132 Å²	132	83%	0.827	67%	0.672	S	S	*	*	H	α-helix	trans	-87.6	-13.3	178.7	-91.7	-85.6	0	0	0	114	Q20	Q20-Y24 WeakPolarHBondContact O-CD2 3.4Å
25	V	22.9	Very low	25.9	Very low	115 Å²	115	135.1 Å²	135.1	70%	0.697	69%	0.688	S	S	*	*	S	Bend	trans	-88.9	-9.5	-178	175.1	0	0	0	0	112.5	C21	C21-V25 WeakPolarHBondContact O-CG2 3.49Å
26	T	20.2	Very low	24.9	Very low	112 Å²	112	137.4 Å²	137.4	69%	0.687	70%	0.696	S	S	*	*	S	Bend	trans	-97.1	9.9	-172.5	-20.9	0	0	0	0	115	L22	L22-T26 PolarHBondContact O-OG1 3.14Å
27	L	19.8	Very low	24	Very low	150 Å²	150	141.7 Å²	141.7	79%	0.785	71%	0.713	S	S	*	*	S	Bend	trans	-124.3	11	-171	-84.3	163.8	0	0	0	117.1
28	M	22.7	Very low	23	Very low	196 Å²	196	148.1 Å²	148.1	97%	0.966	73%	0.731	S	S	*	*	S	Bend	trans	-135.3	43	174.9	-75.9	-162.4	169.9	0	0	113.8
29	S	20.1	Very low	22.5	Very low	110 Å²	110	145.9 Å²	145.9	77%	0.769	73%	0.732	S	S	*	*			trans	-127.7	75.6	177.5	160.5	0	0	0	0	109.6
30	E	19.8	Very low	21.9	Very low	190 Å²	190	150.8 Å²	150.8	89%	0.888	75%	0.747	S	S	*	*			trans	-151.2	133.9	157.2	-116.7	170.1	-173.4	0	0	108
31	E	21	Very low	21.6	Very low	174 Å²	174	151.1 Å²	151.1	81%	0.813	76%	0.758	S	S	*	*	S	Bend	trans	91.5	89.1	170.3	-53.8	-166.8	152.9	0	0	119.6
32	N	23.3	Very low	21.2	Very low	137 Å²	137	152.6 Å²	152.6	73%	0.733	77%	0.766	S	S	*	*				87.9	86	127.3	-64	-36.7	0	0	0	119.3
33	N	21.3	Very low	20.8	Very low	145 Å²	145	155.6 Å²	155.6	78%	0.775	78%	0.782	S	S	*	*				49.1	103	87	-95.2	-27.7	0	0	0	115.6
34	R	19.9	Very low	20.7	Very low	220 Å²	220	162.4 Å²	162.4	83%	0.83	80%	0.795	S	S	*	*				160.3	130	110.8	-91.2	163.3	170.5	-178.4	-3	114
35	Q	22.4	Very low	20.5	Very low	184 Å²	184	160.6 Å²	160.6	86%	0.86	79%	0.788	S	S	*	*			trans	87.4	101.8	148.7	-66.1	174.1	-3	0	0	120.5
36	Q	20.8	Very low	20.4	Very low	160 Å²	160	166 Å²	166	75%	0.748	80%	0.798	S	S	*	*			trans	-101.8	136.2	154.7	-69.6	179.7	-7.6	0	0	109.5
37	Q	21.6	Very low	20.4	Very low	178 Å²	178	170.1 Å²	170.1	83%	0.832	80%	0.802	S	S	*	*			trans	-148.3	136	152.7	-79.4	-162.3	-8.3	0	0	112.9
38	R	19.9	Very low	20.5	Very low	226 Å²	226	171.5 Å²	171.5	85%	0.853	80%	0.804	S	S	*	*			trans	-61.3	164.3	-172.2	-73.6	172.7	158.5	-176.3	-5.2	116.5
39	L	20	Very low	20.4	Very low	124 Å²	124	171.5 Å²	171.5	65%	0.649	80%	0.802	S	S	*	*				178.9	113.4	126.9	-92.2	147.1	0	0	0	108.5
40	Q	18.3	Very low	20.5	Very low	171 Å²	171	168.9 Å²	168.9	80%	0.799	79%	0.792	S	S	*	*				70.3	90.5	70.2	-136.8	-178.2	21.3	0	0	114
41	T	20.6	Very low	20.6	Very low	140 Å²	140	166.3 Å²	166.3	86%	0.859	79%	0.785	S	S	*	*			trans	-173.4	134.1	143	8	0	0	0	0	111.5
42	P	19.1	Very low	20.7	Very low	108 Å²	108	164.6 Å²	164.6	70%	0.701	78%	0.78	S	S	*	*			trans	-93.7	142.4	-178.7	35.8	-29.8	0	0	0	111.7
43	L	19.3	Very low	20.6	Very low	172 Å²	172	164.8 Å²	164.8	90%	0.901	79%	0.786	S	S	*	*			trans	-133.2	95.3	169.5	-82.6	168.1	0	0	0	111.2
44	Y	19	Very low	20.6	Very low	187 Å²	187	161 Å²	161	73%	0.733	77%	0.771	S	S	*	*			trans	31.2	115.8	135	-82.3	-107.8	0	0	0	121.2
45	Y	19.6	Very low	20.8	Very low	173 Å²	173	158.7 Å²	158.7	68%	0.678	78%	0.775	S	S	*	*			trans	59.9	132.5	148.5	-62.6	-103.6	0	0	0	117.9
46	Y	20.8	Very low	20.8	Very low	230 Å²	230	157.6 Å²	157.6	90%	0.902	77%	0.77	S	S	*	*				-139.5	137.3	53.1	-80.3	-100.3	0	0	0	113.2
47	Y	19.2	Very low	20.9	Very low	197 Å²	197	156 Å²	156	77%	0.773	76%	0.762	S	S	*	*			trans	-84.2	129.2	164.8	-84.6	-101.3	0	0	0	109.4
48	H	21.6	Very low	21	Very low	179 Å²	179	151.4 Å²	151.4	83%	0.829	75%	0.748	S	S	*	*				-165	109.7	127.2	-94.7	-49.7	0	0	0	108.8	G50	H48-G50 PolarHBondContact O-N 3.45Å
49	E	21.5	Very low	21.1	Very low	197 Å²	197	150.9 Å²	150.9	92%	0.921	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	104.8	161.6	-70.4	172.4	144.9	0	0	106.6
50	G	21.5	Very low	21.3	Very low	54 Å²	54	151.8 Å²	151.8	56%	0.557	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-176.2	-31.6	-177.6	0	0	0	0	0	116.1	H48	H48-G50 PolarHBondContact O-N 3.45Å
51	D	21.8	Very low	21.5	Very low	137 Å²	137	152.6 Å²	152.6	73%	0.733	75%	0.747	S	S	*	*			trans	-108.6	20.8	-161.2	-66.8	-26.4	0	0	0	116.8
52	I	24.3	Very low	21.6	Very low	138 Å²	138	149.5 Å²	149.5	71%	0.708	74%	0.743	S	S	*	*	S	Bend	trans	-102.8	7	-178.6	-55.8	178.4	0	0	0	113
53	T	21.4	Very low	21.9	Very low	140 Å²	140	147.2 Å²	147.2	86%	0.859	73%	0.727	S	S	*	*	S	Bend	trans	-126	29	173.7	46.1	0	0	0	0	113.1
54	S	21	Very low	22.1	Very low	66 Å²	66	143 Å²	143	46%	0.462	73%	0.726	S	S	.	*			trans	-106.4	128.5	173.4	173.9	0	0	0	0	110	E56	S54-E56 PolarHBondContact O-N 3.45Å
55	N	23	Very low	22.4	Very low	172 Å²	172	136.6 Å²	136.6	92%	0.92	70%	0.703	S	S	*	*			trans	-66.2	32.8	179.7	-79.8	-25.3	0	0	0	114.3
56	E	22.2	Very low	22.7	Very low	161 Å²	161	135.6 Å²	135.6	75%	0.752	71%	0.706	S	S	*	*			trans	-99.6	110.7	-178.4	-72.5	-177.7	168.6	0	0	110.5	S54	S54-E56 PolarHBondContact O-N 3.45Å
57	Q	24.3	Very low	23	Very low	126 Å²	126	127.1 Å²	127.1	59%	0.589	67%	0.673	S	S	*	*			trans	-54.4	130.2	169.2	-75.6	-166	-30.6	0	0	109.5	Y59	Q57-Y59 PolarHBondContact O-N 2.79Å
58	P	23.7	Very low	23.4	Very low	82 Å²	82	120.7 Å²	120.7	53%	0.532	65%	0.652	S	S	.	*			trans	-66.8	99.1	175.3	25.3	-31	0	0	0	109.7	Y60	P58-Y60 PolarHBondContact O-N 3.16Å
59	Y	22.3	Very low	23.7	Very low	215 Å²	215	115.4 Å²	115.4	84%	0.843	63%	0.632	S	S	*	*			trans	-70.2	106.9	171.3	-144.9	-93.7	0	0	0	108.4	Q57	Q57-Y59 PolarHBondContact O-N 2.79Å
60	Y	24.1	Very low	24	Very low	142 Å²	142	106.6 Å²	106.6	56%	0.557	59%	0.591	S	S	*	*			trans	-94.9	108.1	168.6	-97.7	-92.9	0	0	0	108.7	P58 G62	P58-Y60 PolarHBondContact O-N 3.16Å; Y60-G62 PolarHBondContact O-N 2.85Å
61	E	22	Very low	24.3	Very low	188 Å²	188	111.1 Å²	111.1	88%	0.879	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.9	110.1	168.7	-81.9	-175.9	142.7	0	0	109.6
62	G	22.5	Very low	24.5	Very low	76 Å²	76	105.3 Å²	105.3	78%	0.784	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	147.8	-17.4	165.3	0	0	0	0	0	118.1	Y60	Y60-G62 PolarHBondContact O-N 2.85Å
63	T	25.5	Very low	24.5	Very low	59 Å²	59	103.8 Å²	103.8	36%	0.362	56%	0.564	S	S	.	*	S	Bend	trans	-127.7	-7.6	-172.1	65.7	0	0	0	0	117.5	E65 K254	T63-E65 WeakPolarHBondContact CB-OE2 3.17Å; T63-E65 WeakPolarHBondContact O-CG 3.41Å; T63-E65 PolarHBondContact O-N 2.84Å; T63-E65 VanDerWaalsContact O-N 3.12Å; T63-E65 VanDerWaalsContact OG1-CD 3.3Å; T63-E65 PolarHBondContact OG1-OE2 2.87Å; T63-K254 PolarHBondContact O-NZ 2.77Å
64	G	22.2	Very low	24.6	Very low	85 Å²	85	99.2 Å²	99.2	88%	0.876	54%	0.536	S	S	*	.			trans	57	25	179.6	0	0	0	0	0	113.3
65	E	26.7	Very low	24.7	Very low	52 Å²	52	101.1 Å²	101.1	24%	0.243	53%	0.534	C	S	.	.			trans	-99.3	126.1	-173.7	-78.7	153.6	-165.3	0	0	109.5	T63 Y67 K254	T63-E65 WeakPolarHBondContact CB-OE2 3.17Å; T63-E65 WeakPolarHBondContact O-CG 3.41Å; T63-E65 PolarHBondContact O-N 2.84Å; T63-E65 VanDerWaalsContact O-N 3.12Å; T63-E65 VanDerWaalsContact OG1-CD 3.3Å; T63-E65 PolarHBondContact OG1-OE2 2.87Å; E65-Y67 HydrophobicContact CB-CE2 4.24Å; E65-Y67 WeakPolarHBondContact O-CD2 3.41Å; E65-Y67 VanDerWaalsContact O-CE2 3.3Å; E65-Y67 WeakPolarHBondContact O-CE2 3.46Å; E65-K254 IonicContact OE1-NZ 2.91Å; E65-K254 PolarHBondContact OE1-NZ 3.37Å
66	M	25.9	Very low	24.7	Very low	152 Å²	152	97.3 Å²	97.3	75%	0.749	51%	0.514	S	S	*	.			trans	-82.9	138	167.9	-77.9	-169.7	160.3	0	0	109.1
67	Y	26.8	Very low	24.7	Very low	51 Å²	51	98.6 Å²	98.6	20%	0.2	51%	0.513	C	S	.	.			trans	-116.5	115.9	-179.4	-59.1	-85.6	0	0	0	109.3	E65	E65-Y67 HydrophobicContact CB-CE2 4.24Å; E65-Y67 WeakPolarHBondContact O-CD2 3.41Å; E65-Y67 VanDerWaalsContact O-CE2 3.3Å; E65-Y67 WeakPolarHBondContact O-CE2 3.46Å
68	D	27.9	Very low	24.6	Very low	63 Å²	63	101.7 Å²	101.7	34%	0.337	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	123	166.3	-64.1	-34.2	0	0	0	108.3	Y70 K232	D68-Y70 HydrophobicContact CB-CE2 3.82Å; D68-Y70 PolarHBondContact OD2-OH 2.75Å; D68-K232 IonicContact OD2-NZ 3.09Å; D68-K232 PolarHBondContact OD2-NZ 2.88Å; D68-K232 VanDerWaalsContact OD2-NZ 3.09Å
69	T	28.2	Very low	24.6	Very low	68 Å²	68	103.4 Å²	103.4	42%	0.417	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	118.1	174.2	-59.9	0	0	0	0	108.5	T247	T69-T247 HydrophobicContact CG2-CG2 3.74Å
70	Y	27.4	Very low	24.7	Very low	12 Å²	12	99.4 Å²	99.4	5%	0.047	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	128.7	174	-51.4	-87.4	0	0	0	109.9	D68 V121 Y123 L248 T250	D68-Y70 HydrophobicContact CB-CE2 3.82Å; D68-Y70 PolarHBondContact OD2-OH 2.75Å; Y70-V121 HydrophobicContact CD1-CG1 4.33Å; Y70-Y123 HydrophobicContact CE1-CD1 4.12Å; Y70-Y123 AromaticContact CE1-CE1 3.89Å; Y70-Y123 HydrophobicContact CE1-CE1 3.89Å; Y70-L248 HydrophobicContact CD2-CB 4.03Å; Y70-L248 HydrophobicContact CD2-CD2 3.83Å; Y70-L248 HydrophobicContact CD2-CG 3.91Å; Y70-L248 WeakPolarHBondContact CD2-O 3.42Å; Y70-L248 HydrophobicContact CE2-CD2 4.35Å; Y70-L248 HydrophobicContact CG-CB 4.48Å; Y70-L248 HydrophobicContact CG-CD2 4.32Å; Y70-L248 PolarHBondContact N-O 2.98Å; Y70-L248 PolarHBondContact O-N 3.32Å; Y70-T250 HydrophobicContact CE2-CG2 3.77Å
71	Q	26.7	Very low	24.7	Very low	149 Å²	149	102 Å²	102	70%	0.696	54%	0.54	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	115.4	165.3	-67.4	-170.5	2	0	0	108.4
72	V	27	Very low	24.7	Very low	15 Å²	15	95.5 Å²	95.5	9%	0.091	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	113.9	170.5	-174.4	0	0	0	0	107.5	P74 V121 Y246	V72-P74 VanDerWaalsContact O-CD 3.25Å; V72-P74 WeakPolarHBondContact O-CD 3.34Å; V72-V121 HydrophobicContact CG2-CG2 4.35Å; V72-Y246 PolarHBondContact N-O 3.19Å
73	T	23.9	Very low	24.7	Very low	105 Å²	105	98.8 Å²	98.8	64%	0.644	52%	0.523	S	S	*	.			trans	-77.1	109.3	166.4	14.4	0	0	0	0	108.5	Y245	T73-Y245 HydrophobicContact CG2-CD1 4.49Å; T73-Y245 HydrophobicContact CG2-CE1 3.87Å
74	P	23.9	Very low	24.7	Very low	44 Å²	44	102.5 Å²	102.5	29%	0.286	54%	0.541	S	S	.	.			trans	-69.7	150.8	165.1	31.8	-29.6	0	0	0	109	V72 D76 K244	V72-P74 VanDerWaalsContact O-CD 3.25Å; V72-P74 WeakPolarHBondContact O-CD 3.34Å; P74-D76 PolarHBondContact O-N 3.06Å; P74-K244 VanDerWaalsContact CD-C 3.49Å; P74-K244 WeakPolarHBondContact CD-O 3.41Å; P74-K244 HydrophobicContact CG-CB 3.83Å; P74-K244 WeakPolarHBondContact CG-O 3.26Å
75	Y	23.3	Very low	24.8	Very low	107 Å²	107	104.6 Å²	104.6	42%	0.42	53%	0.531	S	S	.	.			trans	-51.7	131.7	169.6	-87.1	-87.3	0	0	0	110.4	Y77 Y117 Y118	Y75-Y77 VanDerWaalsContact C-N 3.29Å; Y75-Y77 PolarHBondContact O-N 3.05Å; Y75-Y117 HydrophobicContact CD1-CD1 4.37Å; Y75-Y117 HydrophobicContact CD1-CD2 4.25Å; Y75-Y117 AromaticContact CD1-CG 3.97Å; Y75-Y117 HydrophobicContact CD1-CG 3.97Å; Y75-Y117 AromaticContact CE1-CD1 3.29Å; Y75-Y117 HydrophobicContact CE1-CD1 3.29Å; Y75-Y117 AromaticContact CE1-CD2 3.64Å; Y75-Y117 HydrophobicContact CE1-CD2 3.64Å; Y75-Y117 AromaticContact CE1-CE1 3.59Å; Y75-Y117 HydrophobicContact CE1-CE1 3.59Å; Y75-Y117 AromaticContact CE1-CE2 3.94Å; Y75-Y117 HydrophobicContact CE1-CE2 3.94Å; Y75-Y117 AromaticContact CE1-CG 3.25Å; Y75-Y117 HydrophobicContact CE1-CG 3.25Å; Y75-Y117 AromaticContact CE1-CZ 3.87Å; Y75-Y117 AromaticContact CE2-CD1 3.66Å; Y75-Y117 HydrophobicContact CE2-CD1 3.66Å; Y75-Y117 HydrophobicContact CE2-CE1 4.46Å; Y75-Y117 AromaticContact CE2-CG 3.91Å; Y75-Y117 HydrophobicContact CE2-CG 3.91Å; Y75-Y117 AromaticContact CZ-CD1 2.9Å; Y75-Y117 AromaticContact CZ-CE1 3.37Å; Y75-Y117 AromaticContact CZ-CG 3.3Å; Y75-Y117 WeakPolarHBondContact OH-CD1 3.28Å; Y75-Y117 WeakPolarHBondContact OH-CE1 3.32Å; Y75-Y118 PolarHBondContact OH-O 3.43Å
76	D	22.3	Very low	24.6	Very low	91 Å²	91	108.6 Å²	108.6	49%	0.487	56%	0.555	S	S	.	*			trans	-57.5	97	161.3	-83.6	-36.5	0	0	0	107.8	P74 Y78 K244	P74-D76 PolarHBondContact O-N 3.06Å; D76-Y78 HydrophobicContact CB-CD2 3.92Å; D76-Y78 HydrophobicContact CB-CE2 4.09Å; D76-Y78 PolarHBondContact O-N 3.22Å; D76-K244 IonicContact OD1-NZ 3.4Å; D76-K244 PolarHBondContact OD1-NZ 3.3Å
77	Y	23	Very low	24.4	Very low	189 Å²	189	107.6 Å²	107.6	74%	0.741	55%	0.552	S	S	*	*			trans	-64.3	96	146	-94.2	-88.7	0	0	0	105.4	Y75 V79	Y75-Y77 VanDerWaalsContact C-N 3.29Å; Y75-Y77 PolarHBondContact O-N 3.05Å; Y77-V79 PolarHBondContact O-N 3.46Å
78	Y	22.2	Very low	24.3	Very low	191 Å²	191	112.2 Å²	112.2	75%	0.749	58%	0.581	S	S	*	*			trans	-58.9	96.2	155.9	-90.7	-96.8	0	0	0	106.5	D76	D76-Y78 HydrophobicContact CB-CD2 3.92Å; D76-Y78 HydrophobicContact CB-CE2 4.09Å; D76-Y78 PolarHBondContact O-N 3.22Å
79	V	23	Very low	24.1	Very low	117 Å²	117	116.3 Å²	116.3	71%	0.709	60%	0.602	S	S	*	*			trans	-77.7	109.8	146.7	-176.1	0	0	0	0	103.3	Y77 E81	Y77-V79 PolarHBondContact O-N 3.46Å; V79-E81 VanDerWaalsContact C-N 3.31Å; V79-E81 PolarHBondContact O-N 3.2Å
80	D	23.3	Very low	24	Very low	131 Å²	131	121.2 Å²	121.2	70%	0.701	62%	0.624	S	S	*	*			trans	-54.8	99.5	166.7	-107.8	-24.8	0	0	0	107.4	G82	D80-G82 PolarHBondContact O-N 2.73Å
81	E	24.7	Very low	23.7	Very low	198 Å²	198	129.1 Å²	129.1	93%	0.925	66%	0.662	S	S	*	*			trans	-74.9	63.4	158.3	-74.8	-172.1	172.8	0	0	107.5	V79	V79-E81 VanDerWaalsContact C-N 3.31Å; V79-E81 PolarHBondContact O-N 3.2Å
82	G	22.2	Very low	23.5	Very low	51 Å²	51	132.7 Å²	132.7	53%	0.526	67%	0.67	S	S	.	*			trans	-95.3	121	164.8	0	0	0	0	0	108.9	D80	D80-G82 PolarHBondContact O-N 2.73Å
83	D	23.7	Very low	23.3	Very low	145 Å²	145	141.5 Å²	141.5	78%	0.775	71%	0.71	S	S	*	*			trans	77.6	97.8	160.5	-61.3	-28.3	0	0	0	118.6
84	N	25	Very low	23.3	Very low	137 Å²	137	146.6 Å²	146.6	73%	0.733	72%	0.719	S	S	*	*				-164.4	104.3	108.7	-98.1	-31.4	0	0	0	113.7
85	N	23	Very low	23.2	Very low	128 Å²	128	149.9 Å²	149.9	68%	0.684	74%	0.744	S	S	*	*				29.2	109.6	129.7	-67.2	-42.6	0	0	0	118.6
86	N	22.9	Very low	23.1	Very low	137 Å²	137	147 Å²	147	73%	0.733	75%	0.746	S	S	*	*				162.9	131.9	98.9	-100.9	-33.4	0	0	0	112.6
87	N	23	Very low	23	Very low	130 Å²	130	148.2 Å²	148.2	70%	0.695	76%	0.757	S	S	*	*			trans	48.2	99	145.4	-67.2	-15.9	0	0	0	118.1
88	N	24.3	Very low	22.9	Very low	149 Å²	149	149.5 Å²	149.5	80%	0.797	76%	0.762	S	S	*	*				176.2	130.4	98.5	-84.7	-31.7	0	0	0	110.4
89	N	23.1	Very low	22.9	Very low	148 Å²	148	144.2 Å²	144.2	79%	0.791	75%	0.753	S	S	*	*			trans	-2.8	128.6	152.6	-63.5	-16.9	0	0	0	115.9
90	I	25.4	Very low	22.8	Very low	172 Å²	172	145.4 Å²	145.4	88%	0.882	76%	0.756	S	S	*	*				-171.2	135.8	111.4	-85.6	146	0	0	0	108.7
91	E	21.6	Very low	22.7	Very low	178 Å²	178	149.7 Å²	149.7	83%	0.832	76%	0.763	S	S	*	*			trans	-70.2	159.7	-171.9	-75.7	165.4	128.9	0	0	116
92	Y	23.1	Very low	22.4	Very low	223 Å²	223	150.6 Å²	150.6	88%	0.875	76%	0.76	S	S	*	*			trans	-32.2	154.2	167.3	-60.8	-94.4	0	0	0	119.1
93	E	22.6	Very low	22.4	Very low	200 Å²	200	153.6 Å²	153.6	94%	0.935	77%	0.77	S	S	*	*				-164.6	153.4	105.1	-123.9	177.7	175.7	0	0	114.4
94	Y	24.2	Very low	22.2	Very low	212 Å²	212	154.1 Å²	154.1	83%	0.831	77%	0.773	S	S	*	*			trans	-103.2	147.9	-164.5	-178.1	-89	0	0	0	111.4
95	S	22	Very low	22.1	Very low	114 Å²	114	151.8 Å²	151.8	80%	0.797	77%	0.767	S	S	*	*			trans	-164	114.3	144.5	51.4	0	0	0	0	108.5
96	G	19.9	Very low	22	Very low	46 Å²	46	153.3 Å²	153.3	47%	0.474	78%	0.775	S	S	.	*				76	120.5	98.8	0	0	0	0	0	110.3
97	T	20.9	Very low	22	Very low	117 Å²	117	156.4 Å²	156.4	72%	0.718	78%	0.778	S	S	*	*			cis	172.8	159	41.5	27.2	0	0	0	0	108.6
98	Y	21.8	Very low	21.9	Very low	216 Å²	216	159.1 Å²	159.1	85%	0.847	79%	0.787	S	S	*	*			trans	78.8	141.8	162.9	-59.9	-78.1	0	0	0	119.2
99	S	20.3	Very low	21.8	Very low	80 Å²	80	156.3 Å²	156.3	56%	0.559	78%	0.775	S	S	*	*			cis	176.8	139.6	-36.8	52	0	0	0	0	106.3
100	N	21.3	Very low	21.8	Very low	142 Å²	142	156.7 Å²	156.7	76%	0.759	78%	0.777	S	S	*	*			trans	88.6	130.8	152.6	-56	-24.5	0	0	0	120.9
101	Y	21	Very low	21.6	Very low	220 Å²	220	158.9 Å²	158.9	86%	0.863	78%	0.776	S	S	*	*			trans	91.8	70.8	164.6	-67.4	-82.4	0	0	0	119.3
102	Y	20.1	Very low	21.7	Very low	217 Å²	217	153.2 Å²	153.2	85%	0.851	77%	0.765	S	S	*	*			trans	-93.6	126.2	145.7	-88.7	-91.4	0	0	0	108.9
103	P	20.7	Very low	21.7	Very low	114 Å²	114	152.5 Å²	152.5	74%	0.74	77%	0.77	S	S	*	*			trans	-79.1	113.1	154	28.4	-22.3	0	0	0	108.3	S105	P103-S105 PolarHBondContact O-N 3.28Å
104	N	20.5	Very low	21.7	Very low	157 Å²	157	147.4 Å²	147.4	84%	0.84	76%	0.756	S	S	*	*			trans	-61.8	126.3	160.6	-77.5	-20	0	0	0	108.5
