A0A087YEN6_POEFO Loading...

Small ribosomal subunit protein mS40

AlphaFold DB , UniProt , Accession A0A087YEN6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 280 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.4	Very low	41.9	Very low	239 Å²	239	148.7 Å²	148.7	100%	1.177	85%	0.854	S	S	*	*				0	118.7	0	-78	-172.2	166.3	0	0	107.5
2	L	43.2	Very low	41.9	Very low	174 Å²	174	151.8 Å²	151.8	91%	0.911	85%	0.85	S	S	*	*			trans	-70	124.9	-178.8	-74.1	155.3	0	0	0	109.6
3	L	39.1	Very low	41.7	Very low	160 Å²	160	149.8 Å²	149.8	84%	0.838	85%	0.847	S	S	*	*			trans	-130.1	90	167.8	-78	171.1	0	0	0	109.6	V5	L3-V5 PolarHBondContact O-N 3.31Å
4	T	42.2	Very low	41.9	Very low	134 Å²	134	149.1 Å²	149.1	82%	0.822	85%	0.848	S	S	*	*			trans	-58.8	117.4	158.2	27.8	0	0	0	0	109.8	C6	T4-C6 PolarHBondContact O-N 3.26Å
5	V	40.2	Very low	41.6	Very low	131 Å²	131	155.1 Å²	155.1	79%	0.794	85%	0.852	S	S	*	*			trans	-85.8	96.8	171.3	-177.1	0	0	0	0	108.6	L3 C7	L3-V5 PolarHBondContact O-N 3.31Å; V5-C7 PolarHBondContact O-N 3.3Å; V5-C7 VanDerWaalsContact O-N 3.14Å
6	C	39	Very low	41.4	Very low	117 Å²	117	154.8 Å²	154.8	79%	0.791	85%	0.846	S	S	*	*			trans	-70.1	101.2	165	-86.2	0	0	0	0	109.4	T4 Q8	T4-C6 PolarHBondContact O-N 3.26Å; C6-Q8 PolarHBondContact O-N 3.2Å; C6-Q8 VanDerWaalsContact O-N 3.1Å
7	C	38.3	Very low	41.2	Very low	121 Å²	121	159.4 Å²	159.4	82%	0.818	85%	0.848	S	S	*	*			trans	-67.1	102.7	164.6	-95.1	0	0	0	0	109.7	V5	V5-C7 PolarHBondContact O-N 3.3Å; V5-C7 VanDerWaalsContact O-N 3.14Å
8	Q	40.3	Very low	41	Very low	182 Å²	182	163.1 Å²	163.1	85%	0.85	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-66.3	134.7	165.4	-84.3	171	-35.8	0	0	110.2	C6	C6-Q8 PolarHBondContact O-N 3.2Å; C6-Q8 VanDerWaalsContact O-N 3.1Å
9	P	45.9	Very low	40.9	Very low	110 Å²	110	162.7 Å²	162.7	71%	0.714	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-71.5	154.5	178.2	29.3	-33.8	0	0	0	111.6	V11	P9-V11 PolarHBondContact O-N 3.49Å
10	P	43	Very low	40.7	Very low	123 Å²	123	166.2 Å²	166.2	80%	0.799	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-64.1	136	-175.7	25.3	-33.7	0	0	0	112.4	K12	P10-K12 PolarHBondContact O-N 3.11Å
11	V	50.1	Low	40.7	Very low	145 Å²	145	169.5 Å²	169.5	88%	0.879	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-62.2	121	175.5	-167.7	0	0	0	0	109.1	P9	P9-V11 PolarHBondContact O-N 3.49Å
12	K	41.9	Very low	40.5	Very low	185 Å²	185	169.6 Å²	169.6	80%	0.804	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-67.8	138.2	-178.1	-66.3	177.7	-178.5	174.9	0	110.7	P10	P10-K12 PolarHBondContact O-N 3.11Å
13	P	39.9	Very low	40.5	Very low	126 Å²	126	172.8 Å²	172.8	82%	0.818	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-66.5	140.2	174.9	26	-31.9	0	0	0	111.3	R15	P13-R15 PolarHBondContact O-N 3.46Å