105	S	22.2	Very low	21.7	Very low	87 Å²	87	145.1 Å²	145.1	61%	0.608	76%	0.758	S	S	*	*			trans	-145.6	109.8	158.6	51.7	0	0	0	0	109.3	P103 Y107	P103-S105 PolarHBondContact O-N 3.28Å; S105-Y107 PolarHBondContact O-N 2.91Å
106	D	20.4	Very low	21.9	Very low	160 Å²	160	146.2 Å²	146.2	86%	0.856	75%	0.751	S	S	*	*			trans	-61.2	118.8	171.5	-63.6	-52.5	0	0	0	109.8
107	Y	22.6	Very low	22	Very low	202 Å²	202	151.3 Å²	151.3	79%	0.792	76%	0.757	S	S	*	*			trans	-134.8	113.3	165.2	-79.4	-77.2	0	0	0	110.3	S105 V109	S105-Y107 PolarHBondContact O-N 2.91Å; Y107-V109 PolarHBondContact O-N 2.87Å
108	E	22	Very low	22.2	Very low	187 Å²	187	152.9 Å²	152.9	87%	0.874	75%	0.751	S	S	*	*			trans	-64.7	114.9	173.3	-70.4	180	150.2	0	0	110.3	N110	E108-N110 PolarHBondContact O-N 3.12Å
109	V	23	Very low	22.4	Very low	91 Å²	91	144.1 Å²	144.1	55%	0.552	73%	0.726	S	S	*	*			trans	-81.6	102.7	174.9	-179.3	0	0	0	0	108.4	Y107 Y111	Y107-V109 PolarHBondContact O-N 2.87Å; V109-Y111 HydrophobicContact CB-CE2 4.36Å; V109-Y111 HydrophobicContact CG1-CD2 4.26Å; V109-Y111 HydrophobicContact CG1-CE2 4.04Å; V109-Y111 WeakPolarHBondContact O-CD2 3.22Å; V109-Y111 PolarHBondContact O-N 3.13Å
110	N	21.9	Very low	22.6	Very low	156 Å²	156	144.3 Å²	144.3	83%	0.834	73%	0.725	S	S	*	*			trans	-80.3	106.2	167.3	-86.1	-47.2	0	0	0	109.2	E108 G112	E108-N110 PolarHBondContact O-N 3.12Å; N110-G112 PolarHBondContact O-N 3.05Å
111	Y	22	Very low	23	Very low	217 Å²	217	138.4 Å²	138.4	85%	0.851	69%	0.694	S	S	*	*			trans	-65.4	113.8	177.9	-73.6	-94.4	0	0	0	110.9	V109	V109-Y111 HydrophobicContact CB-CE2 4.36Å; V109-Y111 HydrophobicContact CG1-CD2 4.26Å; V109-Y111 HydrophobicContact CG1-CE2 4.04Å; V109-Y111 WeakPolarHBondContact O-CD2 3.22Å; V109-Y111 PolarHBondContact O-N 3.13Å
112	G	23.4	Very low	23.1	Very low	60 Å²	60	135 Å²	135	62%	0.619	69%	0.686	S	S	*	*			trans	-106.5	131.6	162.9	0	0	0	0	0	109.1	N110 S114	N110-G112 PolarHBondContact O-N 3.05Å; G112-S114 VanDerWaalsContact C-N 3.31Å; G112-S114 PolarHBondContact O-N 3.39Å
113	E	22.4	Very low	23.3	Very low	208 Å²	208	128.9 Å²	128.9	97%	0.972	66%	0.662	S	S	*	*	S	Bend	trans	-64.2	77.3	-176	-62.6	173.5	158.2	0	0	112.5
114	S	23.9	Very low	23.4	Very low	92 Å²	92	128 Å²	128	64%	0.643	66%	0.658	S	S	*	*	S	Bend	trans	-168.5	110.2	163.6	55	0	0	0	0	110.4	G112 Q116	G112-S114 VanDerWaalsContact C-N 3.31Å; G112-S114 PolarHBondContact O-N 3.39Å; S114-Q116 PolarHBondContact O-N 2.96Å
115	D	24.1	Very low	23.6	Very low	164 Å²	164	122.7 Å²	122.7	88%	0.877	64%	0.642	S	S	*	*			trans	-69.2	73.2	-171.8	-64	-43.3	0	0	0	114.5
116	Q	24.9	Very low	23.7	Very low	137 Å²	137	123.8 Å²	123.8	64%	0.64	65%	0.645	S	S	*	*			trans	-135.4	121.7	172.6	-65.8	-176.1	-1	0	0	111	S114	S114-Q116 PolarHBondContact O-N 2.96Å
117	Y	22.9	Very low	23.8	Very low	154 Å²	154	126.8 Å²	126.8	60%	0.604	65%	0.645	S	S	*	*			trans	-127.5	126.3	177.4	-144.5	-54.8	0	0	0	111.4	Y75	Y75-Y117 HydrophobicContact CD1-CD1 4.37Å; Y75-Y117 HydrophobicContact CD1-CD2 4.25Å; Y75-Y117 AromaticContact CD1-CG 3.97Å; Y75-Y117 HydrophobicContact CD1-CG 3.97Å; Y75-Y117 AromaticContact CE1-CD1 3.29Å; Y75-Y117 HydrophobicContact CE1-CD1 3.29Å; Y75-Y117 AromaticContact CE1-CD2 3.64Å; Y75-Y117 HydrophobicContact CE1-CD2 3.64Å; Y75-Y117 AromaticContact CE1-CE1 3.59Å; Y75-Y117 HydrophobicContact CE1-CE1 3.59Å; Y75-Y117 AromaticContact CE1-CE2 3.94Å; Y75-Y117 HydrophobicContact CE1-CE2 3.94Å; Y75-Y117 AromaticContact CE1-CG 3.25Å; Y75-Y117 HydrophobicContact CE1-CG 3.25Å; Y75-Y117 AromaticContact CE1-CZ 3.87Å; Y75-Y117 AromaticContact CE2-CD1 3.66Å; Y75-Y117 HydrophobicContact CE2-CD1 3.66Å; Y75-Y117 HydrophobicContact CE2-CE1 4.46Å; Y75-Y117 AromaticContact CE2-CG 3.91Å; Y75-Y117 HydrophobicContact CE2-CG 3.91Å; Y75-Y117 AromaticContact CZ-CD1 2.9Å; Y75-Y117 AromaticContact CZ-CE1 3.37Å; Y75-Y117 AromaticContact CZ-CG 3.3Å; Y75-Y117 WeakPolarHBondContact OH-CD1 3.28Å; Y75-Y117 WeakPolarHBondContact OH-CE1 3.32Å
118	Y	25.1	Very low	23.8	Very low	150 Å²	150	123.5 Å²	123.5	59%	0.588	64%	0.642	S	S	*	*			trans	-97.8	129	178.8	-68	-99.4	0	0	0	110.4	Y75	Y75-Y118 PolarHBondContact OH-O 3.43Å
119	G	26	Very low	23.8	Very low	31 Å²	31	120.7 Å²	120.7	32%	0.32	63%	0.633	S	S	.	*			trans	-120.5	135.4	176.1	0	0	0	0	0	112.5
120	P	24.2	Very low	23.8	Very low	85 Å²	85	126.3 Å²	126.3	55%	0.552	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-75.3	137.9	172.3	29.7	-31.7	0	0	0	111.5	Y430	P120-Y430 HydrophobicContact CB-CE1 4.03Å
121	V	29	Very low	23.8	Very low	17 Å²	17	126.8 Å²	126.8	10%	0.103	64%	0.643	C	S	.	*	P	Polyproline II helix	trans	-92.5	123.7	167.8	-178	0	0	0	0	108.4	Y70 V72	Y70-V121 HydrophobicContact CD1-CG1 4.33Å; V72-V121 HydrophobicContact CG2-CG2 4.35Å
122	E	23.8	Very low	23.8	Very low	150 Å²	150	123 Å²	123	70%	0.701	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-93.5	142.4	173.7	-74.2	-168.8	153.4	0	0	111.8	S124	E122-S124 PolarHBondContact O-N 3.11Å
123	Y	24.6	Very low	23.8	Very low	88 Å²	88	127.1 Å²	127.1	35%	0.345	65%	0.645	S	S	.	*			trans	-73.6	108.5	179.4	-74.6	-103.6	0	0	0	109.6	Y70 G125 N427 K428	Y70-Y123 HydrophobicContact CE1-CD1 4.12Å; Y70-Y123 AromaticContact CE1-CE1 3.89Å; Y70-Y123 HydrophobicContact CE1-CE1 3.89Å; Y123-G125 PolarHBondContact O-N 3.08Å; Y123-N427 WeakPolarHBondContact CE2-O 3.42Å; Y123-N427 PolarHBondContact OH-O 3.12Å; Y123-K428 HydrophobicContact CE2-CG 4.05Å
124	S	23.5	Very low	23.7	Very low	94 Å²	94	124.3 Å²	124.3	66%	0.657	64%	0.637	S	S	*	*			trans	-86.1	69.9	159.2	62.8	0	0	0	0	108.9	E122	E122-S124 PolarHBondContact O-N 3.11Å
125	G	24	Very low	23.6	Very low	47 Å²	47	129.9 Å²	129.9	49%	0.485	65%	0.645	S	S	.	*			trans	-96.1	110.3	168.6	0	0	0	0	0	108.6	Y123 Y127	Y123-G125 PolarHBondContact O-N 3.08Å; G125-Y127 VanDerWaalsContact C-N 3.34Å; G125-Y127 PolarHBondContact O-N 3.33Å
126	T	23.7	Very low	23.4	Very low	110 Å²	110	129.5 Å²	129.5	68%	0.675	64%	0.643	S	S	*	*			trans	-60.8	97.5	167.6	40.8	0	0	0	0	108.8	N128	T126-N128 PolarHBondContact O-N 2.85Å
127	Y	23.7	Very low	23.3	Very low	222 Å²	222	129.1 Å²	129.1	87%	0.871	65%	0.65	S	S	*	*			trans	-67	103.8	162.8	-96	-96.2	0	0	0	107.7	G125	G125-Y127 VanDerWaalsContact C-N 3.34Å; G125-Y127 PolarHBondContact O-N 3.33Å
128	N	21.8	Very low	23.1	Very low	134 Å²	134	129.4 Å²	129.4	72%	0.717	66%	0.657	S	S	*	*			trans	-80.9	127	157.2	-76.7	-20.3	0	0	0	107.7	T126	T126-N128 PolarHBondContact O-N 2.85Å
129	D	21.2	Very low	22.9	Very low	127 Å²	127	131.5 Å²	131.5	68%	0.679	67%	0.665	S	S	*	*			trans	79.8	137.5	158	-52.7	-30.5	0	0	0	119.2
130	Y	23.8	Very low	22.7	Very low	209 Å²	209	136.3 Å²	136.3	82%	0.82	68%	0.684	S	S	*	*			trans	98.5	86	166.5	-58.5	-76.4	0	0	0	118
131	E	21.9	Very low	22.5	Very low	167 Å²	167	140.7 Å²	140.7	78%	0.78	70%	0.697	S	S	*	*				28.8	127.6	123	-70.5	178.3	159	0	0	118.9
132	D	21.1	Very low	22.1	Very low	136 Å²	136	150.9 Å²	150.9	73%	0.727	74%	0.735	S	S	*	*			trans	49.1	109.1	146.4	-64.5	-17.5	0	0	0	117.5
133	N	24.1	Very low	22	Very low	148 Å²	148	154.2 Å²	154.2	79%	0.791	74%	0.743	S	S	*	*				-175.1	114.2	119.6	-88.5	-47.4	0	0	0	111.1	Y135	N133-Y135 PolarHBondContact O-N 3.41Å
134	D	20.9	Very low	22.1	Very low	149 Å²	149	155.2 Å²	155.2	80%	0.797	76%	0.76	S	S	*	*			trans	-43.2	121.6	156	-104.3	-33.8	0	0	0	111.2
135	Y	21.2	Very low	21.9	Very low	208 Å²	208	162.8 Å²	162.8	82%	0.816	77%	0.774	S	S	*	*			trans	-145.6	94	149.2	-87	-72.2	0	0	0	110.9	N133 T137	N133-Y135 PolarHBondContact O-N 3.41Å; Y135-T137 PolarHBondContact O-N 3.16Å
136	N	20.9	Very low	21.8	Very low	156 Å²	156	171.3 Å²	171.3	83%	0.834	79%	0.792	S	S	*	*			trans	-42.1	118.4	146.8	-88.2	-41.4	0	0	0	110.1
137	T	22.2	Very low	21.7	Very low	130 Å²	130	173.1 Å²	173.1	80%	0.798	80%	0.797	S	S	*	*			trans	-150.4	107.3	151.9	-18.6	0	0	0	0	111	Y135	Y135-T137 PolarHBondContact O-N 3.16Å
138	Q	19.2	Very low	21.6	Very low	159 Å²	159	167.7 Å²	167.7	74%	0.743	79%	0.787	S	S	*	*			trans	-72.2	169.9	163	-107.9	174.9	-29.5	0	0	111
139	Y	20.9	Very low	21.6	Very low	195 Å²	195	170.8 Å²	170.8	77%	0.765	79%	0.794	S	S	*	*			trans	90.5	136.7	169.7	-56.1	-74.4	0	0	0	115.2
140	D	21.5	Very low	21.6	Very low	132 Å²	132	171.5 Å²	171.5	71%	0.706	80%	0.799	S	S	*	*			cis	-162.7	161.5	1.6	-114.5	-26.6	0	0	0	110.5
141	E	20.2	Very low	21.6	Very low	176 Å²	176	168.1 Å²	168.1	82%	0.822	80%	0.795	S	S	*	*			trans	-45.7	145.3	178.2	-61.8	169.9	143.3	0	0	116.5
142	Y	21	Very low	21.6	Very low	232 Å²	232	170 Å²	170	91%	0.91	80%	0.796	S	S	*	*			trans	-153.7	112.5	152.2	-131.6	-91.8	0	0	0	112.4
143	Y	21	Very low	21.7	Very low	219 Å²	219	171 Å²	171	86%	0.859	80%	0.796	S	S	*	*			trans	-129.3	173.6	165.1	-97	-77.9	0	0	0	107.2
144	P	25.7	Very low	21.6	Very low	110 Å²	110	169.9 Å²	169.9	71%	0.714	80%	0.795	S	S	*	*				-124.2	175.7	-69.8	29.9	-9.1	0	0	0	112.3
145	R	20.4	Very low	21.6	Very low	253 Å²	253	174.8 Å²	174.8	96%	0.955	80%	0.802	S	S	*	*			trans	-142.4	120.3	155	-84.3	-165.5	-176	-169.3	0.7	112.9
146	R	20.9	Very low	21.6	Very low	226 Å²	226	170.6 Å²	170.6	85%	0.853	80%	0.799	S	S	*	*			trans	-58.8	152	153.6	-77.9	177.3	168.4	179.2	-3.5	109.7
147	D	22	Very low	21.7	Very low	147 Å²	147	169.2 Å²	169.2	79%	0.786	80%	0.796	S	S	*	*				168.9	136.6	124.8	-88.6	-14.1	0	0	0	114.2
148	V	21.5	Very low	21.7	Very low	109 Å²	109	174.3 Å²	174.3	66%	0.661	80%	0.8	S	S	*	*			trans	66.6	128.6	153.8	-121.4	0	0	0	0	118.8
149	F	22.4	Very low	21.8	Very low	198 Å²	198	177.3 Å²	177.3	87%	0.868	81%	0.805	S	S	*	*				-157.5	145	51.4	-99.4	-85.9	0	0	0	115.8
150	N	21.8	Very low	21.9	Very low	143 Å²	143	175.9 Å²	175.9	77%	0.765	81%	0.805	S	S	*	*			trans	-72.6	166.5	171.5	-80.5	-35.8	0	0	0	114.6
151	N	22.2	Very low	22	Very low	138 Å²	138	174.3 Å²	174.3	74%	0.738	80%	0.802	S	S	*	*			trans	92.9	108.1	155.6	-63.9	-22.1	0	0	0	117.3
152	Y	23.4	Very low	22.1	Very low	206 Å²	206	170.7 Å²	170.7	81%	0.808	80%	0.796	S	S	*	*				-164.1	111	100.7	-99	-79.1	0	0	0	111.7
153	Q	22.4	Very low	22.2	Very low	157 Å²	157	165.3 Å²	165.3	73%	0.734	79%	0.793	S	S	*	*			trans	51.2	102.5	140	-67.5	175.3	-10.1	0	0	120.2
154	T	21.4	Very low	22.3	Very low	125 Å²	125	158.2 Å²	158.2	77%	0.767	79%	0.786	S	S	*	*				53.6	108.9	86.6	60.3	0	0	0	0	117.1
155	R	21.4	Very low	22.2	Very low	252 Å²	252	160.5 Å²	160.5	95%	0.951	79%	0.787	S	S	*	*				-155.4	119.4	118.2	-119.1	178.4	-179.3	-174.6	0.6	112.7
156	T	21.1	Very low	22.5	Very low	120 Å²	120	158.1 Å²	158.1	74%	0.736	78%	0.779	S	S	*	*			trans	-93.5	170.4	175.2	26.6	0	0	0	0	111.6
157	T	22.2	Very low	22.8	Very low	127 Å²	127	153.9 Å²	153.9	78%	0.779	77%	0.774	S	S	*	*			trans	89.8	127.9	161.6	76.3	0	0	0	0	114.7
158	R	23.3	Very low	23	Very low	236 Å²	236	153 Å²	153	89%	0.891	77%	0.769	S	S	*	*			cis	-146.2	139.1	35.3	-73.7	176.2	167.9	179.8	-5.6	113.3
159	R	21.9	Very low	23.2	Very low	223 Å²	223	156.4 Å²	156.4	84%	0.842	77%	0.771	S	S	*	*			trans	-68.3	147.8	155.4	-72.9	174.4	164.6	175.3	-5	110.4
160	H	23	Very low	23.5	Very low	164 Å²	164	153.9 Å²	153.9	76%	0.759	76%	0.762	S	S	*	*				156.6	157.9	119.2	-97	-70.1	0	0	0	112.4
161	P	23.2	Very low	24	Very low	100 Å²	100	155.4 Å²	155.4	65%	0.649	76%	0.762	S	S	*	*				-129.7	-172.1	-115.9	41.4	-22.7	0	0	0	114.9
162	S	22.5	Very low	24.3	Very low	99 Å²	99	155.3 Å²	155.3	69%	0.692	76%	0.761	S	S	*	*			trans	71.7	113.6	147.7	64.9	0	0	0	0	121.4
163	S	22.1	Very low	24.7	Very low	120 Å²	120	153.2 Å²	153.2	84%	0.839	76%	0.764	S	S	*	*				51	134	128.2	66.3	0	0	0	0	121.7
164	G	23.8	Very low	24.9	Very low	69 Å²	69	156.5 Å²	156.5	71%	0.711	77%	0.771	S	S	*	*			trans	108	136.2	168.8	0	0	0	0	0	109.8
165	E	24.2	Very low	25.2	Very low	159 Å²	159	154 Å²	154	74%	0.743	77%	0.77	S	S	*	*			cis	174.8	145.2	12.6	-127	174.6	-161.9	0	0	104.5
166	Y	25.8	Very low	25.5	Very low	202 Å²	202	148.9 Å²	148.9	79%	0.792	76%	0.762	S	S	*	*			trans	81.4	124.5	161.8	-61.8	-74.4	0	0	0	123.1
167	N	26.3	Very low	25.9	Very low	137 Å²	137	151 Å²	151	73%	0.733	76%	0.764	S	S	*	*			trans	-55.3	157.4	163	-57.2	-45.4	0	0	0	112.8
168	D	27.4	Very low	26.2	Very low	128 Å²	128	150.3 Å²	150.3	68%	0.684	76%	0.755	S	S	*	*				167.6	129.3	110	-95.2	-9.1	0	0	0	114.8
169	Y	25.6	Very low	26.3	Very low	182 Å²	182	145 Å²	145	71%	0.714	74%	0.744	S	S	*	*			trans	63.2	133.6	136.4	-71.5	-63.7	0	0	0	124.2
170	Q	29.1	Very low	26.6	Very low	144 Å²	144	143.1 Å²	143.1	67%	0.673	74%	0.738	S	S	*	*			trans	80.2	139.8	143.4	-70	171	40.2	0	0	116.4
171	K	31.8	Very low	26.7	Very low	176 Å²	176	143.4 Å²	143.4	77%	0.765	74%	0.74	S	S	*	*			cis	-168.6	156.5	16.7	-123.2	162.2	-176.2	156.7	0	108.9
172	N	28.2	Very low	26.8	Very low	136 Å²	136	141.6 Å²	141.6	73%	0.727	74%	0.74	S	S	*	*			trans	-54.2	158.9	174.1	-56.1	-42.9	0	0	0	114.3
173	D	31.7	Very low	27	Very low	162 Å²	162	143.9 Å²	143.9	87%	0.866	74%	0.744	S	S	*	*				-164.4	153.7	122.4	-95.2	-26.7	0	0	0	115.3
174	Y	26.3	Very low	27.2	Very low	226 Å²	226	145.5 Å²	145.5	89%	0.886	74%	0.741	S	S	*	*			trans	-76	166.9	-160.8	-84.3	-108.7	0	0	0	118.3
175	G	29.1	Very low	27.3	Very low	72 Å²	72	151.6 Å²	151.6	74%	0.742	75%	0.745	S	S	*	*			trans	142.5	81.4	148.2	0	0	0	0	0	112.6
176	N	27.7	Very low	27.4	Very low	145 Å²	145	151 Å²	151	78%	0.775	75%	0.746	S	S	*	*				61.8	127.1	77.8	-152.5	25.6	0	0	0	114.8
177	E	28.4	Very low	27.3	Very low	165 Å²	165	148 Å²	148	77%	0.771	74%	0.744	S	S	*	*			trans	153	102.1	146	-82.9	-175.4	-167.4	0	0	109.3
178	N	27.9	Very low	27.1	Very low	111 Å²	111	151.1 Å²	151.1	59%	0.594	75%	0.747	S	S	*	*				80.2	130.7	94.3	-73.7	-7.6	0	0	0	111.2
179	N	26.8	Very low	27	Very low	124 Å²	124	151 Å²	151	66%	0.663	75%	0.746	S	S	*	*			cis	-172.1	172.2	15.5	-89.5	-32	0	0	0	108.3
180	Y	26.7	Very low	26.8	Very low	184 Å²	184	146.5 Å²	146.5	72%	0.722	74%	0.741	S	S	*	*			trans	90.7	92.2	162.6	-74.3	-87.3	0	0	0	116.7
181	E	25.5	Very low	26.5	Very low	171 Å²	171	149.7 Å²	149.7	80%	0.799	75%	0.749	S	S	*	*				78	125	86.4	-79.9	-177.3	-167.5	0	0	111
182	G	26.5	Very low	26	Very low	62 Å²	62	147.9 Å²	147.9	64%	0.639	75%	0.748	S	S	*	*			cis	-172.5	158.2	7.5	0	0	0	0	0	110.4
183	D	25.7	Very low	25.7	Very low	147 Å²	147	147.1 Å²	147.1	79%	0.786	75%	0.748	S	S	*	*			trans	50.7	119.3	143.9	-50.4	-29	0	0	0	119.4
184	I	27	Very low	25.2	Very low	153 Å²	153	147.9 Å²	147.9	79%	0.785	74%	0.743	S	S	*	*				176.6	108.5	95.6	-81.1	163.5	0	0	0	108.5
185	Y	25	Very low	25	Very low	198 Å²	198	143.9 Å²	143.9	78%	0.776	74%	0.738	S	S	*	*			trans	39.3	115	132.8	-79.5	-96.8	0	0	0	120.3
186	N	27.1	Very low	24.7	Very low	145 Å²	145	146.8 Å²	146.8	78%	0.775	74%	0.741	S	S	*	*				178.6	128.3	89.1	-95.7	-36.3	0	0	0	112.4
187	D	23.1	Very low	24.5	Very low	140 Å²	140	146.2 Å²	146.2	75%	0.749	74%	0.742	S	S	*	*			trans	-47.1	153.8	165.2	-94.9	-45.1	0	0	0	114.2
188	Y	22.6	Very low	24.1	Very low	202 Å²	202	144.7 Å²	144.7	79%	0.792	74%	0.74	S	S	*	*				176.8	121.3	110.7	-98.5	-71.6	0	0	0	111.9
189	N	25.2	Very low	23.9	Very low	125 Å²	125	146.9 Å²	146.9	67%	0.668	75%	0.751	S	S	*	*			trans	63.4	99.5	146.4	-61.8	-17	0	0	0	118.2
190	S	21.4	Very low	23.7	Very low	88 Å²	88	150.8 Å²	150.8	62%	0.615	76%	0.757	S	S	*	*				39.1	103.7	75.3	84.3	0	0	0	0	113.5
191	Y	22	Very low	23.5	Very low	212 Å²	212	147 Å²	147	83%	0.831	75%	0.749	S	S	*	*				178.9	115.8	123.2	-97.1	-72.3	0	0	0	110.3
192	N	22.1	Very low	23.5	Very low	138 Å²	138	146.6 Å²	146.6	74%	0.738	74%	0.741	S	S	*	*			trans	3.8	128.1	147.1	-68.1	-26	0	0	0	116.7
193	T	22.1	Very low	23.4	Very low	119 Å²	119	147 Å²	147	73%	0.73	74%	0.735	S	S	*	*				173.6	132.1	96	21.6	0	0	0	0	112.4
194	K	22.2	Very low	23.3	Very low	178 Å²	178	146.3 Å²	146.3	77%	0.774	73%	0.73	S	S	*	*			trans	68.7	125.4	139.5	-68.5	175.4	177.2	179.2	0	119.7
195	N	21.6	Very low	23.1	Very low	143 Å²	143	143.1 Å²	143.1	77%	0.765	72%	0.715	S	S	*	*				40.5	117.2	129.1	-61.4	-7	0	0	0	115.6
196	T	22.5	Very low	23	Very low	132 Å²	132	135.7 Å²	135.7	81%	0.81	69%	0.691	S	S	*	*				-174.4	154.6	55.2	21.3	0	0	0	0	109.1	D198	T196-D198 PolarHBondContact O-N 3.1Å
197	V	22.7	Very low	22.8	Very low	133 Å²	133	135.1 Å²	135.1	81%	0.806	69%	0.692	S	S	*	*			trans	-49.7	115.7	164.5	177.3	0	0	0	0	109.9
198	D	20.8	Very low	22.7	Very low	134 Å²	134	131.9 Å²	131.9	72%	0.717	68%	0.678	S	S	*	*			trans	168.4	140.6	148.7	-84.8	-27	0	0	0	108	T196	T196-D198 PolarHBondContact O-N 3.1Å
199	D	23.3	Very low	22.7	Very low	157 Å²	157	124.7 Å²	124.7	84%	0.84	66%	0.657	S	S	*	*			trans	121	64.7	177.8	-65.2	-19.5	0	0	0	114.2	D201	D199-D201 PolarHBondContact O-N 3.1Å
200	R	22.6	Very low	22.5	Very low	206 Å²	206	125.7 Å²	125.7	78%	0.777	65%	0.653	S	S	*	*			trans	-75.6	86.6	153.5	-69.5	-170.9	-151.8	178.2	7.8	108.1	Y202	R200-Y202 HydrophobicContact CB-CE2 4.08Å; R200-Y202 WeakPolarHBondContact O-CD2 3.26Å; R200-Y202 PolarHBondContact O-N 2.66Å
201	D	23.8	Very low	22.6	Very low	103 Å²	103	130 Å²	130	55%	0.551	66%	0.66	S	S	*	*			trans	-69.4	93.5	178.3	-168.9	6.3	0	0	0	111.3	D199 S203	D199-D201 PolarHBondContact O-N 3.1Å; D201-S203 PolarHBondContact O-N 2.87Å; D201-S203 VanDerWaalsContact O-N 3.16Å; D201-S203 WeakPolarHBondContact OD1-CB 3.34Å; D201-S203 PolarHBondContact OD1-N 2.88Å; D201-S203 PolarHBondContact OD1-OG 3.03Å; D201-S203 PolarHBondContact OD2-OG 2.98Å
202	Y	25.3	Very low	22.8	Very low	164 Å²	164	124.1 Å²	124.1	64%	0.643	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-71.7	8.1	174.1	-68.4	-79.7	0	0	0	113.5	R200 N204	R200-Y202 HydrophobicContact CB-CE2 4.08Å; R200-Y202 WeakPolarHBondContact O-CD2 3.26Å; R200-Y202 PolarHBondContact O-N 2.66Å; Y202-N204 VanDerWaalsContact C-N 3.32Å; Y202-N204 PolarHBondContact O-N 2.79Å
203	S	22.7	Very low	22.9	Very low	71 Å²	71	122.1 Å²	122.1	50%	0.497	63%	0.627	S	S	.	*	G	3₁₀ helix	trans	-73.9	-17.5	176.7	72.9	0	0	0	0	114	D201	D201-S203 PolarHBondContact O-N 2.87Å; D201-S203 VanDerWaalsContact O-N 3.16Å; D201-S203 WeakPolarHBondContact OD1-CB 3.34Å; D201-S203 PolarHBondContact OD1-N 2.88Å; D201-S203 PolarHBondContact OD1-OG 3.03Å; D201-S203 PolarHBondContact OD2-OG 2.98Å
204	N	24.1	Very low	22.9	Very low	131 Å²	131	123.7 Å²	123.7	70%	0.701	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-96.1	11.8	-174.1	-74.7	-51.7	0	0	0	115.6	Y202	Y202-N204 VanDerWaalsContact C-N 3.32Å; Y202-N204 PolarHBondContact O-N 2.79Å
205	L	23.6	Very low	23	Very low	86 Å²	86	120.2 Å²	120.2	45%	0.45	61%	0.606	S	S	.	*	S	Bend	trans	-66.7	122.9	163.7	-79.3	168.7	0	0	0	108.2	T207	L205-T207 PolarHBondContact O-N 2.8Å
206	P	22.3	Very low	23.3	Very low	42 Å²	42	115.3 Å²	115.3	27%	0.273	58%	0.581	S	S	.	*			trans	-61.5	119.3	-177	21.6	-26.7	0	0	0	108.2	T208 L409	P206-T208 HydrophobicContact CB-CG2 3.74Å; P206-T208 PolarHBondContact O-N 2.79Å; P206-T208 PolarHBondContact O-OG1 2.85Å; P206-L409 HydrophobicContact CB-CD1 4.07Å; P206-L409 HydrophobicContact CG-CD1 4.08Å
207	T	22.5	Very low	23.5	Very low	133 Å²	133	111.2 Å²	111.2	82%	0.816	56%	0.557	S	S	*	*			trans	-61.7	21	168.6	39.9	0	0	0	0	112.3	L205 S209	L205-T207 PolarHBondContact O-N 2.8Å; T207-S209 PolarHBondContact O-N 3.02Å; T207-S209 VanDerWaalsContact O-N 3.07Å
208	T	21.6	Very low	23.5	Very low	72 Å²	72	113.3 Å²	113.3	44%	0.442	56%	0.557	S	S	.	*			trans	-73.9	108.5	-167.4	45.3	0	0	0	0	110.4	P206 H212	P206-T208 HydrophobicContact CB-CG2 3.74Å; P206-T208 PolarHBondContact O-N 2.79Å; P206-T208 PolarHBondContact O-OG1 2.85Å; T208-H212 PolarHBondContact O-CE1 2.73Å; T208-H212 VanDerWaalsContact O-CE1 3.26Å
209	S	21.6	Very low	23.7	Very low	51 Å²	51	113.8 Å²	113.8	36%	0.357	55%	0.549	S	S	.	.			trans	85.7	92.7	151.6	159.6	0	0	0	0	115.4	T207 K211 H212	T207-S209 PolarHBondContact O-N 3.02Å; T207-S209 VanDerWaalsContact O-N 3.07Å; S209-K211 PolarHBondContact O-N 3.05Å; S209-K211 WeakPolarHBondContact OG-CA 3.41Å; S209-K211 WeakPolarHBondContact OG-CB 3.42Å; S209-K211 PolarHBondContact OG-N 3.09Å; S209-K211 VanDerWaalsContact OG-N 3.09Å; S209-H212 PolarHBondContact O-N 2.78Å; S209-H212 PolarHBondContact O-ND1 3.4Å; S209-H212 PolarHBondContact OG-CE1 2.78Å; S209-H212 PolarHBondContact OG-ND1 3.04Å
210	Y	21.9	Very low	23.8	Very low	147 Å²	147	107.5 Å²	107.5	58%	0.576	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-55.5	-0.1	149.6	-94.1	-96.6	0	0	0	113.7	H212 K240	Y210-H212 PolarHBondContact O-N 3.05Å; Y210-K240 WeakPolarHBondContact OH-CE 3.32Å; Y210-K240 PolarHBondContact OH-NZ 3.39Å
211	K	23.1	Very low	24	Very low	177 Å²	177	101.3 Å²	101.3	77%	0.77	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-76.8	-6.6	173.2	-57.3	178.7	170.1	177.7	0	113.5	S209 Q213 K214	S209-K211 PolarHBondContact O-N 3.05Å; S209-K211 WeakPolarHBondContact OG-CA 3.41Å; S209-K211 WeakPolarHBondContact OG-CB 3.42Å; S209-K211 PolarHBondContact OG-N 3.09Å; S209-K211 VanDerWaalsContact OG-N 3.09Å; K211-Q213 PolarHBondContact O-N 3.09Å; K211-K214 PolarHBondContact O-N 3Å
212	H	26.4	Very low	24.2	Very low	90 Å²	90	103.3 Å²	103.3	42%	0.417	50%	0.497	S	S	.	.	G	3₁₀ helix	trans	-72.1	-2.9	177.1	-62.3	110.4	0	0	0	114.2	T208 S209 Y210 K214	T208-H212 PolarHBondContact O-CE1 2.73Å; T208-H212 VanDerWaalsContact O-CE1 3.26Å; S209-H212 PolarHBondContact O-N 2.78Å; S209-H212 PolarHBondContact O-ND1 3.4Å; S209-H212 PolarHBondContact OG-CE1 2.78Å; S209-H212 PolarHBondContact OG-ND1 3.04Å; Y210-H212 PolarHBondContact O-N 3.05Å; H212-K214 VanDerWaalsContact C-N 3.28Å; H212-K214 PolarHBondContact O-N 3.33Å
213	Q	23.6	Very low	24.6	Very low	96 Å²	96	96.6 Å²	96.6	45%	0.449	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-79.5	-4	174.4	-69.8	-178.4	-17.8	0	0	114.2	K211	K211-Q213 PolarHBondContact O-N 3.09Å
214	K	23	Very low	25.1	Very low	151 Å²	151	98.4 Å²	98.4	66%	0.657	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-103.4	15.6	-176.9	-81.9	-170.2	173.5	-173.9	0	115.3	K211 H212 V216	K211-K214 PolarHBondContact O-N 3Å; H212-K214 VanDerWaalsContact C-N 3.28Å; H212-K214 PolarHBondContact O-N 3.33Å; K214-V216 PolarHBondContact O-N 3.37Å; K214-V216 VanDerWaalsContact O-N 3.07Å
215	Y	25.1	Very low	25.6	Very low	105 Å²	105	92.9 Å²	92.9	41%	0.412	45%	0.45	S	S	.	.			trans	-85.4	74.5	179.6	-101.4	-77.7	0	0	0	113	Y237 L366 T368	Y215-Y237 WeakPolarHBondContact O-CE1 3.27Å; Y215-Y237 PolarHBondContact O-OH 2.74Å; Y215-Y237 VanDerWaalsContact O-OH 3.12Å; Y215-L366 HydrophobicContact CD1-CD2 4.47Å; Y215-L366 HydrophobicContact CE1-CD2 3.41Å; Y215-L366 VanDerWaalsContact CE1-CD2 3.41Å; Y215-T368 WeakPolarHBondContact OH-CG2 3.27Å
216	V	25.9	Very low	26.3	Very low	41 Å²	41	89 Å²	89	25%	0.248	43%	0.43	C	S	.	.			trans	-91.2	127.1	153.7	178.2	0	0	0	0	105.4	K214 H218 Y237 I251	K214-V216 PolarHBondContact O-N 3.37Å; K214-V216 VanDerWaalsContact O-N 3.07Å; V216-H218 VanDerWaalsContact C-N 3.27Å; V216-H218 PolarHBondContact O-N 3.16Å; V216-Y237 WeakPolarHBondContact CG2-OH 3.33Å; V216-I251 HydrophobicContact CG1-CD1 3.76Å
217	P	26.7	Very low	27.2	Very low	45 Å²	45	92.3 Å²	92.3	29%	0.292	44%	0.438	S	S	.	.			trans	-58.1	100.7	167.3	22.5	-26.4	0	0	0	106.6	R219 L233 I235	P217-R219 PolarHBondContact O-N 3Å; P217-L233 HydrophobicContact CG-CD2 4.18Å; P217-I235 HydrophobicContact CG-CD1 4.11Å
218	H	24.3	Very low	28	Very low	177 Å²	177	88 Å²	88	82%	0.819	41%	0.412	S	S	*	.	S	Bend	trans	-57.8	-7.6	-174	-102.6	-87.4	0	0	0	113.2	V216	V216-H218 VanDerWaalsContact C-N 3.27Å; V216-H218 PolarHBondContact O-N 3.16Å
219	R	24	Very low	28.7	Very low	145 Å²	145	85.3 Å²	85.3	55%	0.547	40%	0.395	S	S	.	.			trans	-149.7	90	-174.9	-79.2	-178.2	179.9	-169.1	6.6	108.7	P217 I221 Y222	P217-R219 PolarHBondContact O-N 3Å; R219-I221 HydrophobicContact CB-CD1 4.02Å; R219-I221 HydrophobicContact CB-CG1 3.56Å; R219-I221 HydrophobicContact CG-CD1 3.99Å; R219-I221 HydrophobicContact CG-CG1 4.11Å; R219-I221 PolarHBondContact O-N 3.31Å; R219-Y222 HydrophobicContact CB-CD2 3.44Å; R219-Y222 VanDerWaalsContact CB-CD2 3.44Å; R219-Y222 HydrophobicContact CB-CE2 3.59Å; R219-Y222 HydrophobicContact CG-CD2 4.39Å; R219-Y222 HydrophobicContact CG-CE2 4.06Å; R219-Y222 PolarHBondContact NH1-OH 2.77Å; R219-Y222 VanDerWaalsContact NH1-OH 3.1Å; R219-Y222 PolarHBondContact O-N 3.04Å
220	I	26.4	Very low	29.8	Very low	25 Å²	25	85.2 Å²	85.2	13%	0.128	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-48	-30.8	170.8	-67.1	164.4	0	0	0	111.4	Y222 L223 L233 I251 L253	I220-Y222 PolarHBondContact O-N 2.9Å; I220-L223 PolarHBondContact O-N 3.2Å; I220-L223 VanDerWaalsContact O-N 3.1Å; I220-L233 HydrophobicContact CG1-CD2 4.32Å; I220-I251 HydrophobicContact CD1-CG2 4.47Å; I220-L253 HydrophobicContact CD1-CD2 3.95Å; I220-L253 HydrophobicContact CG2-CD2 4.07Å
221	I	25.9	Very low	30.7	Very low	76 Å²	76	82.7 Å²	82.7	39%	0.39	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-55.4	-8.4	173.1	47.5	177.3	0	0	0	116.1	R219	R219-I221 HydrophobicContact CB-CD1 4.02Å; R219-I221 HydrophobicContact CB-CG1 3.56Å; R219-I221 HydrophobicContact CG-CD1 3.99Å; R219-I221 HydrophobicContact CG-CG1 4.11Å; R219-I221 PolarHBondContact O-N 3.31Å
222	Y	28.6	Very low	31.7	Very low	144 Å²	144	75.9 Å²	75.9	57%	0.565	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-108.1	3.4	175.9	-62.1	-55.9	0	0	0	115	R219 I220 N224 N364	R219-Y222 HydrophobicContact CB-CD2 3.44Å; R219-Y222 VanDerWaalsContact CB-CD2 3.44Å; R219-Y222 HydrophobicContact CB-CE2 3.59Å; R219-Y222 HydrophobicContact CG-CD2 4.39Å; R219-Y222 HydrophobicContact CG-CE2 4.06Å; R219-Y222 PolarHBondContact NH1-OH 2.77Å; R219-Y222 VanDerWaalsContact NH1-OH 3.1Å; R219-Y222 PolarHBondContact O-N 3.04Å; I220-Y222 PolarHBondContact O-N 2.9Å; Y222-N224 PolarHBondContact O-N 3.31Å; Y222-N224 VanDerWaalsContact O-N 3.08Å; Y222-N364 PolarHBondContact O-OD1 3.16Å
223	L	33.1	Very low	32.6	Very low	23 Å²	23	71.7 Å²	71.7	12%	0.12	34%	0.338	C	S	.	.			trans	-79.8	87.6	172.3	-69.7	170.6	0	0	0	109.5	I220 G225 Y226 L233 N364 Y377	I220-L223 PolarHBondContact O-N 3.2Å; I220-L223 VanDerWaalsContact O-N 3.1Å; L223-G225 PolarHBondContact O-N 2.75Å; L223-Y226 HydrophobicContact CD1-CD1 4.47Å; L223-Y226 HydrophobicContact CD1-CG 4.46Å; L223-L233 HydrophobicContact CD1-CD1 3.66Å; L223-L233 HydrophobicContact CD1-CD2 3.75Å; L223-L233 HydrophobicContact CD1-CG 4.38Å; L223-N364 WeakPolarHBondContact CA-ND2 3.44Å; L223-Y377 HydrophobicContact CD2-CE2 4.4Å
224	N	33.8	Very low	33.7	Very low	110 Å²	110	67.3 Å²	67.3	59%	0.588	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	130.1	169.6	-68.9	-32.5	0	0	0	109.2	Y222 Y226 N364	Y222-N224 PolarHBondContact O-N 3.31Å; Y222-N224 VanDerWaalsContact O-N 3.08Å; N224-Y226 PolarHBondContact O-N 3.36Å; N224-N364 WeakPolarHBondContact CB-OD1 3.47Å; N224-N364 PolarHBondContact N-ND2 3.11Å; N224-N364 VanDerWaalsContact N-ND2 3.11Å; N224-N364 PolarHBondContact N-OD1 3.36Å; N224-N364 VanDerWaalsContact N-OD1 3.12Å; N224-N364 PolarHBondContact O-ND2 2.82Å
225	G	34.6	Very low	34.6	Very low	14 Å²	14	61 Å²	61	14%	0.144	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.9	-0.8	171.8	0	0	0	0	0	117.1	L223 Y227	L223-G225 PolarHBondContact O-N 2.75Å; G225-Y227 WeakPolarHBondContact O-CD2 3.42Å; G225-Y227 PolarHBondContact O-N 2.88Å
226	Y	38.6	Very low	35.5	Very low	6 Å²	6	57.7 Å²	57.7	2%	0.024	28%	0.279	C	S	.	.			trans	-76.6	114.8	176.8	-178.9	-106.9	0	0	0	111.5	L223 N224 P228 K232 L233 L253 Y377	L223-Y226 HydrophobicContact CD1-CD1 4.47Å; L223-Y226 HydrophobicContact CD1-CG 4.46Å; N224-Y226 PolarHBondContact O-N 3.36Å; Y226-P228 HydrophobicContact CE1-CB 3.71Å; Y226-P228 HydrophobicContact CE1-CG 4.35Å; Y226-K232 PolarHBondContact OH-O 2.82Å; Y226-L233 HydrophobicContact CD1-CD1 3.96Å; Y226-L233 HydrophobicContact CD2-CD1 4.19Å; Y226-L233 HydrophobicContact CE1-CB 4.22Å; Y226-L233 HydrophobicContact CE1-CD1 3.54Å; Y226-L233 HydrophobicContact CE1-CG 4.48Å; Y226-L233 HydrophobicContact CE2-CD1 3.84Å; Y226-L233 HydrophobicContact CG-CD1 4.26Å; Y226-L233 WeakPolarHBondContact OH-CA 3.12Å; Y226-L253 HydrophobicContact CE1-CD1 4.23Å; Y226-Y377 AromaticContact CD2-CD1 3.84Å; Y226-Y377 HydrophobicContact CD2-CD1 3.84Å; Y226-Y377 HydrophobicContact CD2-CD2 4.12Å; Y226-Y377 HydrophobicContact CD2-CE1 4.02Å; Y226-Y377 HydrophobicContact CD2-CE2 4.28Å; Y226-Y377 AromaticContact CD2-CG 3.89Å; Y226-Y377 HydrophobicContact CD2-CG 3.89Å; Y226-Y377 HydrophobicContact CE2-CD1 4.02Å; Y226-Y377 HydrophobicContact CE2-CE1 4.07Å
227	Y	41.2	Very low	36.1	Very low	110 Å²	110	56.5 Å²	56.5	43%	0.431	27%	0.27	S	S	.	.			trans	-109.8	113.6	169.4	-64.7	-89.2	0	0	0	110	G225 F362 H379 Y395	G225-Y227 WeakPolarHBondContact O-CD2 3.42Å; G225-Y227 PolarHBondContact O-N 2.88Å; Y227-F362 HydrophobicContact CE2-CZ 4.24Å; Y227-H379 PolarHBondContact O-CE1 2.95Å; Y227-H379 PolarHBondContact O-NE2 3.16Å; Y227-Y395 PolarHBondContact O-OH 2.67Å
228	P	39.1	Very low	36.4	Very low	44 Å²	44	57.6 Å²	57.6	29%	0.286	28%	0.277	S	S	.	.			trans	-74.7	140.7	-178.2	34.6	-38.5	0	0	0	111.7	Y226 D230 L253 Y395	Y226-P228 HydrophobicContact CE1-CB 3.71Å; Y226-P228 HydrophobicContact CE1-CG 4.35Å; P228-D230 VanDerWaalsContact CB-O 3.26Å; P228-D230 WeakPolarHBondContact CB-O 3.13Å; P228-L253 HydrophobicContact CB-CD1 3.54Å; P228-L253 HydrophobicContact CG-CD1 3.57Å; P228-Y395 VanDerWaalsContact C-OH 3.26Å; P228-Y395 WeakPolarHBondContact CA-OH 3.45Å
229	I	36.6	Very low	36.6	Very low	14 Å²	14	51.4 Å²	51.4	7%	0.072	25%	0.249	C	C	.	.	S	Bend	trans	-79.8	-28.5	-179.4	-87.9	177.2	0	0	0	109.8	Y392 Y395 K424	I229-Y392 HydrophobicContact CD1-CG 4.18Å; I229-Y392 HydrophobicContact CG1-CD2 4.01Å; I229-Y392 HydrophobicContact CG1-CG 3.93Å; I229-Y395 HydrophobicContact CB-CE2 3.54Å; I229-Y395 WeakPolarHBondContact CB-OH 3.24Å; I229-Y395 HydrophobicContact CD1-CD1 4.16Å; I229-Y395 HydrophobicContact CD1-CD2 3.24Å; I229-Y395 HydrophobicContact CD1-CE1 3.92Å; I229-Y395 HydrophobicContact CD1-CE2 2.96Å; I229-Y395 HydrophobicContact CD1-CG 3.86Å; I229-Y395 HydrophobicContact CG1-CD2 4.09Å; I229-Y395 HydrophobicContact CG1-CE1 3.95Å; I229-Y395 HydrophobicContact CG1-CE2 3.29Å; I229-Y395 VanDerWaalsContact CG1-OH 3.22Å; I229-Y395 WeakPolarHBondContact CG1-OH 3.28Å; I229-Y395 PolarHBondContact N-OH 3.42Å; I229-K424 VanDerWaalsContact CG2-CE 3.46Å; I229-K424 PolarHBondContact O-NZ 3.37Å
230	D	44.1	Very low	36.7	Very low	50 Å²	50	48.5 Å²	48.5	27%	0.267	24%	0.241	S	C	.	.	S	Bend	trans	-131.7	-157.6	174	62.7	0.5	0	0	0	108.9	P228 K232 Y234	P228-D230 VanDerWaalsContact CB-O 3.26Å; P228-D230 WeakPolarHBondContact CB-O 3.13Å; D230-K232 PolarHBondContact O-N 3.13Å; D230-K232 WeakPolarHBondContact OD1-CA 3.43Å; D230-K232 VanDerWaalsContact OD1-CB 3.27Å; D230-K232 WeakPolarHBondContact OD1-CB 3.35Å; D230-K232 PolarHBondContact OD1-N 2.85Å; D230-Y234 PolarHBondContact OD2-OH 2.82Å
231	N	40.5	Very low	36.8	Very low	94 Å²	94	53.6 Å²	53.6	50%	0.503	27%	0.268	S	S	.	.	S	Bend	trans	-87.1	19.3	174.9	62.8	-46.2	0	0	0	112.4	D252 L253	N231-D252 PolarHBondContact ND2-OD1 3.39Å; N231-D252 CarbonylContact O-C 3.51Å; N231-D252 WeakPolarHBondContact O-CA 3.36Å; N231-L253 WeakPolarHBondContact O-CB 3.3Å; N231-L253 PolarHBondContact O-N 2.75Å
232	K	44.9	Very low	36.7	Very low	34 Å²	34	56.8 Å²	56.8	15%	0.148	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	144.5	-173.4	-60	-178	173	-162.7	0	112.3	D68 Y226 D230 T250 I251 D252	D68-K232 IonicContact OD2-NZ 3.09Å; D68-K232 PolarHBondContact OD2-NZ 2.88Å; D68-K232 VanDerWaalsContact OD2-NZ 3.09Å; Y226-K232 PolarHBondContact OH-O 2.82Å; D230-K232 PolarHBondContact O-N 3.13Å; D230-K232 WeakPolarHBondContact OD1-CA 3.43Å; D230-K232 VanDerWaalsContact OD1-CB 3.27Å; D230-K232 WeakPolarHBondContact OD1-CB 3.35Å; D230-K232 PolarHBondContact OD1-N 2.85Å; K232-T250 HydrophobicContact CB-CG2 4.21Å; K232-T250 HydrophobicContact CD-CG2 3.99Å; K232-I251 CarbonylContact C-O 3.49Å; K232-I251 VanDerWaalsContact CA-O 3.27Å; K232-I251 WeakPolarHBondContact CA-O 3.25Å; K232-D252 WeakPolarHBondContact CE-OD1 2.86Å; K232-D252 WeakPolarHBondContact CG-OD1 3.4Å
233	L	45.1	Very low	36.6	Very low	1 Å²	1	54.7 Å²	54.7	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	123.7	164.8	170.3	67.7	0	0	0	109.9	P217 I220 L223 Y226 I235 T250 I251 L253	P217-L233 HydrophobicContact CG-CD2 4.18Å; I220-L233 HydrophobicContact CG1-CD2 4.32Å; L223-L233 HydrophobicContact CD1-CD1 3.66Å; L223-L233 HydrophobicContact CD1-CD2 3.75Å; L223-L233 HydrophobicContact CD1-CG 4.38Å; Y226-L233 HydrophobicContact CD1-CD1 3.96Å; Y226-L233 HydrophobicContact CD2-CD1 4.19Å; Y226-L233 HydrophobicContact CE1-CB 4.22Å; Y226-L233 HydrophobicContact CE1-CD1 3.54Å; Y226-L233 HydrophobicContact CE1-CG 4.48Å; Y226-L233 HydrophobicContact CE2-CD1 3.84Å; Y226-L233 HydrophobicContact CG-CD1 4.26Å; Y226-L233 WeakPolarHBondContact OH-CA 3.12Å; L233-I235 HydrophobicContact CD2-CD1 4.07Å; L233-I235 HydrophobicContact CD2-CG1 4.1Å; L233-I235 HydrophobicContact CG-CD1 4.42Å; L233-I235 HydrophobicContact CG-CG1 4Å; L233-T250 CarbonylContact O-C 3.54Å; L233-T250 VanDerWaalsContact O-CA 3.25Å; L233-T250 WeakPolarHBondContact O-CA 3.47Å; L233-I251 HydrophobicContact CB-CB 4.29Å; L233-I251 PolarHBondContact N-O 3.19Å; L233-I251 PolarHBondContact O-N 3.26Å; L233-L253 HydrophobicContact CB-CD2 3.98Å; L233-L253 HydrophobicContact CB-CG 4.48Å