14	T	44.1	Very low	40.4	Very low	140 Å²	140	176.5 Å²	176.5	86%	0.859	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-59.4	126	176.4	28	0	0	0	0	111.2	I16	T14-I16 PolarHBondContact O-N 3.15Å; T14-I16 VanDerWaalsContact O-N 3.1Å
15	R	37.4	Very low	40.2	Very low	240 Å²	240	181.6 Å²	181.6	91%	0.906	84%	0.844	S	S	*	*			trans	-78.6	93.1	-172.5	-154.1	-179.4	-165.3	-173.1	5.8	110.2	P13 R17	P13-R15 PolarHBondContact O-N 3.46Å; R15-R17 PolarHBondContact O-N 3.18Å; R15-R17 VanDerWaalsContact O-N 3.12Å
16	I	38.8	Very low	40.1	Very low	149 Å²	149	186.8 Å²	186.8	76%	0.764	85%	0.849	S	S	*	*			trans	-59.8	114.6	164.7	-64.3	173.3	0	0	0	107.9	T14 R18	T14-I16 PolarHBondContact O-N 3.15Å; T14-I16 VanDerWaalsContact O-N 3.1Å; I16-R18 VanDerWaalsContact C-N 3.32Å; I16-R18 PolarHBondContact O-N 3.29Å
17	R	37.3	Very low	40.1	Very low	233 Å²	233	192.3 Å²	192.3	88%	0.879	85%	0.854	S	S	*	*			trans	-69.7	85.7	173.9	-83.8	-176.8	168.4	180	-1.8	109.7	R15 I19	R15-R17 PolarHBondContact O-N 3.18Å; R15-R17 VanDerWaalsContact O-N 3.12Å; R17-I19 PolarHBondContact O-N 3.35Å
18	R	37.6	Very low	40	Very low	226 Å²	226	192.5 Å²	192.5	85%	0.853	85%	0.853	S	S	*	*			trans	-70.5	111.6	159.5	-85.7	-176	174	178.7	-1.4	108.7	I16 R20	I16-R18 VanDerWaalsContact C-N 3.32Å; I16-R18 PolarHBondContact O-N 3.29Å; R18-R20 PolarHBondContact O-N 3.46Å
19	I	40.2	Very low	39.7	Very low	157 Å²	157	193.3 Å²	193.3	81%	0.805	85%	0.854	S	S	*	*			trans	-61.9	97.9	168.9	-63.6	171.3	0	0	0	107.9	R17 R21	R17-I19 PolarHBondContact O-N 3.35Å; I19-R21 PolarHBondContact O-N 3.26Å
20	R	36.2	Very low	39.4	Very low	231 Å²	231	193.9 Å²	193.9	87%	0.872	86%	0.856	S	S	*	*			trans	-76.5	100.7	167.5	-89.1	-178.9	166.4	168	-3.8	108.3	R18 R22	R18-R20 PolarHBondContact O-N 3.46Å; R20-R22 PolarHBondContact O-N 3.24Å
21	R	39.6	Very low	39.2	Very low	237 Å²	237	193.6 Å²	193.6	89%	0.894	85%	0.854	S	S	*	*			trans	-59.8	106.7	159.8	-76.5	-178	174	174.4	-1.8	107.9	I19 R23	I19-R21 PolarHBondContact O-N 3.26Å; R21-R23 PolarHBondContact O-N 3.28Å
22	R	35.7	Very low	38.6	Very low	240 Å²	240	192.6 Å²	192.6	91%	0.906	85%	0.852	S	S	*	*			trans	-64.5	95.6	169.2	-89.6	-179.8	168.7	174.1	-3.9	108.4	R20 R24	R20-R22 PolarHBondContact O-N 3.24Å; R22-R24 PolarHBondContact O-N 3.35Å
23	R	43.1	Very low	38.6	Very low	241 Å²	241	191.6 Å²	191.6	91%	0.909	85%	0.85	S	S	*	*			trans	-66.4	107.3	155.1	-89.1	-177	172.9	174.4	-2.1	106.6	R21 R25	R21-R23 PolarHBondContact O-N 3.28Å; R23-R25 PolarHBondContact O-N 3.35Å
24	R	37.9	Very low	38.3	Very low	238 Å²	238	193.6 Å²	193.6	90%	0.898	85%	0.854	S	S	*	*			trans	-57.3	106.5	166	-81	179.2	171.4	171.9	-3.1	107.3	R22 R26	R22-R24 PolarHBondContact O-N 3.35Å; R24-R26 PolarHBondContact O-N 2.97Å; R24-R26 VanDerWaalsContact O-N 3.09Å