234	Y	46.1	Very low	36.4	Very low	5 Å²	5	59 Å²	59	2%	0.02	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	121.6	177.1	-61.4	-87.5	0	0	0	110.7	D230 L248 T250 Y395 I420 H429	D230-Y234 PolarHBondContact OD2-OH 2.82Å; Y234-L248 HydrophobicContact CD1-CD1 4.14Å; Y234-L248 HydrophobicContact CD1-CD2 4.13Å; Y234-L248 HydrophobicContact CD1-CG 4.43Å; Y234-T250 HydrophobicContact CD1-CG2 3.55Å; Y234-T250 HydrophobicContact CE1-CG2 3.51Å; Y234-T250 HydrophobicContact CG-CG2 4.41Å; Y234-Y395 HydrophobicContact CD2-CE2 4.31Å; Y234-Y395 HydrophobicContact CE2-CE2 4.1Å; Y234-I420 HydrophobicContact CD1-CD1 4.28Å; Y234-I420 HydrophobicContact CG-CD1 4.05Å; Y234-H429 AromaticContact CE1-NE2 4Å; Y234-H429 AromaticContact CZ-CE1 3.77Å; Y234-H429 AromaticContact CZ-NE2 4Å; Y234-H429 PolarHBondContact OH-CE1 2.98Å; Y234-H429 PolarHBondContact OH-NE2 3.05Å; Y234-H429 VanDerWaalsContact OH-NE2 3.13Å
235	I	42	Very low	36.1	Very low	19 Å²	19	59.1 Å²	59.1	10%	0.097	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	122.8	178	-55.9	169.3	0	0	0	108.9	P217 L233 Y237 R249 I251	P217-I235 HydrophobicContact CG-CD1 4.11Å; L233-I235 HydrophobicContact CD2-CD1 4.07Å; L233-I235 HydrophobicContact CD2-CG1 4.1Å; L233-I235 HydrophobicContact CG-CD1 4.42Å; L233-I235 HydrophobicContact CG-CG1 4Å; I235-Y237 HydrophobicContact CB-CE2 3.85Å; I235-Y237 HydrophobicContact CG2-CD2 4.08Å; I235-Y237 HydrophobicContact CG2-CE1 4.43Å; I235-Y237 HydrophobicContact CG2-CE2 3.4Å; I235-Y237 VanDerWaalsContact CG2-CE2 3.4Å; I235-R249 PolarHBondContact N-O 3.28Å; I235-R249 PolarHBondContact O-N 3.07Å; I235-I251 HydrophobicContact CD1-CD1 3.31Å; I235-I251 HydrophobicContact CD1-CG1 3.91Å
236	F	43	Very low	36.1	Very low	35 Å²	35	60.8 Å²	60.8	15%	0.154	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	123.7	179.2	-166.9	-101.7	0	0	0	110.4	P238 Y246 T418 V431 Y433	F236-P238 WeakPolarHBondContact O-CD 3.48Å; F236-Y246 HydrophobicContact CD1-CD1 4.19Å; F236-Y246 AromaticContact CE1-CD1 3.1Å; F236-Y246 HydrophobicContact CE1-CD1 3.1Å; F236-Y246 AromaticContact CE1-CE1 3.63Å; F236-Y246 HydrophobicContact CE1-CE1 3.63Å; F236-Y246 AromaticContact CE1-CG 3.67Å; F236-Y246 HydrophobicContact CE1-CG 3.67Å; F236-Y246 VanDerWaalsContact CE2-CB 3.41Å; F236-Y246 HydrophobicContact CE2-CD1 4.11Å; F236-Y246 HydrophobicContact CE2-CD2 4.48Å; F236-Y246 AromaticContact CE2-CG 3.79Å; F236-Y246 HydrophobicContact CE2-CG 3.79Å; F236-Y246 AromaticContact CZ-CD1 3.08Å; F236-Y246 HydrophobicContact CZ-CD1 3.08Å; F236-Y246 AromaticContact CZ-CD2 3.77Å; F236-Y246 HydrophobicContact CZ-CD2 3.77Å; F236-Y246 AromaticContact CZ-CE1 3.78Å; F236-Y246 HydrophobicContact CZ-CE1 3.78Å; F236-Y246 HydrophobicContact CZ-CE2 4.35Å; F236-Y246 AromaticContact CZ-CG 3.08Å; F236-Y246 HydrophobicContact CZ-CG 3.08Å; F236-T418 HydrophobicContact CD2-CG2 4.47Å; F236-T418 HydrophobicContact CE2-CG2 4.43Å; F236-V431 HydrophobicContact CE2-CG1 4.43Å; F236-Y433 AromaticContact CE1-CD2 3.73Å; F236-Y433 HydrophobicContact CE1-CD2 3.73Å; F236-Y433 AromaticContact CE1-CE2 3.78Å; F236-Y433 HydrophobicContact CE1-CE2 3.78Å; F236-Y433 AromaticContact CZ-CD2 3.59Å; F236-Y433 HydrophobicContact CZ-CD2 3.59Å; F236-Y433 HydrophobicContact CZ-CE2 4.13Å; F236-Y433 HydrophobicContact CZ-CG 4.17Å
237	Y	39	Very low	35.9	Very low	16 Å²	16	61.8 Å²	61.8	6%	0.063	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	105.3	175.6	-61.7	-100	0	0	0	109.1	Y215 V216 I235 N239 T247 R249	Y215-Y237 WeakPolarHBondContact O-CE1 3.27Å; Y215-Y237 PolarHBondContact O-OH 2.74Å; Y215-Y237 VanDerWaalsContact O-OH 3.12Å; V216-Y237 WeakPolarHBondContact CG2-OH 3.33Å; I235-Y237 HydrophobicContact CB-CE2 3.85Å; I235-Y237 HydrophobicContact CG2-CD2 4.08Å; I235-Y237 HydrophobicContact CG2-CE1 4.43Å; I235-Y237 HydrophobicContact CG2-CE2 3.4Å; I235-Y237 VanDerWaalsContact CG2-CE2 3.4Å; Y237-N239 PolarHBondContact O-N 3.07Å; Y237-T247 WeakPolarHBondContact CD2-O 3.25Å; Y237-T247 PolarHBondContact N-O 2.92Å; Y237-T247 PolarHBondContact O-N 2.98Å; Y237-T247 VanDerWaalsContact O-N 3.16Å; Y237-R249 HydrophobicContact CD2-CB 4.41Å; Y237-R249 HydrophobicContact CD2-CG 3.79Å; Y237-R249 HydrophobicContact CE2-CB 3.76Å; Y237-R249 HydrophobicContact CE2-CG 3.4Å; Y237-R249 PolarHBondContact OH-NH1 3.41Å
238	P	33	Very low	35.8	Very low	68 Å²	68	56.8 Å²	56.8	44%	0.442	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	99.1	166	26.8	-30.5	0	0	0	109.3	F236 K240 Y246	F236-P238 WeakPolarHBondContact O-CD 3.48Å; P238-K240 PolarHBondContact O-N 2.75Å; P238-Y246 HydrophobicContact CB-CD1 4.17Å; P238-Y246 HydrophobicContact CB-CE1 4.1Å
239	N	29.5	Very low	35.9	Very low	46 Å²	46	57.6 Å²	57.6	25%	0.246	27%	0.27	C	S	.	.			trans	-79	83.1	-175.4	-166.7	12.9	0	0	0	110.6	Y237	Y237-N239 PolarHBondContact O-N 3.07Å
240	K	26.5	Very low	36.1	Very low	85 Å²	85	57.1 Å²	57.1	37%	0.37	27%	0.268	S	S	.	.			trans	56	127.9	-170	-57.5	-179.8	175	-172	0	111.9	Y210 P238 K242 K243	Y210-K240 WeakPolarHBondContact OH-CE 3.32Å; Y210-K240 PolarHBondContact OH-NZ 3.39Å; P238-K240 PolarHBondContact O-N 2.75Å; K240-K242 PolarHBondContact O-N 3.21Å; K240-K243 PolarHBondContact O-N 2.9Å
241	L	27.1	Very low	35.9	Very low	131 Å²	131	55.1 Å²	55.1	69%	0.686	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-2.5	174.5	-70.7	163.1	0	0	0	115.7	K414	L241-K414 HydrophobicContact CD2-CD 4.41Å
242	K	25.1	Very low	35.9	Very low	143 Å²	143	53.9 Å²	53.9	62%	0.622	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-9.8	179.2	-67	-166.7	174.9	-167.5	0	114.7	K240	K240-K242 PolarHBondContact O-N 3.21Å
243	K	26.5	Very low	35.5	Very low	100 Å²	100	53.1 Å²	53.1	44%	0.435	25%	0.248	S	C	.	.	S	Bend	trans	-104.4	132.3	179.5	-70.4	-167.3	171.9	-167.4	0	110.5	K240 Y245	K240-K243 PolarHBondContact O-N 2.9Å; K243-Y245 PolarHBondContact O-N 2.86Å
244	K	27.7	Very low	35	Very low	113 Å²	113	57.4 Å²	57.4	49%	0.491	27%	0.267	S	S	.	.	S	Bend	trans	-65.1	38.6	171.3	-63.8	-178.2	177.8	-178.8	0	111.8	P74 D76	P74-K244 VanDerWaalsContact CD-C 3.49Å; P74-K244 WeakPolarHBondContact CD-O 3.41Å; P74-K244 HydrophobicContact CG-CB 3.83Å; P74-K244 WeakPolarHBondContact CG-O 3.26Å; D76-K244 IonicContact OD1-NZ 3.4Å; D76-K244 PolarHBondContact OD1-NZ 3.3Å
245	Y	27.5	Very low	34.2	Very low	114 Å²	114	66.8 Å²	66.8	45%	0.447	31%	0.31	S	S	.	.			trans	-151.4	132.7	-178.4	-57.5	-77.3	0	0	0	109.7	T73 K243	T73-Y245 HydrophobicContact CG2-CD1 4.49Å; T73-Y245 HydrophobicContact CG2-CE1 3.87Å; K243-Y245 PolarHBondContact O-N 2.86Å
246	Y	34.2	Very low	33.6	Very low	48 Å²	48	69.3 Å²	69.3	19%	0.188	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	142.2	170.6	-58.8	-86.2	0	0	0	108.8	V72 F236 P238 Y433	V72-Y246 PolarHBondContact N-O 3.19Å; F236-Y246 HydrophobicContact CD1-CD1 4.19Å; F236-Y246 AromaticContact CE1-CD1 3.1Å; F236-Y246 HydrophobicContact CE1-CD1 3.1Å; F236-Y246 AromaticContact CE1-CE1 3.63Å; F236-Y246 HydrophobicContact CE1-CE1 3.63Å; F236-Y246 AromaticContact CE1-CG 3.67Å; F236-Y246 HydrophobicContact CE1-CG 3.67Å; F236-Y246 VanDerWaalsContact CE2-CB 3.41Å; F236-Y246 HydrophobicContact CE2-CD1 4.11Å; F236-Y246 HydrophobicContact CE2-CD2 4.48Å; F236-Y246 AromaticContact CE2-CG 3.79Å; F236-Y246 HydrophobicContact CE2-CG 3.79Å; F236-Y246 AromaticContact CZ-CD1 3.08Å; F236-Y246 HydrophobicContact CZ-CD1 3.08Å; F236-Y246 AromaticContact CZ-CD2 3.77Å; F236-Y246 HydrophobicContact CZ-CD2 3.77Å; F236-Y246 AromaticContact CZ-CE1 3.78Å; F236-Y246 HydrophobicContact CZ-CE1 3.78Å; F236-Y246 HydrophobicContact CZ-CE2 4.35Å; F236-Y246 AromaticContact CZ-CG 3.08Å; F236-Y246 HydrophobicContact CZ-CG 3.08Å; P238-Y246 HydrophobicContact CB-CD1 4.17Å; P238-Y246 HydrophobicContact CB-CE1 4.1Å; Y246-Y433 HydrophobicContact CE1-CE1 4.45Å; Y246-Y433 HydrophobicContact CE1-CE2 4.48Å; Y246-Y433 HydrophobicContact CE2-CD1 4.1Å; Y246-Y433 HydrophobicContact CE2-CE1 4.5Å; Y246-Y433 HydrophobicContact CE2-CG 4.35Å; Y246-Y433 AromaticContact CZ-CD1 3.9Å; Y246-Y433 AromaticContact CZ-CE1 3.84Å; Y246-Y433 WeakPolarHBondContact OH-CE1 3.34Å
247	T	35.5	Very low	33.1	Very low	27 Å²	27	70.9 Å²	70.9	17%	0.166	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	114	172.2	-54.2	0	0	0	0	107.7	T69 Y237 R249	T69-T247 HydrophobicContact CG2-CG2 3.74Å; Y237-T247 WeakPolarHBondContact CD2-O 3.25Å; Y237-T247 PolarHBondContact N-O 2.92Å; Y237-T247 PolarHBondContact O-N 2.98Å; Y237-T247 VanDerWaalsContact O-N 3.16Å; T247-R249 HydrophobicContact CG2-CG 3.95Å
248	L	39.6	Very low	32.6	Very low	5 Å²	5	73.1 Å²	73.1	3%	0.026	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	130.7	162	178.5	72.5	0	0	0	106.8	Y70 Y234 I420 V431	Y70-L248 HydrophobicContact CD2-CB 4.03Å; Y70-L248 HydrophobicContact CD2-CD2 3.83Å; Y70-L248 HydrophobicContact CD2-CG 3.91Å; Y70-L248 WeakPolarHBondContact CD2-O 3.42Å; Y70-L248 HydrophobicContact CE2-CD2 4.35Å; Y70-L248 HydrophobicContact CG-CB 4.48Å; Y70-L248 HydrophobicContact CG-CD2 4.32Å; Y70-L248 PolarHBondContact N-O 2.98Å; Y70-L248 PolarHBondContact O-N 3.32Å; Y234-L248 HydrophobicContact CD1-CD1 4.14Å; Y234-L248 HydrophobicContact CD1-CD2 4.13Å; Y234-L248 HydrophobicContact CD1-CG 4.43Å; L248-I420 HydrophobicContact CD1-CD1 4.44Å; L248-V431 HydrophobicContact CD2-CG2 3.98Å
249	R	39.8	Very low	32.3	Very low	62 Å²	62	74.1 Å²	74.1	23%	0.234	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	142.5	166.8	-57.4	-171.5	-177.2	163.6	-7.9	109	I235 Y237 T247	I235-R249 PolarHBondContact N-O 3.28Å; I235-R249 PolarHBondContact O-N 3.07Å; Y237-R249 HydrophobicContact CD2-CB 4.41Å; Y237-R249 HydrophobicContact CD2-CG 3.79Å; Y237-R249 HydrophobicContact CE2-CB 3.76Å; Y237-R249 HydrophobicContact CE2-CG 3.4Å; Y237-R249 PolarHBondContact OH-NH1 3.41Å; T247-R249 HydrophobicContact CG2-CG 3.95Å
250	T	41	Very low	32	Very low	3 Å²	3	83.1 Å²	83.1	2%	0.018	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	143.2	167.8	48	0	0	0	0	109.5	Y70 K232 L233 Y234	Y70-T250 HydrophobicContact CE2-CG2 3.77Å; K232-T250 HydrophobicContact CB-CG2 4.21Å; K232-T250 HydrophobicContact CD-CG2 3.99Å; L233-T250 CarbonylContact O-C 3.54Å; L233-T250 VanDerWaalsContact O-CA 3.25Å; L233-T250 WeakPolarHBondContact O-CA 3.47Å; Y234-T250 HydrophobicContact CD1-CG2 3.55Å; Y234-T250 HydrophobicContact CE1-CG2 3.51Å; Y234-T250 HydrophobicContact CG-CG2 4.41Å
251	I	39.8	Very low	31.9	Very low	9 Å²	9	86.5 Å²	86.5	5%	0.046	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	118.9	170.7	-59.6	-175.6	0	0	0	107.6	V216 I220 K232 L233 I235 L253	V216-I251 HydrophobicContact CG1-CD1 3.76Å; I220-I251 HydrophobicContact CD1-CG2 4.47Å; K232-I251 CarbonylContact C-O 3.49Å; K232-I251 VanDerWaalsContact CA-O 3.27Å; K232-I251 WeakPolarHBondContact CA-O 3.25Å; L233-I251 HydrophobicContact CB-CB 4.29Å; L233-I251 PolarHBondContact N-O 3.19Å; L233-I251 PolarHBondContact O-N 3.26Å; I235-I251 HydrophobicContact CD1-CD1 3.31Å; I235-I251 HydrophobicContact CD1-CG1 3.91Å; I251-L253 PolarHBondContact O-N 3.03Å
252	D	40.5	Very low	31.8	Very low	68 Å²	68	84.2 Å²	84.2	36%	0.364	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	118.8	170.4	-75.2	-40.7	0	0	0	110	N231 K232 K254	N231-D252 PolarHBondContact ND2-OD1 3.39Å; N231-D252 CarbonylContact O-C 3.51Å; N231-D252 WeakPolarHBondContact O-CA 3.36Å; K232-D252 WeakPolarHBondContact CE-OD1 2.86Å; K232-D252 WeakPolarHBondContact CG-OD1 3.4Å; D252-K254 PolarHBondContact O-N 2.7Å
253	L	36.1	Very low	31.6	Very low	18 Å²	18	79.2 Å²	79.2	9%	0.094	38%	0.375	C	S	.	.			trans	-72.7	107.7	175.7	-61	173.6	0	0	0	108.4	I220 Y226 P228 N231 L233 I251 H255 F258	I220-L253 HydrophobicContact CD1-CD2 3.95Å; I220-L253 HydrophobicContact CG2-CD2 4.07Å; Y226-L253 HydrophobicContact CE1-CD1 4.23Å; P228-L253 HydrophobicContact CB-CD1 3.54Å; P228-L253 HydrophobicContact CG-CD1 3.57Å; N231-L253 WeakPolarHBondContact O-CB 3.3Å; N231-L253 PolarHBondContact O-N 2.75Å; L233-L253 HydrophobicContact CB-CD2 3.98Å; L233-L253 HydrophobicContact CB-CG 4.48Å; I251-L253 PolarHBondContact O-N 3.03Å; L253-H255 PolarHBondContact O-N 2.86Å; L253-F258 HydrophobicContact CD1-CE2 4.09Å; L253-F258 HydrophobicContact CD1-CZ 4.22Å
254	K	35.7	Very low	31.5	Very low	90 Å²	90	79.5 Å²	79.5	39%	0.391	39%	0.39	S	S	.	.			trans	-64.5	134	173.8	-69.9	171.1	179.3	151.5	0	109.4	T63 E65 D252 G256 Q257	T63-K254 PolarHBondContact O-NZ 2.77Å; E65-K254 IonicContact OE1-NZ 2.91Å; E65-K254 PolarHBondContact OE1-NZ 3.37Å; D252-K254 PolarHBondContact O-N 2.7Å; K254-G256 PolarHBondContact O-N 2.75Å; K254-G256 VanDerWaalsContact O-N 3.14Å; K254-Q257 HydrophobicContact CB-CG 3.99Å; K254-Q257 PolarHBondContact O-N 2.71Å; K254-Q257 VanDerWaalsContact O-N 3.09Å
255	H	29.8	Very low	31.3	Very low	203 Å²	203	79.6 Å²	79.6	94%	0.94	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	121.9	169.9	-88.7	-1.8	0	0	0	110.3	L253	L253-H255 PolarHBondContact O-N 2.86Å
256	G	29.1	Very low	31.2	Very low	71 Å²	71	77.8 Å²	77.8	73%	0.732	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.5	1.6	178.9	0	0	0	0	0	116.7	K254 F258	K254-G256 PolarHBondContact O-N 2.75Å; K254-G256 VanDerWaalsContact O-N 3.14Å; G256-F258 PolarHBondContact O-N 3.4Å
257	Q	32.4	Very low	30.8	Very low	69 Å²	69	78.3 Å²	78.3	32%	0.322	40%	0.404	S	S	.	.			trans	-77.7	-6.1	168.2	-78.8	-176.6	-24.8	0	0	113.7	K254	K254-Q257 HydrophobicContact CB-CG 3.99Å; K254-Q257 PolarHBondContact O-N 2.71Å; K254-Q257 VanDerWaalsContact O-N 3.09Å
258	F	28.3	Very low	30.4	Very low	63 Å²	63	83.2 Å²	83.2	28%	0.276	42%	0.423	S	S	.	.	S	Bend	trans	-81.5	121.4	158.6	-71.1	-88	0	0	0	108.1	L253 G256 R260 F262	L253-F258 HydrophobicContact CD1-CE2 4.09Å; L253-F258 HydrophobicContact CD1-CZ 4.22Å; G256-F258 PolarHBondContact O-N 3.4Å; F258-R260 PolarHBondContact O-N 3.48Å; F258-F262 HydrophobicContact CB-CB 4.43Å; F258-F262 HydrophobicContact CB-CD2 4.37Å; F258-F262 HydrophobicContact CB-CG 4.49Å; F258-F262 HydrophobicContact CD1-CD1 4.2Å; F258-F262 AromaticContact CD1-CD2 3.89Å; F258-F262 HydrophobicContact CD1-CD2 3.89Å; F258-F262 HydrophobicContact CD1-CE1 4.24Å; F258-F262 AromaticContact CD1-CE2 3.94Å; F258-F262 HydrophobicContact CD1-CE2 3.94Å; F258-F262 HydrophobicContact CD1-CG 4.02Å; F258-F262 HydrophobicContact CD1-CZ 4.11Å; F258-F262 HydrophobicContact CE1-CE1 4.46Å; F258-F262 HydrophobicContact CE1-CZ 4.35Å
259	D	25.9	Very low	29.8	Very low	88 Å²	88	90.1 Å²	90.1	47%	0.471	45%	0.452	S	S	.	.			trans	-48.8	137.6	170.7	-164.2	-16.4	0	0	0	109	H261 F262	D259-H261 PolarHBondContact O-N 2.72Å; D259-H261 IonicContact OD1-CD2 3.41Å; D259-H261 PolarHBondContact OD1-CD2 2.74Å; D259-H261 IonicContact OD1-CG 3.99Å; D259-H261 PolarHBondContact OD1-N 2.89Å; D259-H261 IonicContact OD2-CD2 3.92Å; D259-F262 WeakPolarHBondContact O-CA 3.43Å; D259-F262 VanDerWaalsContact O-CB 3.3Å; D259-F262 WeakPolarHBondContact O-CB 3.44Å; D259-F262 PolarHBondContact O-N 2.98Å
260	R	23.9	Very low	29.2	Very low	236 Å²	236	88.6 Å²	88.6	89%	0.891	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-8.4	175	-80.1	-177.4	-171.5	178.5	3.3	112.3	F258 S263	F258-R260 PolarHBondContact O-N 3.48Å; R260-S263 PolarHBondContact O-N 2.94Å
261	H	24.7	Very low	28.6	Very low	155 Å²	155	95.4 Å²	95.4	72%	0.718	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-5	168.1	-64.6	-63	0	0	0	115.1	D259 S263	D259-H261 PolarHBondContact O-N 2.72Å; D259-H261 IonicContact OD1-CD2 3.41Å; D259-H261 PolarHBondContact OD1-CD2 2.74Å; D259-H261 IonicContact OD1-CG 3.99Å; D259-H261 PolarHBondContact OD1-N 2.89Å; D259-H261 IonicContact OD2-CD2 3.92Å; H261-S263 PolarHBondContact O-N 2.82Å
262	F	24.9	Very low	28.1	Very low	83 Å²	83	100.4 Å²	100.4	36%	0.364	52%	0.522	S	S	.	.	S	Bend	trans	-66	61.2	138.9	-85.1	-95.1	0	0	0	107.6	F258 D259 S264	F258-F262 HydrophobicContact CB-CB 4.43Å; F258-F262 HydrophobicContact CB-CD2 4.37Å; F258-F262 HydrophobicContact CB-CG 4.49Å; F258-F262 HydrophobicContact CD1-CD1 4.2Å; F258-F262 AromaticContact CD1-CD2 3.89Å; F258-F262 HydrophobicContact CD1-CD2 3.89Å; F258-F262 HydrophobicContact CD1-CE1 4.24Å; F258-F262 AromaticContact CD1-CE2 3.94Å; F258-F262 HydrophobicContact CD1-CE2 3.94Å; F258-F262 HydrophobicContact CD1-CG 4.02Å; F258-F262 HydrophobicContact CD1-CZ 4.11Å; F258-F262 HydrophobicContact CE1-CE1 4.46Å; F258-F262 HydrophobicContact CE1-CZ 4.35Å; D259-F262 WeakPolarHBondContact O-CA 3.43Å; D259-F262 VanDerWaalsContact O-CB 3.3Å; D259-F262 WeakPolarHBondContact O-CB 3.44Å; D259-F262 PolarHBondContact O-N 2.98Å; F262-S264 PolarHBondContact O-N 2.79Å
263	S	21.3	Very low	27.3	Very low	38 Å²	38	98.1 Å²	98.1	27%	0.266	52%	0.515	S	S	.	.			trans	-65.1	133.9	179.3	75.2	0	0	0	0	106.2	R260 H261 E265	R260-S263 PolarHBondContact O-N 2.94Å; H261-S263 PolarHBondContact O-N 2.82Å; S263-E265 PolarHBondContact O-N 3.12Å; S263-E265 WeakPolarHBondContact OG-CB 3.5Å; S263-E265 WeakPolarHBondContact OG-CG 3.3Å
264	S	23.2	Very low	26.7	Very low	107 Å²	107	103.8 Å²	103.8	75%	0.748	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	17.7	167.1	46.5	0	0	0	0	114.8	F262	F262-S264 PolarHBondContact O-N 2.79Å
265	E	23.7	Very low	26.3	Very low	114 Å²	114	105.5 Å²	105.5	53%	0.533	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-23.9	176.5	-62.8	-151.9	125.6	0	0	113.8	S263 A267 K268	S263-E265 PolarHBondContact O-N 3.12Å; S263-E265 WeakPolarHBondContact OG-CB 3.5Å; S263-E265 WeakPolarHBondContact OG-CG 3.3Å; E265-A267 PolarHBondContact O-N 3.45Å; E265-K268 IonicContact OE1-NZ 2.75Å; E265-K268 PolarHBondContact OE1-NZ 3.48Å
266	I	26	Very low	26.2	Very low	76 Å²	76	103.9 Å²	103.9	39%	0.39	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-12.8	-177.5	-36.3	178.2	0	0	0	111.8
267	A	25.6	Very low	26	Very low	59 Å²	59	110 Å²	110	49%	0.488	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134	49.5	174.9	0	0	0	0	0	110.9	E265 K269 F275	E265-A267 PolarHBondContact O-N 3.45Å; A267-K269 PolarHBondContact O-N 3.44Å; A267-F275 HydrophobicContact CB-CD1 3.94Å; A267-F275 HydrophobicContact CB-CE1 3.89Å
268	K	26.7	Very low	25.7	Very low	130 Å²	130	111.4 Å²	111.4	57%	0.565	55%	0.552	S	S	*	*			trans	-66.2	99.4	167.7	-90.9	175.2	-178.5	162.4	0	109	E265 S270	E265-K268 IonicContact OE1-NZ 2.75Å; E265-K268 PolarHBondContact OE1-NZ 3.48Å; K268-S270 PolarHBondContact O-N 2.85Å; K268-S270 VanDerWaalsContact O-N 3.1Å
269	K	27	Very low	25.5	Very low	150 Å²	150	113.6 Å²	113.6	65%	0.652	57%	0.567	S	S	*	*			trans	-52.1	113.3	166.4	-173.2	179.6	-178.6	-177.7	0	107.8	A267	A267-K269 PolarHBondContact O-N 3.44Å
270	S	28.7	Very low	25.4	Very low	30 Å²	30	114.2 Å²	114.2	21%	0.21	58%	0.576	C	S	.	*			trans	-64.6	154.3	173.3	68.1	0	0	0	0	109.5	K268 N272 G273 Y274	K268-S270 PolarHBondContact O-N 2.85Å; K268-S270 VanDerWaalsContact O-N 3.1Å; S270-N272 WeakPolarHBondContact CB-OD1 3.27Å; S270-N272 PolarHBondContact O-N 3.2Å; S270-N272 PolarHBondContact OG-OD1 2.83Å; S270-G273 PolarHBondContact O-N 3.13Å; S270-Y274 PolarHBondContact N-O 3.07Å; S270-Y274 WeakPolarHBondContact OG-CB 3.32Å; S270-Y274 PolarHBondContact OG-N 3.12Å; S270-Y274 VanDerWaalsContact OG-N 3.07Å; S270-Y274 PolarHBondContact OG-O 3.27Å
271	P	28.2	Very low	25.5	Very low	146 Å²	146	109 Å²	109	95%	0.948	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55	-24.9	177.9	-26.2	34.3	0	0	0	113.6
272	N	29.1	Very low	25.6	Very low	114 Å²	114	104.2 Å²	104.2	61%	0.61	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	9.6	174.7	51	-19	0	0	0	114.5	S270 Y274	S270-N272 WeakPolarHBondContact CB-OD1 3.27Å; S270-N272 PolarHBondContact O-N 3.2Å; S270-N272 PolarHBondContact OG-OD1 2.83Å; N272-Y274 HydrophobicContact CB-CD2 4.04Å; N272-Y274 HydrophobicContact CB-CE2 4.27Å; N272-Y274 VanDerWaalsContact O-CD2 3.25Å; N272-Y274 WeakPolarHBondContact O-CD2 3.48Å; N272-Y274 WeakPolarHBondContact O-CE2 3.31Å; N272-Y274 PolarHBondContact O-N 3.27Å
273	G	22.7	Very low	25.6	Very low	20 Å²	20	108.8 Å²	108.8	21%	0.206	57%	0.569	C	S	.	*	S	Bend	trans	80.4	11.4	168.9	0	0	0	0	0	116.2	S270 K388	S270-G273 PolarHBondContact O-N 3.13Å; G273-K388 WeakPolarHBondContact O-CE 3.5Å; G273-K388 PolarHBondContact O-NZ 3.09Å; G273-K388 VanDerWaalsContact O-NZ 3.12Å
274	Y	23.6	Very low	25.9	Very low	138 Å²	138	114 Å²	114	54%	0.541	59%	0.594	S	S	.	*			trans	-93.2	147.3	175.4	-64.4	-87.8	0	0	0	110.5	S270 N272	S270-Y274 PolarHBondContact N-O 3.07Å; S270-Y274 WeakPolarHBondContact OG-CB 3.32Å; S270-Y274 PolarHBondContact OG-N 3.12Å; S270-Y274 VanDerWaalsContact OG-N 3.07Å; S270-Y274 PolarHBondContact OG-O 3.27Å; N272-Y274 HydrophobicContact CB-CD2 4.04Å; N272-Y274 HydrophobicContact CB-CE2 4.27Å; N272-Y274 VanDerWaalsContact O-CD2 3.25Å; N272-Y274 WeakPolarHBondContact O-CD2 3.48Å; N272-Y274 WeakPolarHBondContact O-CE2 3.31Å; N272-Y274 PolarHBondContact O-N 3.27Å
275	F	28.1	Very low	26	Very low	126 Å²	126	117.7 Å²	117.7	55%	0.553	60%	0.597	S	S	*	*			trans	-88.3	136.2	161	-66.3	-79.2	0	0	0	107.3	A267 E277	A267-F275 HydrophobicContact CB-CD1 3.94Å; A267-F275 HydrophobicContact CB-CE1 3.89Å; F275-E277 PolarHBondContact O-N 2.8Å
276	K	26.7	Very low	26.1	Very low	169 Å²	169	120.2 Å²	120.2	74%	0.735	61%	0.608	S	S	*	*			trans	-75.1	115	176.5	-153.2	176.5	-175.6	-176.9	0	106.9	I278	K276-I278 HydrophobicContact CB-CG1 4.49Å; K276-I278 PolarHBondContact O-N 2.88Å; K276-I278 VanDerWaalsContact O-N 3.08Å
277	E	25.9	Very low	25.9	Very low	199 Å²	199	127.6 Å²	127.6	93%	0.93	63%	0.633	S	S	*	*			trans	-53.2	114.1	164.6	-93.6	179.4	151.4	0	0	107.8	F275	F275-E277 PolarHBondContact O-N 2.8Å
278	I	24.6	Very low	25.8	Very low	98 Å²	98	128.7 Å²	128.7	50%	0.503	64%	0.637	S	S	.	*			trans	-113.7	109.4	171.2	-61.2	176.9	0	0	0	106.3	K276 A282	K276-I278 HydrophobicContact CB-CG1 4.49Å; K276-I278 PolarHBondContact O-N 2.88Å; K276-I278 VanDerWaalsContact O-N 3.08Å; I278-A282 HydrophobicContact CG2-CB 4.19Å
279	N	24.2	Very low	25.8	Very low	109 Å²	109	130.4 Å²	130.4	58%	0.583	65%	0.647	S	S	*	*			trans	-46.4	123.1	177.4	-154.4	-20.8	0	0	0	110	N281 A282	N279-N281 PolarHBondContact O-N 2.81Å; N279-A282 WeakPolarHBondContact O-CB 3.46Å; N279-A282 PolarHBondContact O-N 2.75Å
280	P	25.3	Very low	25.7	Very low	102 Å²	102	127.4 Å²	127.4	66%	0.662	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-56.5	-19.9	-178	18.3	-30	0	0	0	113.1	A282 Y283	P280-A282 PolarHBondContact O-N 2.8Å; P280-A282 VanDerWaalsContact O-N 3.14Å; P280-Y283 PolarHBondContact O-N 2.84Å
281	N	26.3	Very low	25.5	Very low	125 Å²	125	133.3 Å²	133.3	67%	0.668	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-65.6	-9	174	-69.4	-23.8	0	0	0	115.1	N279	N279-N281 PolarHBondContact O-N 2.81Å
282	A	24.8	Very low	25.3	Very low	55 Å²	55	136.5 Å²	136.5	46%	0.455	67%	0.668	S	S	.	*	G	3₁₀ helix	trans	-79.5	-14.4	178.9	0	0	0	0	0	114.4	I278 N279 P280	I278-A282 HydrophobicContact CG2-CB 4.19Å; N279-A282 WeakPolarHBondContact O-CB 3.46Å; N279-A282 PolarHBondContact O-N 2.75Å; P280-A282 PolarHBondContact O-N 2.8Å; P280-A282 VanDerWaalsContact O-N 3.14Å
283	Y	26.3	Very low	25.1	Very low	179 Å²	179	134.3 Å²	134.3	70%	0.702	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-90.5	2.2	-177.4	-111.9	-90.2	0	0	0	115	P280 K285	P280-Y283 PolarHBondContact O-N 2.84Å; Y283-K285 PolarHBondContact O-N 2.73Å; Y283-K285 VanDerWaalsContact O-N 3.14Å
284	N	26.3	Very low	25.1	Very low	147 Å²	147	142.9 Å²	142.9	79%	0.786	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-75.7	17.5	164.8	-93	-21.5	0	0	0	113.7	Q286	N284-Q286 PolarHBondContact O-N 2.83Å
285	K	26.4	Very low	25.2	Very low	186 Å²	186	144.4 Å²	144.4	81%	0.809	72%	0.718	S	S	*	*			trans	-70	90.3	162.5	-85.4	-172.1	176.7	179.7	0	108.2	Y283	Y283-K285 PolarHBondContact O-N 2.73Å; Y283-K285 VanDerWaalsContact O-N 3.14Å
286	Q	24.7	Very low	25.2	Very low	167 Å²	167	143.3 Å²	143.3	78%	0.78	72%	0.718	S	S	*	*			trans	23.3	112.5	142.2	-71.7	174	-29.3	0	0	112.7	N284 S288	N284-Q286 PolarHBondContact O-N 2.83Å; Q286-S288 PolarHBondContact O-N 2.65Å
287	Y	23.1	Very low	25.1	Very low	230 Å²	230	141.1 Å²	141.1	90%	0.902	71%	0.714	S	S	*	*			trans	-55.8	70	137	-85.6	-89.6	0	0	0	108.2	H289	Y287-H289 PolarHBondContact O-N 3.28Å; Y287-H289 VanDerWaalsContact O-N 3.16Å; Y287-H289 PolarHBondContact O-ND1 3.1Å
288	S	23.9	Very low	25.2	Very low	82 Å²	82	138.9 Å²	138.9	57%	0.573	70%	0.703	S	S	*	*			trans	-63	113	153	-174.4	0	0	0	0	102.5	Q286 S290	Q286-S288 PolarHBondContact O-N 2.65Å; S288-S290 PolarHBondContact O-N 2.69Å
289	H	25.4	Very low	25.3	Very low	167 Å²	167	141.9 Å²	141.9	77%	0.773	71%	0.713	S	S	*	*			trans	-54.1	90.4	166.8	-71.6	49.9	0	0	0	106.1	Y287 N291	Y287-H289 PolarHBondContact O-N 3.28Å; Y287-H289 VanDerWaalsContact O-N 3.16Å; Y287-H289 PolarHBondContact O-ND1 3.1Å; H289-N291 PolarHBondContact O-N 3.27Å
290	S	24.8	Very low	25.4	Very low	87 Å²	87	144.1 Å²	144.1	61%	0.608	72%	0.72	S	S	*	*			trans	-77	84.6	177.6	65	0	0	0	0	105.4	S288 Y292	S288-S290 PolarHBondContact O-N 2.69Å; S290-Y292 PolarHBondContact O-N 2.72Å
291	N	24	Very low	25.5	Very low	153 Å²	153	144.1 Å²	144.1	82%	0.818	72%	0.722	S	S	*	*			trans	-50.4	84.7	151.4	-81.4	-27.9	0	0	0	107.9	H289	H289-N291 PolarHBondContact O-N 3.27Å
292	Y	25.5	Very low	25.7	Very low	213 Å²	213	149.6 Å²	149.6	84%	0.835	73%	0.733	S	S	*	*			trans	-142.5	119.2	167.6	-81.8	-91.2	0	0	0	104.9	S290	S290-Y292 PolarHBondContact O-N 2.72Å
293	G	23.9	Very low	25.8	Very low	68 Å²	68	150.5 Å²	150.5	70%	0.701	75%	0.748	S	S	*	*			cis	-131.3	145.2	6.8	0	0	0	0	0	111.5	N295	G293-N295 PolarHBondContact O-N 2.86Å
294	Y	24.3	Very low	25.7	Very low	201 Å²	201	148 Å²	148	79%	0.788	75%	0.753	S	S	*	*			trans	-25.4	114.6	137	-78.3	-100.2	0	0	0	111.6
295	N	25.5	Very low	25.8	Very low	169 Å²	169	146.6 Å²	146.6	90%	0.904	76%	0.755	S	S	*	*			trans	-127.6	89.4	130.7	-124.9	-1.6	0	0	0	107	G293 N297	G293-N295 PolarHBondContact O-N 2.86Å; N295-N297 PolarHBondContact O-N 2.67Å
296	N	26.9	Very low	25.7	Very low	104 Å²	104	144.7 Å²	144.7	56%	0.556	75%	0.754	S	S	*	*			trans	-55.6	126.3	164.6	-91.3	-27.4	0	0	0	108.6
297	N	24.7	Very low	25.8	Very low	122 Å²	122	147.7 Å²	147.7	65%	0.652	76%	0.76	S	S	*	*			trans	65.8	133.8	133.2	-54.9	-30.2	0	0	0	119.5	N295	N295-N297 PolarHBondContact O-N 2.67Å
298	H	27.4	Very low	25.8	Very low	152 Å²	152	146.9 Å²	146.9	70%	0.704	76%	0.756	S	S	*	*			trans	94.1	111.1	150.6	-71.6	-73.7	0	0	0	118.3
299	F	27.7	Very low	25.9	Very low	162 Å²	162	148.9 Å²	148.9	71%	0.711	77%	0.767	S	S	*	*				59.3	134	127.2	-76.4	-125	0	0	0	115.9
300	E	26.8	Very low	26	Very low	156 Å²	156	146.1 Å²	146.1	73%	0.729	77%	0.767	S	S	*	*			cis	179.9	144	15.7	-122.5	176.2	179.6	0	0	105.5
301	S	26.8	Very low	25.9	Very low	101 Å²	101	149 Å²	149	71%	0.706	78%	0.775	S	S	*	*			trans	75	139.6	131.8	-154.8	0	0	0	0	122.2
302	R	29.9	Very low	25.9	Very low	241 Å²	241	152.6 Å²	152.6	91%	0.909	78%	0.779	S	S	*	*			trans	83.9	113.2	161.8	-46.3	-175.2	-177.7	-170.4	-0.7	114.2
303	G	26.9	Very low	26	Very low	73 Å²	73	149.5 Å²	149.5	75%	0.753	77%	0.772	S	S	*	*			cis	166.9	175.7	21.7	0	0	0	0	0	107.1
304	P	25.8	Very low	26	Very low	127 Å²	127	150.8 Å²	150.8	83%	0.825	77%	0.771	S	S	*	*			trans	-99.6	148.7	-137.1	36.3	-33.5	0	0	0	115
305	S	26.9	Very low	26	Very low	118 Å²	118	151.3 Å²	151.3	83%	0.825	77%	0.773	S	S	*	*			trans	-144	113.6	150.5	76.5	0	0	0	0	111.2
306	N	25.3	Very low	26	Very low	145 Å²	145	151.4 Å²	151.4	78%	0.775	77%	0.767	S	S	*	*			trans	-61.2	127.3	174.4	-66.9	-37.3	0	0	0	111.4
307	Y	26.1	Very low	26	Very low	231 Å²	231	158.5 Å²	158.5	91%	0.906	79%	0.786	S	S	*	*			trans	-150.7	122.1	147.8	-130.3	-95.9	0	0	0	109.6
308	Y	22.6	Very low	26.1	Very low	212 Å²	212	162.6 Å²	162.6	83%	0.831	80%	0.798	S	S	*	*			trans	-65.7	146.6	-170.1	-82.2	-103.5	0	0	0	114.2
309	P	26.2	Very low	26.1	Very low	124 Å²	124	158.7 Å²	158.7	81%	0.805	80%	0.799	S	S	*	*			trans	-113	119.7	138.7	30.3	-20	0	0	0	110.4
310	S	28	Very low	26	Very low	109 Å²	109	157 Å²	157	76%	0.762	80%	0.797	S	S	*	*			trans	-71.2	122.3	177.9	49.7	0	0	0	0	112.6
311	N	23.2	Very low	25.9	Very low	147 Å²	147	159.1 Å²	159.1	79%	0.786	80%	0.8	S	S	*	*			trans	20.8	118.2	144.4	-68.4	-19.8	0	0	0	119.3
312	Y	24.6	Very low	25.9	Very low	230 Å²	230	165.6 Å²	165.6	90%	0.902	81%	0.809	S	S	*	*				-149.2	141	119.5	-120.7	-90.6	0	0	0	110.6
313	Q	27.1	Very low	25.7	Very low	147 Å²	147	160.9 Å²	160.9	69%	0.687	80%	0.802	S	S	*	*			trans	-80.4	153.4	-146.3	-65.6	170.1	-42	0	0	116.8
314	S	23.4	Very low	25.9	Very low	95 Å²	95	166.4 Å²	166.4	66%	0.664	81%	0.808	S	S	*	*			trans	-64.1	142.9	160	73.7	0	0	0	0	112.3
315	Y	24.1	Very low	25.9	Very low	213 Å²	213	167 Å²	167	84%	0.835	80%	0.804	S	S	*	*			trans	-127.7	100.7	149	-88.9	-83.7	0	0	0	109.9
316	H	25	Very low	26	Very low	171 Å²	171	170.6 Å²	170.6	79%	0.792	81%	0.805	S	S	*	*			trans	-72.6	138.5	152.3	-78.8	-76.8	0	0	0	108.9
317	R	27	Very low	26	Very low	253 Å²	253	170.3 Å²	170.3	96%	0.955	80%	0.803	S	S	*	*			trans	-131.2	106.5	153.7	-133.7	-179.4	-173.6	-161.1	2	109.8
318	K	26.4	Very low	26.1	Very low	208 Å²	208	166 Å²	166	90%	0.904	80%	0.796	S	S	*	*			trans	-75.3	149.6	166.7	-82.8	-179.1	173.4	177.4	0	110.4
319	G	27.4	Very low	26.2	Very low	69 Å²	69	162.9 Å²	162.9	71%	0.711	79%	0.793	S	S	*	*			trans	144.1	141.2	150.5	0	0	0	0	0	112.4
320	N	26.1	Very low	26.1	Very low	127 Å²	127	163 Å²	163	68%	0.679	79%	0.791	S	S	*	*			cis	-178.1	135.1	-12.5	-121.6	-6.4	0	0	0	106.4
321	Y	25.3	Very low	26	Very low	201 Å²	201	166.8 Å²	166.8	79%	0.788	79%	0.794	S	S	*	*			trans	61.3	127.9	159.5	-50.1	-71	0	0	0	119
322	R	27.2	Very low	26	Very low	237 Å²	237	164.9 Å²	164.9	89%	0.894	79%	0.792	S	S	*	*				-173.5	134.7	65.1	-92.5	-172.8	170.8	162	-3.2	110.6
323	N	25.6	Very low	25.9	Very low	141 Å²	141	162.3 Å²	162.3	75%	0.754	79%	0.793	S	S	*	*			trans	-57.6	144.5	163.6	-94.7	-28.7	0	0	0	112.3
324	H	30.1	Very low	25.6	Very low	190 Å²	190	165.4 Å²	165.4	88%	0.88	80%	0.8	S	S	*	*			trans	-148.1	101.4	136.5	-94.1	-63.4	0	0	0	110.7
325	N	25.7	Very low	25.6	Very low	139 Å²	139	167.7 Å²	167.7	74%	0.743	81%	0.805	S	S	*	*			trans	-51.3	143.8	158.3	-89.4	-26.1	0	0	0	111.5
326	K	29.2	Very low	25.5	Very low	193 Å²	193	164.1 Å²	164.1	84%	0.839	80%	0.801	S	S	*	*				-175.1	115	120.3	-101.3	168.2	-177	-177.6	0	112.2
327	N	25.8	Very low	25.3	Very low	140 Å²	140	161.3 Å²	161.3	75%	0.749	80%	0.797	S	S	*	*			trans	39.6	118	133.2	-69.2	-2.4	0	0	0	119
328	N	27.3	Very low	25.2	Very low	141 Å²	141	160.3 Å²	160.3	75%	0.754	80%	0.795	S	S	*	*				-179.2	128.9	97.2	-90.9	-30.9	0	0	0	111.6
329	N	24.9	Very low	24.9	Very low	145 Å²	145	159.1 Å²	159.1	78%	0.775	79%	0.79	S	S	*	*			trans	30.2	122.4	140.5	-66.9	-24.4	0	0	0	118.4
330	V	24.2	Very low	24.7	Very low	126 Å²	126	166.3 Å²	166.3	76%	0.764	80%	0.797	S	S	*	*				-178.4	112.2	111.5	157	0	0	0	0	110.3
331	K	26.9	Very low	24.5	Very low	190 Å²	190	164.4 Å²	164.4	83%	0.826	79%	0.794	S	S	*	*			trans	60.1	115.3	140.7	-61.7	179.8	-178.1	178.2	0	120.9
332	S	22.8	Very low	24.5	Very low	106 Å²	106	160.6 Å²	160.6	74%	0.741	79%	0.791	S	S	*	*			trans	-43.9	141.9	148.6	60.3	0	0	0	0	114
333	L	22.4	Very low	24.2	Very low	177 Å²	177	155.4 Å²	155.4	93%	0.927	78%	0.781	S	S	*	*			trans	-150.3	104.9	142.2	-100.9	151.9	0	0	0	107.8
334	Y	20.8	Very low	24.2	Very low	211 Å²	211	157 Å²	157	83%	0.827	79%	0.785	S	S	*	*			trans	-58.7	157.6	157.4	-96.1	-100.4	0	0	0	109.9
335	N	23.3	Very low	23.8	Very low	143 Å²	143	153.6 Å²	153.6	77%	0.765	77%	0.773	S	S	*	*			trans	87.8	76	165	-61.4	-11.9	0	0	0	118.8
336	N	22	Very low	23.7	Very low	139 Å²	139	158 Å²	158	74%	0.743	78%	0.781	S	S	*	*				-177.7	138.8	112.5	-102	-30.7	0	0	0	109.4	Y338	N336-Y338 PolarHBondContact O-N 2.76Å
337	P	21.6	Very low	23.4	Very low	112 Å²	112	155 Å²	155	73%	0.727	77%	0.773	S	S	*	*			trans	-66.5	112.1	169.4	29.5	-28.1	0	0	0	105.3	K339	P337-K339 PolarHBondContact O-N 2.81Å
338	Y	23.2	Very low	23.3	Very low	231 Å²	231	154 Å²	154	91%	0.906	77%	0.768	S	S	*	*			trans	-61.9	100.7	172.1	-94.7	-87.8	0	0	0	107	N336 Y340	N336-Y338 PolarHBondContact O-N 2.76Å; Y338-Y340 PolarHBondContact O-N 2.74Å
339	K	21.9	Very low	23.1	Very low	183 Å²	183	158.1 Å²	158.1	80%	0.796	78%	0.775	S	S	*	*			trans	-36.6	128.6	165.6	-78.8	174.1	170.8	176.8	0	107.4	P337 S341	P337-K339 PolarHBondContact O-N 2.81Å; K339-S341 PolarHBondContact O-N 3.42Å
340	Y	22.3	Very low	23.1	Very low	221 Å²	221	156.6 Å²	156.6	87%	0.867	77%	0.766	S	S	*	*			trans	-45	99.4	141.9	-88.9	-96.9	0	0	0	106.3	Y338 T342	Y338-Y340 PolarHBondContact O-N 2.74Å; Y340-T342 PolarHBondContact O-N 3.22Å
341	S	22.1	Very low	23.1	Very low	86 Å²	86	153.7 Å²	153.7	60%	0.601	76%	0.761	S	S	*	*			trans	-74	90.8	166.2	175.1	0	0	0	0	105	K339 N343	K339-S341 PolarHBondContact O-N 3.42Å; S341-N343 PolarHBondContact O-N 3.37Å
342	T	24.2	Very low	22.9	Very low	121 Å²	121	152.4 Å²	152.4	74%	0.742	76%	0.763	S	S	*	*			trans	-65.7	20.6	167	45	0	0	0	0	112.7	Y340	Y340-T342 PolarHBondContact O-N 3.22Å
343	N	22.8	Very low	23	Very low	128 Å²	128	154.3 Å²	154.3	68%	0.684	77%	0.765	S	S	*	*			trans	-135.5	60.2	-175.3	-69	-4.7	0	0	0	110.6	S341	S341-N343 PolarHBondContact O-N 3.37Å
344	Q	23.6	Very low	23.1	Very low	176 Å²	176	155.5 Å²	155.5	82%	0.822	76%	0.763	S	S	*	*	S	Bend	trans	-101.3	113.1	150.1	-81.6	-168.1	-25.1	0	0	107.1	Y346	Q344-Y346 PolarHBondContact O-N 3.45Å
345	N	22.2	Very low	23.5	Very low	117 Å²	117	150.5 Å²	150.5	63%	0.626	75%	0.75	S	S	*	*			trans	-44.2	97.7	-176.7	-69.6	-19.8	0	0	0	112.6	N347	N345-N347 HydrophobicContact CB-CB 4.39Å; N345-N347 PolarHBondContact O-N 2.82Å; N345-N347 VanDerWaalsContact O-N 3.13Å
346	Y	23.5	Very low	23.5	Very low	232 Å²	232	147.9 Å²	147.9	91%	0.91	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	62.3	147.1	-98.7	-93.2	0	0	0	107.5	Q344	Q344-Y346 PolarHBondContact O-N 3.45Å
347	N	24.1	Very low	23.6	Very low	129 Å²	129	149.2 Å²	149.2	69%	0.69	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.1	1.6	-180	-94.5	-13.6	0	0	0	114.4	N345	N345-N347 HydrophobicContact CB-CB 4.39Å; N345-N347 PolarHBondContact O-N 2.82Å; N345-N347 VanDerWaalsContact O-N 3.13Å
348	D	22.9	Very low	23.8	Very low	120 Å²	120	147.7 Å²	147.7	64%	0.642	73%	0.734	S	S	*	*	S	Bend	trans	-101.6	7.6	-173	-68.2	-26.5	0	0	0	115.3
349	Y	22.6	Very low	23.9	Very low	228 Å²	228	140.1 Å²	140.1	89%	0.894	71%	0.708	S	S	*	*	S	Bend	trans	-146.7	55.2	167.6	-79.1	-82.2	0	0	0	112.6
350	I	25.9	Very low	24.1	Very low	113 Å²	113	136.9 Å²	136.9	58%	0.579	69%	0.694	S	S	*	*			trans	-130.5	75.4	151.6	-53.8	175.3	0	0	0	104.8	D352 L355	I350-D352 PolarHBondContact O-N 3.16Å; I350-D352 VanDerWaalsContact O-N 3.09Å; I350-L355 HydrophobicContact CD1-CD1 4.02Å; I350-L355 HydrophobicContact CG2-CD1 4.29Å
351	G	23.6	Very low	24.2	Very low	65 Å²	65	132.2 Å²	132.2	67%	0.67	68%	0.684	S	S	*	*			trans	-63.9	110.3	171.7	0	0	0	0	0	108.4	D353	G351-D353 PolarHBondContact O-N 3.31Å
352	D	22.6	Very low	24.4	Very low	162 Å²	162	130.6 Å²	130.6	87%	0.866	67%	0.666	S	S	*	*	S	Bend	trans	33.4	3.5	155.7	-68.8	-27	0	0	0	122.6	I350	I350-D352 PolarHBondContact O-N 3.16Å; I350-D352 VanDerWaalsContact O-N 3.09Å
353	D	24.8	Very low	24.7	Very low	146 Å²	146	129.4 Å²	129.4	78%	0.781	66%	0.655	S	S	*	*	S	Bend	trans	-102.3	92.6	177.3	-74.8	-28.8	0	0	0	109.8	G351 L355	G351-D353 PolarHBondContact O-N 3.31Å; D353-L355 PolarHBondContact O-N 2.97Å; D353-L355 VanDerWaalsContact O-N 3.12Å
354	K	25.7	Very low	25.1	Very low	202 Å²	202	124.6 Å²	124.6	88%	0.878	63%	0.629	S	S	*	*			trans	-11.5	100.5	167.2	-65.6	173.5	179.5	173.3	0	114.6
355	L	27.6	Very low	25.4	Very low	106 Å²	106	119.8 Å²	119.8	56%	0.555	61%	0.612	S	S	*	*			trans	-56.5	133.8	158.9	-84.4	157.4	0	0	0	108.5	I350 D353 N357	I350-L355 HydrophobicContact CD1-CD1 4.02Å; I350-L355 HydrophobicContact CG2-CD1 4.29Å; D353-L355 PolarHBondContact O-N 2.97Å; D353-L355 VanDerWaalsContact O-N 3.12Å; L355-N357 PolarHBondContact O-N 2.66Å
356	P	24.3	Very low	25.7	Very low	89 Å²	89	118.5 Å²	118.5	58%	0.578	61%	0.605	S	S	*	*			trans	-54.4	132.6	170.9	-18.5	29.2	0	0	0	108.9	D358	P356-D358 PolarHBondContact O-N 2.98Å
357	N	25	Very low	25.9	Very low	166 Å²	166	113.1 Å²	113.1	89%	0.888	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	12.9	-175.1	-75.4	-26.6	0	0	0	115.6	L355	L355-N357 PolarHBondContact O-N 2.66Å
358	D	25.6	Very low	26.2	Very low	81 Å²	81	108.8 Å²	108.8	43%	0.433	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-124.2	10.2	-166.1	-67.4	-39.8	0	0	0	114.8	P356 Q383	P356-D358 PolarHBondContact O-N 2.98Å; D358-Q383 PolarHBondContact OD1-NE2 3.41Å; D358-Q383 VanDerWaalsContact OD1-NE2 3.13Å
359	L	23.5	Very low	26.4	Very low	71 Å²	71	107.4 Å²	107.4	37%	0.372	56%	0.561	S	S	.	*			trans	-93.2	115.3	175.4	-105.2	88.2	0	0	0	112.4	H378 Y398	L359-H378 WeakPolarHBondContact CG-ND1 3.26Å; L359-Y398 HydrophobicContact CD2-CE2 4.09Å
360	F	26.3	Very low	26.7	Very low	115 Å²	115	100.4 Å²	100.4	50%	0.504	54%	0.539	S	S	.	.			trans	-95.2	104.4	170	-70.5	-86.9	0	0	0	110.5	F362 H378	F360-F362 HydrophobicContact CB-CD2 4.11Å; F360-F362 HydrophobicContact CB-CE2 3.48Å; F360-F362 VanDerWaalsContact CB-CE2 3.48Å; F360-F362 HydrophobicContact CB-CZ 4.05Å; F360-F362 HydrophobicContact CG-CE2 4.36Å; F360-F362 WeakPolarHBondContact O-CD2 3.3Å; F360-F362 PolarHBondContact O-N 2.99Å; F360-H378 PolarHBondContact O-CE1 3.23Å; F360-H378 PolarHBondContact O-ND1 2.88Å
361	L	24.7	Very low	27.1	Very low	123 Å²	123	97.4 Å²	97.4	64%	0.644	52%	0.52	S	S	*	.			trans	-68.5	122.1	173.2	-86.2	105.7	0	0	0	111.8
362	F	26	Very low	27.7	Very low	53 Å²	53	96.5 Å²	96.5	23%	0.232	50%	0.499	C	S	.	.			trans	-128.2	89.5	170.2	-64.9	-72.6	0	0	0	110.3	Y227 F360 S376 Y377	Y227-F362 HydrophobicContact CE2-CZ 4.24Å; F360-F362 HydrophobicContact CB-CD2 4.11Å; F360-F362 HydrophobicContact CB-CE2 3.48Å; F360-F362 VanDerWaalsContact CB-CE2 3.48Å; F360-F362 HydrophobicContact CB-CZ 4.05Å; F360-F362 HydrophobicContact CG-CE2 4.36Å; F360-F362 WeakPolarHBondContact O-CD2 3.3Å; F360-F362 PolarHBondContact O-N 2.99Å; F362-S376 WeakPolarHBondContact O-CA 3.44Å; F362-S376 VanDerWaalsContact O-CB 3.25Å; F362-S376 WeakPolarHBondContact O-CB 3.05Å; F362-Y377 WeakPolarHBondContact CD2-O 3.47Å
363	D	31	Very low	28.4	Very low	95 Å²	95	91.3 Å²	91.3	51%	0.508	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	121.3	-179.3	-73.2	-28.5	0	0	0	111.9
364	N	32.4	Very low	29.1	Very low	27 Å²	27	85.3 Å²	85.3	14%	0.144	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	114	155.2	-69.9	-54.8	0	0	0	108.8	Y222 L223 N224 S374 I375	Y222-N364 PolarHBondContact O-OD1 3.16Å; L223-N364 WeakPolarHBondContact CA-ND2 3.44Å; N224-N364 WeakPolarHBondContact CB-OD1 3.47Å; N224-N364 PolarHBondContact N-ND2 3.11Å; N224-N364 VanDerWaalsContact N-ND2 3.11Å; N224-N364 PolarHBondContact N-OD1 3.36Å; N224-N364 VanDerWaalsContact N-OD1 3.12Å; N224-N364 PolarHBondContact O-ND2 2.82Å; N364-S374 VanDerWaalsContact O-CA 3.31Å; N364-S374 WeakPolarHBondContact O-CA 3.49Å; N364-I375 PolarHBondContact N-O 3.09Å; N364-I375 PolarHBondContact O-N 2.83Å
365	T	29.1	Very low	29.8	Very low	76 Å²	76	77.5 Å²	77.5	47%	0.466	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	118	174.3	-51.9	0	0	0	0	109.8	E372 E373 S374	T365-E372 HydrophobicContact CG2-CG 3.4Å; T365-E372 VanDerWaalsContact CG2-OE1 3.27Å; T365-E372 WeakPolarHBondContact CG2-OE1 3.4Å; T365-E373 CarbonylContact C-O 3.47Å; T365-E373 WeakPolarHBondContact CA-O 3.19Å; T365-S374 WeakPolarHBondContact CG2-OG 3.09Å; T365-S374 PolarHBondContact OG1-OG 2.81Å; T365-S374 VanDerWaalsContact OG1-OG 3.07Å
366	L	29.3	Very low	30.3	Very low	89 Å²	89	72.8 Å²	72.8	47%	0.466	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	115.9	175.4	-164.8	116.6	0	0	0	110.4	Y215 T368 E372 E373	Y215-L366 HydrophobicContact CD1-CD2 4.47Å; Y215-L366 HydrophobicContact CE1-CD2 3.41Å; Y215-L366 VanDerWaalsContact CE1-CD2 3.41Å; L366-T368 HydrophobicContact CD2-CG2 4.08Å; L366-E372 CarbonylContact O-C 3.45Å; L366-E372 WeakPolarHBondContact O-CA 3.28Å; L366-E373 PolarHBondContact N-O 3.07Å; L366-E373 PolarHBondContact O-N 2.91Å
367	K	27.8	Very low	31.2	Very low	119 Å²	119	69.2 Å²	69.2	52%	0.517	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	122.1	-179.4	-166.2	167.8	-170.1	125.5	0	110.9	E372 D405	K367-E372 HydrophobicContact CB-CG 4.41Å; K367-E372 HydrophobicContact CG-CG 4.48Å; K367-E372 IonicContact NZ-OE2 3.93Å; K367-E372 PolarHBondContact NZ-OE2 2.87Å; K367-D405 IonicContact NZ-OD2 3.87Å; K367-D405 PolarHBondContact NZ-OD2 3.06Å
368	T	30.2	Very low	32.1	Very low	38 Å²	38	61.6 Å²	61.6	23%	0.233	32%	0.316	C	S	.	.			trans	-105.2	177.2	170.8	75.2	0	0	0	0	110.5	Y215 L366 D370 Y371 S404	Y215-T368 WeakPolarHBondContact OH-CG2 3.27Å; L366-T368 HydrophobicContact CD2-CG2 4.08Å; T368-D370 PolarHBondContact O-N 3.39Å; T368-D370 PolarHBondContact OG1-N 3.26Å; T368-Y371 WeakPolarHBondContact CA-O 3.48Å; T368-Y371 WeakPolarHBondContact CB-O 2.99Å; T368-Y371 PolarHBondContact N-O 3.42Å; T368-Y371 WeakPolarHBondContact OG1-CA 3.15Å; T368-Y371 PolarHBondContact OG1-N 3.38Å; T368-Y371 PolarHBondContact OG1-O 2.68Å; T368-S404 WeakPolarHBondContact O-CB 2.79Å
369	T	27.3	Very low	32.9	Very low	92 Å²	92	58.8 Å²	58.8	56%	0.564	30%	0.3	S	S	*	.	S	Bend	trans	-61.5	-24.5	173.1	38.2	0	0	0	0	113.4	S404 K406	T369-S404 PolarHBondContact O-OG 3.39Å; T369-K406 WeakPolarHBondContact O-CB 3.46Å
370	D	28.2	Very low	33.7	Very low	80 Å²	80	57 Å²	57	43%	0.428	29%	0.294	S	S	.	.	S	Bend	trans	-124.4	-21.6	-168.7	-58	-66.3	0	0	0	113	T368 R403 S404	T368-D370 PolarHBondContact O-N 3.39Å; T368-D370 PolarHBondContact OG1-N 3.26Å; D370-R403 CarbonylContact O-C 3.56Å; D370-R403 WeakPolarHBondContact O-CA 3.2Å; D370-S404 PolarHBondContact O-N 3.44Å
371	Y	34.8	Very low	34.2	Very low	51 Å²	51	52.5 Å²	52.5	20%	0.2	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	151.6	-176.8	-58.2	-86.2	0	0	0	112.5	T368 V401 R402 R403	T368-Y371 WeakPolarHBondContact CA-O 3.48Å; T368-Y371 WeakPolarHBondContact CB-O 2.99Å; T368-Y371 PolarHBondContact N-O 3.42Å; T368-Y371 WeakPolarHBondContact OG1-CA 3.15Å; T368-Y371 PolarHBondContact OG1-N 3.38Å; T368-Y371 PolarHBondContact OG1-O 2.68Å; Y371-V401 HydrophobicContact CD1-CG1 3.87Å; Y371-V401 HydrophobicContact CG-CG1 4.28Å; Y371-R402 CarbonylContact C-O 3.5Å; Y371-R402 WeakPolarHBondContact CA-O 3.09Å; Y371-R402 WeakPolarHBondContact CB-O 3.29Å; Y371-R403 HydrophobicContact CD1-CB 4.4Å; Y371-R403 HydrophobicContact CD1-CG 3.54Å; Y371-R403 HydrophobicContact CE1-CB 4.49Å; Y371-R403 HydrophobicContact CE1-CG 3.24Å; Y371-R403 PolarHBondContact OH-NE 3.24Å; Y371-R403 PolarHBondContact OH-NH2 3.44Å
372	E	35.5	Very low	34.8	Very low	45 Å²	45	55.7 Å²	55.7	21%	0.21	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	111.2	169.4	-174.3	169.3	146.2	0	0	106.7	T365 L366 K367 R402	T365-E372 HydrophobicContact CG2-CG 3.4Å; T365-E372 VanDerWaalsContact CG2-OE1 3.27Å; T365-E372 WeakPolarHBondContact CG2-OE1 3.4Å; L366-E372 CarbonylContact O-C 3.45Å; L366-E372 WeakPolarHBondContact O-CA 3.28Å; K367-E372 HydrophobicContact CB-CG 4.41Å; K367-E372 HydrophobicContact CG-CG 4.48Å; K367-E372 IonicContact NZ-OE2 3.93Å; K367-E372 PolarHBondContact NZ-OE2 2.87Å; E372-R402 HydrophobicContact CB-CB 4.42Å; E372-R402 PolarHBondContact N-O 3.09Å; E372-R402 PolarHBondContact O-N 3.02Å
373	E	38	Very low	35.4	Very low	53 Å²	53	57.8 Å²	57.8	25%	0.248	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	122.6	178.6	-179.5	169.8	-151.4	0	0	109.6	T365 L366 I375 S400 V401 Y416	T365-E373 CarbonylContact C-O 3.47Å; T365-E373 WeakPolarHBondContact CA-O 3.19Å; L366-E373 PolarHBondContact N-O 3.07Å; L366-E373 PolarHBondContact O-N 2.91Å; E373-I375 HydrophobicContact CG-CD1 4.28Å; E373-I375 HydrophobicContact CG-CG1 3.9Å; E373-S400 CarbonylContact C-O 3.59Å; E373-S400 VanDerWaalsContact CA-O 3.26Å; E373-S400 WeakPolarHBondContact CA-O 3.47Å; E373-V401 HydrophobicContact CB-CG2 4.38Å; E373-V401 HydrophobicContact CG-CG2 4Å; E373-Y416 PolarHBondContact OE1-OH 2.91Å
374	S	38.8	Very low	35.8	Very low	20 Å²	20	54.9 Å²	54.9	14%	0.14	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	133.2	168.5	-58.6	0	0	0	0	108.6	N364 T365 G399 S400	N364-S374 VanDerWaalsContact O-CA 3.31Å; N364-S374 WeakPolarHBondContact O-CA 3.49Å; T365-S374 WeakPolarHBondContact CG2-OG 3.09Å; T365-S374 PolarHBondContact OG1-OG 2.81Å; T365-S374 VanDerWaalsContact OG1-OG 3.07Å; S374-G399 CarbonylContact O-C 3.6Å; S374-G399 WeakPolarHBondContact O-CA 3.4Å; S374-S400 WeakPolarHBondContact CB-OG 3.37Å; S374-S400 PolarHBondContact N-O 3.31Å; S374-S400 PolarHBondContact O-N 2.94Å
375	I	41.5	Very low	35.9	Very low	38 Å²	38	59.2 Å²	59.2	20%	0.195	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	134.9	173.9	-51.7	-178.5	0	0	0	107.6	N364 E373 Y377 I397 Y398 Y416	N364-I375 PolarHBondContact N-O 3.09Å; N364-I375 PolarHBondContact O-N 2.83Å; E373-I375 HydrophobicContact CG-CD1 4.28Å; E373-I375 HydrophobicContact CG-CG1 3.9Å; I375-Y377 HydrophobicContact CB-CE2 4.48Å; I375-Y377 HydrophobicContact CG2-CD2 4.29Å; I375-Y377 HydrophobicContact CG2-CE2 3.72Å; I375-I397 HydrophobicContact CG2-CG2 3.58Å; I375-Y398 CarbonylContact C-O 3.54Å; I375-Y398 WeakPolarHBondContact CA-O 3.38Å; I375-Y416 WeakPolarHBondContact CG1-OH 3.26Å
376	S	37.8	Very low	36.3	Very low	7 Å²	7	62.9 Å²	62.9	5%	0.049	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	135.7	171.8	70.4	0	0	0	0	111.2	F362 H378 I397 Y398	F362-S376 WeakPolarHBondContact O-CA 3.44Å; F362-S376 VanDerWaalsContact O-CB 3.25Å; F362-S376 WeakPolarHBondContact O-CB 3.05Å; S376-H378 PolarHBondContact OG-NE2 2.9Å; S376-I397 CarbonylContact O-C 3.57Å; S376-I397 VanDerWaalsContact O-CA 3.3Å; S376-I397 WeakPolarHBondContact O-CA 3.44Å; S376-Y398 PolarHBondContact N-O 3.34Å; S376-Y398 PolarHBondContact O-N 2.86Å; S376-Y398 WeakPolarHBondContact OG-CB 3.33Å; S376-Y398 PolarHBondContact OG-O 3.18Å
377	Y	41.7	Very low	36.4	Very low	15 Å²	15	60.8 Å²	60.8	6%	0.059	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	126.2	-179.1	-64.1	-92.3	0	0	0	108.2	L223 Y226 F362 I375 I397	L223-Y377 HydrophobicContact CD2-CE2 4.4Å; Y226-Y377 AromaticContact CD2-CD1 3.84Å; Y226-Y377 HydrophobicContact CD2-CD1 3.84Å; Y226-Y377 HydrophobicContact CD2-CD2 4.12Å; Y226-Y377 HydrophobicContact CD2-CE1 4.02Å; Y226-Y377 HydrophobicContact CD2-CE2 4.28Å; Y226-Y377 AromaticContact CD2-CG 3.89Å; Y226-Y377 HydrophobicContact CD2-CG 3.89Å; Y226-Y377 HydrophobicContact CE2-CD1 4.02Å; Y226-Y377 HydrophobicContact CE2-CE1 4.07Å; F362-Y377 WeakPolarHBondContact CD2-O 3.47Å; I375-Y377 HydrophobicContact CB-CE2 4.48Å; I375-Y377 HydrophobicContact CG2-CD2 4.29Å; I375-Y377 HydrophobicContact CG2-CE2 3.72Å; Y377-I397 HydrophobicContact CD1-CD1 4.18Å; Y377-I397 HydrophobicContact CD1-CG1 3.86Å; Y377-I397 HydrophobicContact CD1-CG2 4.42Å; Y377-I397 HydrophobicContact CE1-CD1 3.92Å; Y377-I397 HydrophobicContact CE1-CG1 4.07Å; Y377-I397 HydrophobicContact CE1-CG2 4.28Å
378	H	43.8	Very low	36.7	Very low	5 Å²	5	59 Å²	59	2%	0.023	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	142	178.8	-59.3	-116.7	0	0	0	108.6	L359 F360 S376 Y395 D396 Y398	L359-H378 WeakPolarHBondContact CG-ND1 3.26Å; F360-H378 PolarHBondContact O-CE1 3.23Å; F360-H378 PolarHBondContact O-ND1 2.88Å; S376-H378 PolarHBondContact OG-NE2 2.9Å; H378-Y395 WeakPolarHBondContact O-CA 3.4Å; H378-D396 HydrophobicContact CB-CB 4.13Å; H378-D396 PolarHBondContact N-O 2.92Å; H378-D396 PolarHBondContact O-N 3.05Å; H378-Y398 HydrophobicContact CB-CE2 4.4Å; H378-Y398 AromaticContact CD2-CD2 3.3Å; H378-Y398 WeakPolarHBondContact CD2-CD2 3.48Å; H378-Y398 AromaticContact CD2-CE2 3.58Å; H378-Y398 AromaticContact CG-CE2 3.89Å; H378-Y398 AromaticContact NE2-CD2 3.44Å; H378-Y398 WeakPolarHBondContact NE2-CD2 3.39Å; H378-Y398 AromaticContact NE2-CE2 3.86Å
379	H	44.2	Very low	37.2	Very low	22 Å²	22	59.8 Å²	59.8	10%	0.102	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	117	173.2	-61.2	79.4	0	0	0	107.9	Y227 Y392 Y395	Y227-H379 PolarHBondContact O-CE1 2.95Å; Y227-H379 PolarHBondContact O-NE2 3.16Å; H379-Y392 HydrophobicContact CB-CD1 3.95Å; H379-Y392 HydrophobicContact CB-CE1 3.98Å; H379-Y392 AromaticContact CD2-CD1 3.65Å; H379-Y392 AromaticContact CD2-CE1 3.58Å; H379-Y392 AromaticContact CG-CE1 3.99Å; H379-Y395 AromaticContact CD2-CE1 3.54Å; H379-Y395 AromaticContact CE1-CE1 3.95Å; H379-Y395 AromaticContact NE2-CE1 3.28Å; H379-Y395 VanDerWaalsContact NE2-CE1 3.28Å; H379-Y395 WeakPolarHBondContact NE2-CE1 3.41Å
380	S	39	Very low	37.5	Very low	35 Å²	35	62.6 Å²	62.6	25%	0.245	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	129	168.7	54.2	0	0	0	0	109.6	S393 N394 D396	S380-S393 PolarHBondContact O-N 3.27Å; S380-S393 PolarHBondContact O-OG 3.33Å; S380-S393 VanDerWaalsContact O-OG 3.11Å; S380-N394 PolarHBondContact N-O 3.37Å; S380-N394 PolarHBondContact O-N 3.29Å; S380-D396 WeakPolarHBondContact CB-OD2 3.48Å; S380-D396 PolarHBondContact OG-OD2 3.16Å
381	G	38.3	Very low	38	Very low	19 Å²	19	65 Å²	65	20%	0.196	34%	0.344	C	S	.	.			trans	-167.8	147.2	-179.4	0	0	0	0	0	111.7	Q383	G381-Q383 PolarHBondContact O-N 3.33Å
382	K	36.1	Very low	38.3	Very low	191 Å²	191	67.1 Å²	67.1	83%	0.83	35%	0.353	S	S	*	.			trans	-61.6	114.6	176.5	-77	-173.5	177.9	-179.7	0	109.6
383	Q	38.6	Very low	38.4	Very low	97 Å²	97	67.6 Å²	67.6	45%	0.453	36%	0.361	S	S	.	.	B	Isolated β-bridge	trans	-66	135	164.8	-64	-177.3	10.8	0	0	108.8	D358 G381 K388 I389	D358-Q383 PolarHBondContact OD1-NE2 3.41Å; D358-Q383 VanDerWaalsContact OD1-NE2 3.13Å; G381-Q383 PolarHBondContact O-N 3.33Å; Q383-K388 CarbonylContact C-O 3.57Å; Q383-I389 HydrophobicContact CG-CG1 4.03Å
384	D	39.7	Very low	38.3	Very low	33 Å²	33	67.1 Å²	67.1	18%	0.176	36%	0.36	C	S	.	.			trans	-70.3	169.9	165.9	74.9	7.7	0	0	0	110.3	K386 G387 K388 K390	D384-K386 PolarHBondContact O-N 2.86Å; D384-K386 VanDerWaalsContact OD1-C 3.23Å; D384-K386 VanDerWaalsContact OD1-CA 3.22Å; D384-K386 WeakPolarHBondContact OD1-CA 3.38Å; D384-K386 VanDerWaalsContact OD1-CB 3.3Å; D384-K386 WeakPolarHBondContact OD1-CB 3.4Å; D384-K386 PolarHBondContact OD1-N 2.8Å; D384-G387 PolarHBondContact O-N 2.97Å; D384-G387 PolarHBondContact OD1-N 3.02Å; D384-G387 VanDerWaalsContact OD1-N 3.16Å; D384-K388 PolarHBondContact N-O 2.73Å; D384-K388 WeakPolarHBondContact OD1-CA 3.39Å; D384-K388 WeakPolarHBondContact OD1-CB 3.47Å; D384-K388 PolarHBondContact OD1-N 2.68Å; D384-K390 HydrophobicContact CB-CD 3.91Å; D384-K390 HydrophobicContact CB-CG 4.08Å; D384-K390 WeakPolarHBondContact OD2-CE 3.42Å; D384-K390 IonicContact OD2-NZ 3.99Å
385	A	33.6	Very low	38.6	Very low	118 Å²	118	66.3 Å²	66.3	98%	0.975	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-3.1	177.7	0	0	0	0	0	114.4
386	K	38.1	Very low	38.6	Very low	153 Å²	153	65.3 Å²	65.3	67%	0.665	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	12.1	173.4	-58	-176.7	178	-177.3	0	112.1	D384 K388	D384-K386 PolarHBondContact O-N 2.86Å; D384-K386 VanDerWaalsContact OD1-C 3.23Å; D384-K386 VanDerWaalsContact OD1-CA 3.22Å; D384-K386 WeakPolarHBondContact OD1-CA 3.38Å; D384-K386 VanDerWaalsContact OD1-CB 3.3Å; D384-K386 WeakPolarHBondContact OD1-CB 3.4Å; D384-K386 PolarHBondContact OD1-N 2.8Å; K386-K388 VanDerWaalsContact C-N 3.28Å; K386-K388 PolarHBondContact O-N 3.34Å
387	G	30.9	Very low	38.9	Very low	46 Å²	46	65.5 Å²	65.5	47%	0.474	35%	0.349	S	S	.	.	S	Bend	trans	74.7	11	-178.3	0	0	0	0	0	114.3	D384	D384-G387 PolarHBondContact O-N 2.97Å; D384-G387 PolarHBondContact OD1-N 3.02Å; D384-G387 VanDerWaalsContact OD1-N 3.16Å
388	K	35.2	Very low	38.8	Very low	82 Å²	82	68.1 Å²	68.1	36%	0.357	36%	0.359	S	S	.	.			trans	-92.8	123.1	-179.3	-56.6	-171.9	175.3	-170.3	0	110.5	G273 Q383 D384 K386 K390	G273-K388 WeakPolarHBondContact O-CE 3.5Å; G273-K388 PolarHBondContact O-NZ 3.09Å; G273-K388 VanDerWaalsContact O-NZ 3.12Å; Q383-K388 CarbonylContact C-O 3.57Å; D384-K388 PolarHBondContact N-O 2.73Å; D384-K388 WeakPolarHBondContact OD1-CA 3.39Å; D384-K388 WeakPolarHBondContact OD1-CB 3.47Å; D384-K388 PolarHBondContact OD1-N 2.68Å; K386-K388 VanDerWaalsContact C-N 3.28Å; K386-K388 PolarHBondContact O-N 3.34Å; K388-K390 PolarHBondContact O-N 3.46Å
389	I	40.2	Very low	38.7	Very low	54 Å²	54	68.2 Å²	68.2	28%	0.277	36%	0.362	S	S	.	.	B	Isolated β-bridge	trans	-67.1	106.1	168.4	-58.9	172.5	0	0	0	107.6	Q383 Y392	Q383-I389 HydrophobicContact CG-CG1 4.03Å; I389-Y392 HydrophobicContact CD1-CE1 4.38Å; I389-Y392 HydrophobicContact CG2-CD1 3.86Å; I389-Y392 HydrophobicContact CG2-CE1 4.01Å; I389-Y392 HydrophobicContact CG2-CG 4.42Å
390	K	34.3	Very low	38.3	Very low	150 Å²	150	68.8 Å²	68.8	65%	0.652	37%	0.368	S	S	*	.	S	Bend	trans	-79.2	-32.3	-175.7	-87.1	-175.4	176.3	175.6	0	113	D384 K388	D384-K390 HydrophobicContact CB-CD 3.91Å; D384-K390 HydrophobicContact CB-CG 4.08Å; D384-K390 WeakPolarHBondContact OD2-CE 3.42Å; D384-K390 IonicContact OD2-NZ 3.99Å; K388-K390 PolarHBondContact O-N 3.46Å
391	N	37.7	Very low	38.4	Very low	131 Å²	131	69 Å²	69	70%	0.701	37%	0.368	S	S	*	.	S	Bend	trans	-143.8	116.8	178.2	-69.2	-39.5	0	0	0	106.5	S393	N391-S393 PolarHBondContact O-N 2.82Å; N391-S393 VanDerWaalsContact O-N 3.16Å
392	Y	40.5	Very low	38.5	Very low	96 Å²	96	73.8 Å²	73.8	38%	0.376	38%	0.38	S	S	.	.			trans	-62	115.5	163.8	-59.5	-73.9	0	0	0	106.5	I229 H379 I389	I229-Y392 HydrophobicContact CD1-CG 4.18Å; I229-Y392 HydrophobicContact CG1-CD2 4.01Å; I229-Y392 HydrophobicContact CG1-CG 3.93Å; H379-Y392 HydrophobicContact CB-CD1 3.95Å; H379-Y392 HydrophobicContact CB-CE1 3.98Å; H379-Y392 AromaticContact CD2-CD1 3.65Å; H379-Y392 AromaticContact CD2-CE1 3.58Å; H379-Y392 AromaticContact CG-CE1 3.99Å; I389-Y392 HydrophobicContact CD1-CE1 4.38Å; I389-Y392 HydrophobicContact CG2-CD1 3.86Å; I389-Y392 HydrophobicContact CG2-CE1 4.01Å; I389-Y392 HydrophobicContact CG2-CG 4.42Å
393	S	38.8	Very low	38.6	Very low	55 Å²	55	66.2 Å²	66.2	39%	0.385	35%	0.346	S	S	.	.			trans	-81.5	-48.2	174.8	40.3	0	0	0	0	108.7	S380 N391 S422	S380-S393 PolarHBondContact O-N 3.27Å; S380-S393 PolarHBondContact O-OG 3.33Å; S380-S393 VanDerWaalsContact O-OG 3.11Å; N391-S393 PolarHBondContact O-N 2.82Å; N391-S393 VanDerWaalsContact O-N 3.16Å; S393-S422 PolarHBondContact O-N 3.28Å
394	N	35.4	Very low	38.7	Very low	42 Å²	42	61.7 Å²	61.7	23%	0.225	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	148.6	-163.6	-57.7	8.5	0	0	0	110	S380 I419 I420 D421	S380-N394 PolarHBondContact N-O 3.37Å; S380-N394 PolarHBondContact O-N 3.29Å; N394-I419 HydrophobicContact CB-CG2 4.13Å; N394-I420 CarbonylContact C-O 3.52Å; N394-D421 WeakPolarHBondContact CB-OD1 3.48Å; N394-D421 PolarHBondContact ND2-OD1 2.92Å; N394-D421 PolarHBondContact ND2-OD2 2.97Å; N394-D421 PolarHBondContact OD1-OD1 3.07Å
395	Y	46.3	Very low	38.8	Very low	3 Å²	3	65.2 Å²	65.2	1%	0.012	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	134.1	162.5	-83.9	-67.8	0	0	0	109.2	Y227 P228 I229 Y234 H378 H379 I419 I420	Y227-Y395 PolarHBondContact O-OH 2.67Å; P228-Y395 VanDerWaalsContact C-OH 3.26Å; P228-Y395 WeakPolarHBondContact CA-OH 3.45Å; I229-Y395 HydrophobicContact CB-CE2 3.54Å; I229-Y395 WeakPolarHBondContact CB-OH 3.24Å; I229-Y395 HydrophobicContact CD1-CD1 4.16Å; I229-Y395 HydrophobicContact CD1-CD2 3.24Å; I229-Y395 HydrophobicContact CD1-CE1 3.92Å; I229-Y395 HydrophobicContact CD1-CE2 2.96Å; I229-Y395 HydrophobicContact CD1-CG 3.86Å; I229-Y395 HydrophobicContact CG1-CD2 4.09Å; I229-Y395 HydrophobicContact CG1-CE1 3.95Å; I229-Y395 HydrophobicContact CG1-CE2 3.29Å; I229-Y395 VanDerWaalsContact CG1-OH 3.22Å; I229-Y395 WeakPolarHBondContact CG1-OH 3.28Å; I229-Y395 PolarHBondContact N-OH 3.42Å; Y234-Y395 HydrophobicContact CD2-CE2 4.31Å; Y234-Y395 HydrophobicContact CE2-CE2 4.1Å; H378-Y395 WeakPolarHBondContact O-CA 3.4Å; H379-Y395 AromaticContact CD2-CE1 3.54Å; H379-Y395 AromaticContact CE1-CE1 3.95Å; H379-Y395 AromaticContact NE2-CE1 3.28Å; H379-Y395 VanDerWaalsContact NE2-CE1 3.28Å; H379-Y395 WeakPolarHBondContact NE2-CE1 3.41Å; Y395-I419 CarbonylContact O-C 3.49Å; Y395-I419 WeakPolarHBondContact O-CA 3.12Å; Y395-I420 HydrophobicContact CD2-CB 4.41Å; Y395-I420 PolarHBondContact N-O 3.34Å; Y395-I420 PolarHBondContact O-N 3.32Å
396	D	40.8	Very low	39	Very low	17 Å²	17	67.5 Å²	67.5	9%	0.091	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	112.8	170.6	-56.2	-57.4	0	0	0	107.7	H378 S380 Y398 H417 I419	H378-D396 HydrophobicContact CB-CB 4.13Å; H378-D396 PolarHBondContact N-O 2.92Å; H378-D396 PolarHBondContact O-N 3.05Å; S380-D396 WeakPolarHBondContact CB-OD2 3.48Å; S380-D396 PolarHBondContact OG-OD2 3.16Å; D396-Y398 HydrophobicContact CB-CE2 3.75Å; D396-H417 WeakPolarHBondContact CB-NE2 3.39Å; D396-H417 IonicContact OD1-NE2 2.88Å; D396-H417 PolarHBondContact OD1-NE2 3.49Å; D396-I419 WeakPolarHBondContact OD1-CG1 3.21Å
397	I	44.6	Very low	38.9	Very low	12 Å²	12	61.5 Å²	61.5	6%	0.062	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	105.2	177.3	-53.5	175.9	0	0	0	107.4	I375 S376 Y377 H417 T418 I420	I375-I397 HydrophobicContact CG2-CG2 3.58Å; S376-I397 CarbonylContact O-C 3.57Å; S376-I397 VanDerWaalsContact O-CA 3.3Å; S376-I397 WeakPolarHBondContact O-CA 3.44Å; Y377-I397 HydrophobicContact CD1-CD1 4.18Å; Y377-I397 HydrophobicContact CD1-CG1 3.86Å; Y377-I397 HydrophobicContact CD1-CG2 4.42Å; Y377-I397 HydrophobicContact CE1-CD1 3.92Å; Y377-I397 HydrophobicContact CE1-CG1 4.07Å; Y377-I397 HydrophobicContact CE1-CG2 4.28Å; I397-H417 CarbonylContact O-C 3.52Å; I397-H417 VanDerWaalsContact O-CA 3.26Å; I397-H417 WeakPolarHBondContact O-CA 3.21Å; I397-T418 WeakPolarHBondContact CB-O 3.33Å; I397-T418 PolarHBondContact N-O 3.23Å; I397-T418 PolarHBondContact O-N 3.02Å; I397-I420 HydrophobicContact CD1-CD1 3.58Å; I397-I420 HydrophobicContact CD1-CG1 4.24Å
398	Y	39.1	Very low	39.2	Very low	69 Å²	69	66.3 Å²	66.3	27%	0.271	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	132.5	170.2	-54.7	-92.8	0	0	0	108.6	L359 I375 S376 H378 D396 Y416 H417	L359-Y398 HydrophobicContact CD2-CE2 4.09Å; I375-Y398 CarbonylContact C-O 3.54Å; I375-Y398 WeakPolarHBondContact CA-O 3.38Å; S376-Y398 PolarHBondContact N-O 3.34Å; S376-Y398 PolarHBondContact O-N 2.86Å; S376-Y398 WeakPolarHBondContact OG-CB 3.33Å; S376-Y398 PolarHBondContact OG-O 3.18Å; H378-Y398 HydrophobicContact CB-CE2 4.4Å; H378-Y398 AromaticContact CD2-CD2 3.3Å; H378-Y398 WeakPolarHBondContact CD2-CD2 3.48Å; H378-Y398 AromaticContact CD2-CE2 3.58Å; H378-Y398 AromaticContact CG-CE2 3.89Å; H378-Y398 AromaticContact NE2-CD2 3.44Å; H378-Y398 WeakPolarHBondContact NE2-CD2 3.39Å; H378-Y398 AromaticContact NE2-CE2 3.86Å; D396-Y398 HydrophobicContact CB-CE2 3.75Å; Y398-Y416 CarbonylContact C-O 3.5Å; Y398-Y416 WeakPolarHBondContact CA-O 2.68Å; Y398-H417 HydrophobicContact CD1-CB 3.91Å; Y398-H417 AromaticContact CD1-CD2 3.71Å; Y398-H417 AromaticContact CD1-CG 3.78Å; Y398-H417 HydrophobicContact CE1-CB 4.08Å; Y398-H417 AromaticContact CE1-CD2 3.4Å; Y398-H417 VanDerWaalsContact CE1-CD2 3.4Å; Y398-H417 WeakPolarHBondContact CE1-CD2 3.26Å; Y398-H417 AromaticContact CE1-CE1 3.92Å; Y398-H417 AromaticContact CE1-CG 3.51Å; Y398-H417 AromaticContact CE1-ND1 3.83Å; Y398-H417 AromaticContact CE1-NE2 3.66Å; Y398-H417 AromaticContact CZ-CD2 3.67Å; Y398-H417 AromaticContact CZ-NE2 3.55Å
399	G	40.9	Very low	39.1	Very low	7 Å²	7	66.7 Å²	66.7	7%	0.072	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	158.9	168.6	0	0	0	0	0	113	S374 K415 Y416	S374-G399 CarbonylContact O-C 3.6Å; S374-G399 WeakPolarHBondContact O-CA 3.4Å; G399-K415 CarbonylContact O-C 3.56Å; G399-K415 WeakPolarHBondContact O-CA 3.38Å; G399-Y416 VanDerWaalsContact CA-CZ 3.44Å; G399-Y416 PolarHBondContact N-O 3.04Å; G399-Y416 WeakPolarHBondContact O-CD1 3.19Å; G399-Y416 PolarHBondContact O-N 3.38Å
400	S	37.1	Very low	39.1	Very low	34 Å²	34	67.2 Å²	67.2	24%	0.238	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	123.3	174	70.7	0	0	0	0	108.7	E373 S374 K414	E373-S400 CarbonylContact C-O 3.59Å; E373-S400 VanDerWaalsContact CA-O 3.26Å; E373-S400 WeakPolarHBondContact CA-O 3.47Å; S374-S400 WeakPolarHBondContact CB-OG 3.37Å; S374-S400 PolarHBondContact N-O 3.31Å; S374-S400 PolarHBondContact O-N 2.94Å; S400-K414 CarbonylContact C-O 3.36Å; S400-K414 WeakPolarHBondContact CA-O 3.36Å
401	V	40.5	Very low	39.3	Very low	40 Å²	40	65.6 Å²	65.6	24%	0.242	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	109.7	170.6	-173.8	0	0	0	0	107.5	Y371 E373 S413 K414 Y416	Y371-V401 HydrophobicContact CD1-CG1 3.87Å; Y371-V401 HydrophobicContact CG-CG1 4.28Å; E373-V401 HydrophobicContact CB-CG2 4.38Å; E373-V401 HydrophobicContact CG-CG2 4Å; V401-S413 CarbonylContact O-C 3.53Å; V401-S413 WeakPolarHBondContact O-CA 3.25Å; V401-K414 PolarHBondContact N-O 3.08Å; V401-K414 PolarHBondContact O-N 3.43Å; V401-Y416 HydrophobicContact CG2-CE1 3.95Å
402	R	40.1	Very low	39.5	Very low	120 Å²	120	61.1 Å²	61.1	45%	0.453	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	149.1	169.8	-174.8	-179.2	160.2	163.9	-6.3	108.8	Y371 E372 D405	Y371-R402 CarbonylContact C-O 3.5Å; Y371-R402 WeakPolarHBondContact CA-O 3.09Å; Y371-R402 WeakPolarHBondContact CB-O 3.29Å; E372-R402 HydrophobicContact CB-CB 4.42Å; E372-R402 PolarHBondContact N-O 3.09Å; E372-R402 PolarHBondContact O-N 3.02Å; R402-D405 IonicContact CZ-OD1 2.98Å; R402-D405 IonicContact NH2-OD1 2.67Å; R402-D405 PolarHBondContact NH2-OD1 3.43Å
403	R	39.1	Very low	39.4	Very low	31 Å²	31	60.4 Å²	60.4	12%	0.117	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	134	163.9	-89	178.9	167.5	161.6	5.1	111.2	D370 Y371 S410 G412	D370-R403 CarbonylContact O-C 3.56Å; D370-R403 WeakPolarHBondContact O-CA 3.2Å; Y371-R403 HydrophobicContact CD1-CB 4.4Å; Y371-R403 HydrophobicContact CD1-CG 3.54Å; Y371-R403 HydrophobicContact CE1-CB 4.49Å; Y371-R403 HydrophobicContact CE1-CG 3.24Å; Y371-R403 PolarHBondContact OH-NE 3.24Å; Y371-R403 PolarHBondContact OH-NH2 3.44Å; R403-S410 WeakPolarHBondContact CD-O 3.46Å; R403-S410 PolarHBondContact NH1-O 3.1Å; R403-G412 PolarHBondContact N-O 3.16Å; R403-G412 VanDerWaalsContact N-O 3.09Å
404	S	40.8	Very low	39.4	Very low	3 Å²	3	63 Å²	63	2%	0.021	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-63.1	150.1	176.1	97.9	0	0	0	0	109	T368 T369 D370 K406 S407	T368-S404 WeakPolarHBondContact O-CB 2.79Å; T369-S404 PolarHBondContact O-OG 3.39Å; D370-S404 PolarHBondContact O-N 3.44Å; S404-K406 PolarHBondContact O-N 2.95Å; S404-K406 PolarHBondContact OG-N 2.61Å; S404-S407 WeakPolarHBondContact O-CB 2.74Å; S404-S407 PolarHBondContact O-N 3.08Å
405	D	41.2	Very low	39.5	Very low	107 Å²	107	67.1 Å²	67.1	57%	0.572	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-0.2	-179.3	-42	-61.9	0	0	0	113.5	K367 R402	K367-D405 IonicContact NZ-OD2 3.87Å; K367-D405 PolarHBondContact NZ-OD2 3.06Å; R402-D405 IonicContact CZ-OD1 2.98Å; R402-D405 IonicContact NH2-OD1 2.67Å; R402-D405 PolarHBondContact NH2-OD1 3.43Å
406	K	38.1	Very low	39.2	Very low	165 Å²	165	68 Å²	68	72%	0.717	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-10.2	174.1	-62.8	-177.8	178.7	179.7	0	113.5	T369 S404	T369-K406 WeakPolarHBondContact O-CB 3.46Å; S404-K406 PolarHBondContact O-N 2.95Å; S404-K406 PolarHBondContact OG-N 2.61Å
407	S	35.7	Very low	39.3	Very low	27 Å²	27	67.8 Å²	67.8	19%	0.189	36%	0.355	C	S	.	.			trans	-74.1	123.4	176.5	158.9	0	0	0	0	111	S404 L409	S404-S407 WeakPolarHBondContact O-CB 2.74Å; S404-S407 PolarHBondContact O-N 3.08Å; S407-L409 PolarHBondContact O-N 2.96Å; S407-L409 PolarHBondContact OG-N 2.91Å; S407-L409 VanDerWaalsContact OG-N 3.16Å; S407-L409 PolarHBondContact OG-O 3.26Å
408	K	37.5	Very low	39.2	Very low	147 Å²	147	67.2 Å²	67.2	64%	0.639	35%	0.352	S	S	*	.	S	Bend	trans	-70.8	-7.2	171.9	-67.1	-173.7	177.9	-176.9	0	114
409	L	33.3	Very low	39.3	Very low	90 Å²	90	65.3 Å²	65.3	47%	0.471	35%	0.346	S	S	.	.	S	Bend	trans	-97.7	143.5	-180	-66.8	151.3	0	0	0	109.3	P206 S407	P206-L409 HydrophobicContact CB-CD1 4.07Å; P206-L409 HydrophobicContact CG-CD1 4.08Å; S407-L409 PolarHBondContact O-N 2.96Å; S407-L409 PolarHBondContact OG-N 2.91Å; S407-L409 VanDerWaalsContact OG-N 3.16Å; S407-L409 PolarHBondContact OG-O 3.26Å
410	S	39.2	Very low	39.5	Very low	66 Å²	66	65 Å²	65	46%	0.462	34%	0.343	S	S	.	.			trans	-37.9	137.8	-172.7	59.3	0	0	0	0	114.2	R403 G412	R403-S410 WeakPolarHBondContact CD-O 3.46Å; R403-S410 PolarHBondContact NH1-O 3.1Å; S410-G412 PolarHBondContact O-N 3.01Å
411	S	38.2	Very low	39.7	Very low	115 Å²	115	64.9 Å²	64.9	80%	0.804	34%	0.34	S	S	*	.			trans	-64.2	91.1	175.9	53	0	0	0	0	110.2
412	G	43.1	Very low	39.7	Very low	37 Å²	37	63.6 Å²	63.6	38%	0.381	33%	0.333	S	S	.	.			trans	-101.5	130.7	167.8	0	0	0	0	0	109.6	R403 S410	R403-G412 PolarHBondContact N-O 3.16Å; R403-G412 VanDerWaalsContact N-O 3.09Å; S410-G412 PolarHBondContact O-N 3.01Å
413	S	36.7	Very low	39.7	Very low	81 Å²	81	59.3 Å²	59.3	57%	0.566	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104	134.6	158	56.6	0	0	0	0	108.7	V401	V401-S413 CarbonylContact O-C 3.53Å; V401-S413 WeakPolarHBondContact O-CA 3.25Å
414	K	39.5	Very low	39.8	Very low	110 Å²	110	64.5 Å²	64.5	48%	0.478	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	133	167.5	-67.8	-169	175	-165.9	0	108.4	L241 S400 V401	L241-K414 HydrophobicContact CD2-CD 4.41Å; S400-K414 CarbonylContact C-O 3.36Å; S400-K414 WeakPolarHBondContact CA-O 3.36Å; V401-K414 PolarHBondContact N-O 3.08Å; V401-K414 PolarHBondContact O-N 3.43Å
415	K	37.5	Very low	39.6	Very low	128 Å²	128	74.8 Å²	74.8	56%	0.557	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.5	152	173.9	-70.2	177.9	-177	179.9	0	108.7	G399 Y436	G399-K415 CarbonylContact O-C 3.56Å; G399-K415 WeakPolarHBondContact O-CA 3.38Å; K415-Y436 PolarHBondContact N-O 3.45Å; K415-Y436 VanDerWaalsContact N-O 3.16Å; K415-Y436 PolarHBondContact O-N 3.3Å; K415-Y436 VanDerWaalsContact O-O 3.1Å
416	Y	40.5	Very low	39.5	Very low	22 Å²	22	75.5 Å²	75.5	9%	0.086	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	153.9	175.6	63.9	-96.9	0	0	0	110.1	E373 I375 Y398 G399 V401 Y433 F434	E373-Y416 PolarHBondContact OE1-OH 2.91Å; I375-Y416 WeakPolarHBondContact CG1-OH 3.26Å; Y398-Y416 CarbonylContact C-O 3.5Å; Y398-Y416 WeakPolarHBondContact CA-O 2.68Å; G399-Y416 VanDerWaalsContact CA-CZ 3.44Å; G399-Y416 PolarHBondContact N-O 3.04Å; G399-Y416 WeakPolarHBondContact O-CD1 3.19Å; G399-Y416 PolarHBondContact O-N 3.38Å; V401-Y416 HydrophobicContact CG2-CE1 3.95Å; Y416-Y433 WeakPolarHBondContact CB-OH 3.48Å; Y416-Y433 HydrophobicContact CD2-CE2 4.19Å; Y416-Y433 HydrophobicContact CG-CE2 4.05Å; Y416-F434 CarbonylContact C-O 3.58Å; Y416-F434 WeakPolarHBondContact CA-O 3.34Å
417	H	43.1	Very low	39.6	Very low	12 Å²	12	72.7 Å²	72.7	6%	0.056	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	128.8	171.2	177.2	-153.6	0	0	0	106.9	D396 I397 Y398 I419 Y433 F434 Y436	D396-H417 WeakPolarHBondContact CB-NE2 3.39Å; D396-H417 IonicContact OD1-NE2 2.88Å; D396-H417 PolarHBondContact OD1-NE2 3.49Å; I397-H417 CarbonylContact O-C 3.52Å; I397-H417 VanDerWaalsContact O-CA 3.26Å; I397-H417 WeakPolarHBondContact O-CA 3.21Å; Y398-H417 HydrophobicContact CD1-CB 3.91Å; Y398-H417 AromaticContact CD1-CD2 3.71Å; Y398-H417 AromaticContact CD1-CG 3.78Å; Y398-H417 HydrophobicContact CE1-CB 4.08Å; Y398-H417 AromaticContact CE1-CD2 3.4Å; Y398-H417 VanDerWaalsContact CE1-CD2 3.4Å; Y398-H417 WeakPolarHBondContact CE1-CD2 3.26Å; Y398-H417 AromaticContact CE1-CE1 3.92Å; Y398-H417 AromaticContact CE1-CG 3.51Å; Y398-H417 AromaticContact CE1-ND1 3.83Å; Y398-H417 AromaticContact CE1-NE2 3.66Å; Y398-H417 AromaticContact CZ-CD2 3.67Å; Y398-H417 AromaticContact CZ-NE2 3.55Å; H417-I419 VanDerWaalsContact CE1-CG1 3.48Å; H417-I419 WeakPolarHBondContact CE1-CG1 2.91Å; H417-I419 WeakPolarHBondContact NE2-CG1 3.48Å; H417-Y433 CarbonylContact O-C 3.49Å; H417-F434 HydrophobicContact CB-CB 4.21Å; H417-F434 HydrophobicContact CB-CD2 4.5Å; H417-F434 PolarHBondContact N-O 3.23Å; H417-F434 AromaticContact ND1-CD2 3.85Å; H417-F434 PolarHBondContact O-N 3.18Å; H417-Y436 HydrophobicContact CB-CD2 4.15Å; H417-Y436 HydrophobicContact CB-CE2 3.21Å; H417-Y436 PolarHBondContact ND1-OH 3.46Å; H417-Y436 VanDerWaalsContact ND1-OH 3.1Å
418	T	42.7	Very low	39.7	Very low	1 Å²	1	74.4 Å²	74.4	1%	0.006	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	113.8	176.5	-53.9	0	0	0	0	107.6	F236 I397 I420 V431 T432 Y433	F236-T418 HydrophobicContact CD2-CG2 4.47Å; F236-T418 HydrophobicContact CE2-CG2 4.43Å; I397-T418 WeakPolarHBondContact CB-O 3.33Å; I397-T418 PolarHBondContact N-O 3.23Å; I397-T418 PolarHBondContact O-N 3.02Å; T418-I420 HydrophobicContact CG2-CG1 4.3Å; T418-V431 HydrophobicContact CG2-CG1 3.53Å; T418-T432 CarbonylContact C-O 3.39Å; T418-T432 VanDerWaalsContact CA-O 3.24Å; T418-T432 WeakPolarHBondContact CA-O 3.27Å; T418-Y433 WeakPolarHBondContact OG1-CD2 3.47Å
419	I	40.5	Very low	39.9	Very low	28 Å²	28	68.3 Å²	68.3	14%	0.144	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	132.8	171.1	-51.6	-174.2	0	0	0	108.2	N394 Y395 D396 H417 D421 V431 T432 F434	N394-I419 HydrophobicContact CB-CG2 4.13Å; Y395-I419 CarbonylContact O-C 3.49Å; Y395-I419 WeakPolarHBondContact O-CA 3.12Å; D396-I419 WeakPolarHBondContact OD1-CG1 3.21Å; H417-I419 VanDerWaalsContact CE1-CG1 3.48Å; H417-I419 WeakPolarHBondContact CE1-CG1 2.91Å; H417-I419 WeakPolarHBondContact NE2-CG1 3.48Å; I419-D421 WeakPolarHBondContact CG2-OD1 3.45Å; I419-V431 CarbonylContact O-C 3.38Å; I419-V431 VanDerWaalsContact O-CA 3.28Å; I419-V431 WeakPolarHBondContact O-CA 3.41Å; I419-T432 PolarHBondContact N-O 3.24Å; I419-T432 PolarHBondContact O-N 3.08Å; I419-F434 HydrophobicContact CD1-CD2 4.42Å; I419-F434 HydrophobicContact CD1-CE2 3.6Å; I419-F434 HydrophobicContact CD1-CZ 4.39Å; I419-F434 HydrophobicContact CG1-CD2 4.33Å; I419-F434 HydrophobicContact CG1-CE2 3.85Å
420	I	44.8	Very low	40.1	Very low	2 Å²	2	66.7 Å²	66.7	1%	0.01	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	103.4	170.4	-49.3	177.8	0	0	0	108.9	Y234 L248 N394 Y395 I397 T418 H429 Y430 V431	Y234-I420 HydrophobicContact CD1-CD1 4.28Å; Y234-I420 HydrophobicContact CG-CD1 4.05Å; L248-I420 HydrophobicContact CD1-CD1 4.44Å; N394-I420 CarbonylContact C-O 3.52Å; Y395-I420 HydrophobicContact CD2-CB 4.41Å; Y395-I420 PolarHBondContact N-O 3.34Å; Y395-I420 PolarHBondContact O-N 3.32Å; I397-I420 HydrophobicContact CD1-CD1 3.58Å; I397-I420 HydrophobicContact CD1-CG1 4.24Å; T418-I420 HydrophobicContact CG2-CG1 4.3Å; I420-H429 HydrophobicContact CG2-CB 4.12Å; I420-Y430 CarbonylContact C-O 3.54Å; I420-Y430 VanDerWaalsContact CA-O 3.29Å; I420-Y430 WeakPolarHBondContact CA-O 3.14Å; I420-V431 HydrophobicContact CG1-CG2 4.49Å
421	D	41.6	Very low	40.2	Very low	30 Å²	30	64.4 Å²	64.4	16%	0.16	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	125.7	174.7	-59.2	-5.6	0	0	0	108.6	N394 I419 H429 Y430	N394-D421 WeakPolarHBondContact CB-OD1 3.48Å; N394-D421 PolarHBondContact ND2-OD1 2.92Å; N394-D421 PolarHBondContact ND2-OD2 2.97Å; N394-D421 PolarHBondContact OD1-OD1 3.07Å; I419-D421 WeakPolarHBondContact CG2-OD1 3.45Å; D421-H429 CarbonylContact O-C 3.44Å; D421-H429 VanDerWaalsContact O-CA 3.28Å; D421-H429 WeakPolarHBondContact O-CA 3.38Å; D421-Y430 HydrophobicContact CB-CD2 4.35Å; D421-Y430 PolarHBondContact N-O 3.27Å; D421-Y430 PolarHBondContact O-N 3.31Å
422	S	40.4	Very low	40.1	Very low	14 Å²	14	60.2 Å²	60.2	10%	0.098	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	105.9	-175.9	-59.8	0	0	0	0	110.3	S393 K424 H429	S393-S422 PolarHBondContact O-N 3.28Å; S422-K424 PolarHBondContact O-N 3.24Å; S422-H429 WeakPolarHBondContact CB-ND1 3.48Å; S422-H429 PolarHBondContact OG-CE1 2.93Å; S422-H429 PolarHBondContact OG-ND1 2.75Å
423	D	40.7	Very low	39.9	Very low	29 Å²	29	61.4 Å²	61.4	16%	0.155	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	90.5	170.1	-167	-15	0	0	0	109.3	R425 K426 N427 K428 Y430	D423-R425 PolarHBondContact O-N 3.18Å; D423-R425 VanDerWaalsContact O-N 3.09Å; D423-R425 WeakPolarHBondContact OD1-CB 3.47Å; D423-R425 PolarHBondContact OD1-N 3.27Å; D423-R425 IonicContact OD1-NE 3.28Å; D423-R425 PolarHBondContact OD1-NE 3.29Å; D423-R425 IonicContact OD1-NH2 3.89Å; D423-R425 IonicContact OD2-NH2 3.54Å; D423-K426 HydrophobicContact CB-CB 4.21Å; D423-K426 HydrophobicContact CB-CD 4.49Å; D423-K426 HydrophobicContact CB-CG 4.45Å; D423-K426 PolarHBondContact O-N 2.91Å; D423-K426 VanDerWaalsContact OD2-CD 3.26Å; D423-K426 WeakPolarHBondContact OD2-CD 3.34Å; D423-K426 WeakPolarHBondContact OD2-CE 3.06Å; D423-K426 WeakPolarHBondContact OD2-CG 3.47Å; D423-K426 IonicContact OD2-NZ 3.27Å; D423-N427 PolarHBondContact O-N 3.45Å; D423-K428 PolarHBondContact N-O 3.47Å; D423-K428 PolarHBondContact O-N 3.03Å; D423-Y430 HydrophobicContact CB-CE2 4.22Å
424	K	40.9	Very low	39.8	Very low	141 Å²	141	60.9 Å²	60.9	61%	0.613	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-25.1	177.5	-67.9	-168.6	175.1	-166.7	0	113.4	I229 S422	I229-K424 VanDerWaalsContact CG2-CE 3.46Å; I229-K424 PolarHBondContact O-NZ 3.37Å; S422-K424 PolarHBondContact O-N 3.24Å
425	R	36.8	Very low	39.5	Very low	218 Å²	218	60.1 Å²	60.1	82%	0.823	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-33.4	179.5	-58.6	173	-65.4	177.1	1.2	111.9	D423	D423-R425 PolarHBondContact O-N 3.18Å; D423-R425 VanDerWaalsContact O-N 3.09Å; D423-R425 WeakPolarHBondContact OD1-CB 3.47Å; D423-R425 PolarHBondContact OD1-N 3.27Å; D423-R425 IonicContact OD1-NE 3.28Å; D423-R425 PolarHBondContact OD1-NE 3.29Å; D423-R425 IonicContact OD1-NH2 3.89Å; D423-R425 IonicContact OD2-NH2 3.54Å
426	K	39	Very low	39.3	Very low	122 Å²	122	62.7 Å²	62.7	53%	0.53	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-7.4	179.8	-63.5	-177.7	-173.6	176.5	0	112.3	D423 K428	D423-K426 HydrophobicContact CB-CB 4.21Å; D423-K426 HydrophobicContact CB-CD 4.49Å; D423-K426 HydrophobicContact CB-CG 4.45Å; D423-K426 PolarHBondContact O-N 2.91Å; D423-K426 VanDerWaalsContact OD2-CD 3.26Å; D423-K426 WeakPolarHBondContact OD2-CD 3.34Å; D423-K426 WeakPolarHBondContact OD2-CE 3.06Å; D423-K426 WeakPolarHBondContact OD2-CG 3.47Å; D423-K426 IonicContact OD2-NZ 3.27Å; K426-K428 HydrophobicContact CB-CB 4.12Å; K426-K428 HydrophobicContact CB-CD 4.33Å; K426-K428 HydrophobicContact CB-CG 4.06Å; K426-K428 PolarHBondContact O-N 3.23Å
427	N	39.9	Very low	39.2	Very low	106 Å²	106	64.7 Å²	64.7	57%	0.567	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.8	55.4	-166	-170.5	38.7	0	0	0	108.8	Y123 D423	Y123-N427 WeakPolarHBondContact CE2-O 3.42Å; Y123-N427 PolarHBondContact OH-O 3.12Å; D423-N427 PolarHBondContact O-N 3.45Å
428	K	37.5	Very low	39	Very low	63 Å²	63	67.5 Å²	67.5	27%	0.274	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	142.6	-180	-74.2	-171.1	179	-165.4	0	110.3	Y123 D423 K426 Y430	Y123-K428 HydrophobicContact CE2-CG 4.05Å; D423-K428 PolarHBondContact N-O 3.47Å; D423-K428 PolarHBondContact O-N 3.03Å; K426-K428 HydrophobicContact CB-CB 4.12Å; K426-K428 HydrophobicContact CB-CD 4.33Å; K426-K428 HydrophobicContact CB-CG 4.06Å; K426-K428 PolarHBondContact O-N 3.23Å; K428-Y430 HydrophobicContact CB-CE2 4.43Å
429	H	41.8	Very low	38.8	Very low	19 Å²	19	71.2 Å²	71.2	9%	0.088	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	133.8	171.8	-57.8	-71	0	0	0	109.7	Y234 I420 D421 S422	Y234-H429 AromaticContact CE1-NE2 4Å; Y234-H429 AromaticContact CZ-CE1 3.77Å; Y234-H429 AromaticContact CZ-NE2 4Å; Y234-H429 PolarHBondContact OH-CE1 2.98Å; Y234-H429 PolarHBondContact OH-NE2 3.05Å; Y234-H429 VanDerWaalsContact OH-NE2 3.13Å; I420-H429 HydrophobicContact CG2-CB 4.12Å; D421-H429 CarbonylContact O-C 3.44Å; D421-H429 VanDerWaalsContact O-CA 3.28Å; D421-H429 WeakPolarHBondContact O-CA 3.38Å; S422-H429 WeakPolarHBondContact CB-ND1 3.48Å; S422-H429 PolarHBondContact OG-CE1 2.93Å; S422-H429 PolarHBondContact OG-ND1 2.75Å
430	Y	38.6	Very low	38.7	Very low	57 Å²	57	73.7 Å²	73.7	22%	0.224	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	123.5	172.5	-56.4	-92.8	0	0	0	107.5	P120 I420 D421 D423 K428	P120-Y430 HydrophobicContact CB-CE1 4.03Å; I420-Y430 CarbonylContact C-O 3.54Å; I420-Y430 VanDerWaalsContact CA-O 3.29Å; I420-Y430 WeakPolarHBondContact CA-O 3.14Å; D421-Y430 HydrophobicContact CB-CD2 4.35Å; D421-Y430 PolarHBondContact N-O 3.27Å; D421-Y430 PolarHBondContact O-N 3.31Å; D423-Y430 HydrophobicContact CB-CE2 4.22Å; K428-Y430 HydrophobicContact CB-CE2 4.43Å
431	V	40	Very low	38.3	Very low	18 Å²	18	78.2 Å²	78.2	11%	0.109	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	123.8	-177.2	-175.4	0	0	0	0	108.6	F236 L248 T418 I419 I420	F236-V431 HydrophobicContact CE2-CG1 4.43Å; L248-V431 HydrophobicContact CD2-CG2 3.98Å; T418-V431 HydrophobicContact CG2-CG1 3.53Å; I419-V431 CarbonylContact O-C 3.38Å; I419-V431 VanDerWaalsContact O-CA 3.28Å; I419-V431 WeakPolarHBondContact O-CA 3.41Å; I420-V431 HydrophobicContact CG1-CG2 4.49Å
432	T	37.4	Very low	38.1	Very low	26 Å²	26	81.4 Å²	81.4	16%	0.16	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	116	175.7	-43.9	0	0	0	0	109.5	T418 I419 F434	T418-T432 CarbonylContact C-O 3.39Å; T418-T432 VanDerWaalsContact CA-O 3.24Å; T418-T432 WeakPolarHBondContact CA-O 3.27Å; I419-T432 PolarHBondContact N-O 3.24Å; I419-T432 PolarHBondContact O-N 3.08Å; T432-F434 HydrophobicContact CG2-CD2 4.14Å; T432-F434 HydrophobicContact CG2-CE1 3.99Å; T432-F434 HydrophobicContact CG2-CE2 3.29Å; T432-F434 HydrophobicContact CG2-CZ 3.22Å
433	Y	37.2	Very low	38	Very low	63 Å²	63	86.2 Å²	86.2	25%	0.247	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	124.3	179.9	178.1	-92.5	0	0	0	110.6	F236 Y246 Y416 H417 T418 P435	F236-Y433 AromaticContact CE1-CD2 3.73Å; F236-Y433 HydrophobicContact CE1-CD2 3.73Å; F236-Y433 AromaticContact CE1-CE2 3.78Å; F236-Y433 HydrophobicContact CE1-CE2 3.78Å; F236-Y433 AromaticContact CZ-CD2 3.59Å; F236-Y433 HydrophobicContact CZ-CD2 3.59Å; F236-Y433 HydrophobicContact CZ-CE2 4.13Å; F236-Y433 HydrophobicContact CZ-CG 4.17Å; Y246-Y433 HydrophobicContact CE1-CE1 4.45Å; Y246-Y433 HydrophobicContact CE1-CE2 4.48Å; Y246-Y433 HydrophobicContact CE2-CD1 4.1Å; Y246-Y433 HydrophobicContact CE2-CE1 4.5Å; Y246-Y433 HydrophobicContact CE2-CG 4.35Å; Y246-Y433 AromaticContact CZ-CD1 3.9Å; Y246-Y433 AromaticContact CZ-CE1 3.84Å; Y246-Y433 WeakPolarHBondContact OH-CE1 3.34Å; Y416-Y433 WeakPolarHBondContact CB-OH 3.48Å; Y416-Y433 HydrophobicContact CD2-CE2 4.19Å; Y416-Y433 HydrophobicContact CG-CE2 4.05Å; H417-Y433 CarbonylContact O-C 3.49Å; T418-Y433 WeakPolarHBondContact OG1-CD2 3.47Å; Y433-P435 HydrophobicContact CD1-CG 4.45Å; Y433-P435 HydrophobicContact CE1-CB 3.82Å; Y433-P435 HydrophobicContact CE1-CG 3.95Å
434	F	35.9	Very low	37.7	Very low	70 Å²	70	90.6 Å²	90.6	31%	0.307	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	106.8	176.3	-55.6	-87.1	0	0	0	109	Y416 H417 I419 T432 Y436	Y416-F434 CarbonylContact C-O 3.58Å; Y416-F434 WeakPolarHBondContact CA-O 3.34Å; H417-F434 HydrophobicContact CB-CB 4.21Å; H417-F434 HydrophobicContact CB-CD2 4.5Å; H417-F434 PolarHBondContact N-O 3.23Å; H417-F434 AromaticContact ND1-CD2 3.85Å; H417-F434 PolarHBondContact O-N 3.18Å; I419-F434 HydrophobicContact CD1-CD2 4.42Å; I419-F434 HydrophobicContact CD1-CE2 3.6Å; I419-F434 HydrophobicContact CD1-CZ 4.39Å; I419-F434 HydrophobicContact CG1-CD2 4.33Å; I419-F434 HydrophobicContact CG1-CE2 3.85Å; T432-F434 HydrophobicContact CG2-CD2 4.14Å; T432-F434 HydrophobicContact CG2-CE1 3.99Å; T432-F434 HydrophobicContact CG2-CE2 3.29Å; T432-F434 HydrophobicContact CG2-CZ 3.22Å; F434-Y436 HydrophobicContact CB-CE2 3.63Å; F434-Y436 VanDerWaalsContact O-CD2 3.26Å; F434-Y436 WeakPolarHBondContact O-CD2 3.45Å; F434-Y436 WeakPolarHBondContact O-CE2 3.45Å
435	P	32.8	Very low	37.5	Very low	94 Å²	94	86.4 Å²	86.4	61%	0.61	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	138.8	167.6	27.6	-27.5	0	0	0	110.3	Y433	Y433-P435 HydrophobicContact CD1-CG 4.45Å; Y433-P435 HydrophobicContact CE1-CB 3.82Å; Y433-P435 HydrophobicContact CE1-CG 3.95Å
436	Y	32.8	Very low	37.5	Very low	181 Å²	181	74.5 Å²	74.5	71%	0.71	35%	0.348	S	S	*	.			trans	-121.7	0	174.7	-59.9	-100	0	0	0	111.9	K415 H417 F434	K415-Y436 PolarHBondContact N-O 3.45Å; K415-Y436 VanDerWaalsContact N-O 3.16Å; K415-Y436 PolarHBondContact O-N 3.3Å; K415-Y436 VanDerWaalsContact O-O 3.1Å; H417-Y436 HydrophobicContact CB-CD2 4.15Å; H417-Y436 HydrophobicContact CB-CE2 3.21Å; H417-Y436 PolarHBondContact ND1-OH 3.46Å; H417-Y436 VanDerWaalsContact ND1-OH 3.1Å; F434-Y436 HydrophobicContact CB-CE2 3.63Å; F434-Y436 VanDerWaalsContact O-CD2 3.26Å; F434-Y436 WeakPolarHBondContact O-CD2 3.45Å; F434-Y436 WeakPolarHBondContact O-CE2 3.45Å

Retrieved 436 of 436 residues in 309.4 ms (Link to these results)

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