25	R	37.5	Very low	38.2	Very low	242 Å²	242	195 Å²	195	91%	0.913	85%	0.848	S	S	*	*			trans	-63.8	106.8	160.5	-79.1	-174.7	174.1	-176	-2.4	106.2	R23 R27	R23-R25 PolarHBondContact O-N 3.35Å; R25-R27 PolarHBondContact O-N 3.11Å
26	R	38.8	Very low	38.5	Very low	239 Å²	239	192.6 Å²	192.6	90%	0.902	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-62.2	126.9	165.2	-70.3	-176.9	175.6	-168.9	-1.4	106.4	R24	R24-R26 PolarHBondContact O-N 2.97Å; R24-R26 VanDerWaalsContact O-N 3.09Å
27	R	37.6	Very low	38.3	Very low	234 Å²	234	190.6 Å²	190.6	88%	0.883	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-62.7	140.2	165.1	-67	-177.4	178	-163.1	-1.5	107.4	R25 F29	R25-R27 PolarHBondContact O-N 3.11Å; R27-F29 PolarHBondContact O-N 3.05Å
28	P	37.7	Very low	38.3	Very low	124 Å²	124	184 Å²	184	81%	0.805	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-62.9	128.7	171.4	25.2	-29.6	0	0	0	108.7	T30	P28-T30 PolarHBondContact O-N 3.13Å
29	F	34.3	Very low	38.6	Very low	199 Å²	199	183.6 Å²	183.6	87%	0.873	85%	0.851	S	S	*	*			trans	-74.5	115.3	171.4	-154	-96.4	0	0	0	106	R27 P31	R27-F29 PolarHBondContact O-N 3.05Å; F29-P31 WeakPolarHBondContact O-CD 3.07Å
30	T	39	Very low	38.6	Very low	123 Å²	123	180.5 Å²	180.5	76%	0.755	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-72.3	121.9	167.7	45.1	0	0	0	0	107.6	P28 C32	P28-T30 PolarHBondContact O-N 3.13Å; T30-C32 PolarHBondContact O-N 3.42Å
31	P	39.3	Very low	38.9	Very low	116 Å²	116	178 Å²	178	75%	0.753	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-68.4	123.2	170.4	-9.9	26.1	0	0	0	108	F29	F29-P31 WeakPolarHBondContact O-CD 3.07Å
32	C	36.4	Very low	38.9	Very low	125 Å²	125	173.1 Å²	173.1	85%	0.845	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-73.4	123.2	161.4	-135.4	0	0	0	0	105.9	T30 D34	T30-C32 PolarHBondContact O-N 3.42Å; C32-D34 PolarHBondContact O-N 2.96Å
33	E	41.3	Very low	39	Very low	163 Å²	163	169.7 Å²	169.7	76%	0.762	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-59	123.4	179.3	-69.1	-175.8	150.9	0	0	110.9	K35	E33-K35 PolarHBondContact O-N 3.43Å
34	D	35.2	Very low	38.6	Very low	168 Å²	168	163 Å²	163	90%	0.898	82%	0.822	S	S	*	*			trans	-62.6	108.1	165	-71.6	-46	0	0	0	109.2	C32	C32-D34 PolarHBondContact O-N 2.96Å
35	K	42.3	Very low	38.5	Very low	170 Å²	170	160.4 Å²	160.4	74%	0.739	82%	0.817	S	S	*	*			trans	-114.6	134.8	154	-68.3	-174.1	-177.9	177	0	107.6	E33	E33-K35 PolarHBondContact O-N 3.43Å
36	M	43.1	Very low	38.6	Very low	190 Å²	190	156 Å²	156	94%	0.936	81%	0.81	S	S	*	*			trans	98.2	58.5	178.2	-48.8	-62	-176.5	0	0	116.2
37	A	33.6	Very low	38.3	Very low	107 Å²	107	153.9 Å²	153.9	88%	0.884	81%	0.808	S	S	*	*			trans	-116.9	83.3	149.5	0	0	0	0	0	109.1
38	A	39	Very low	38.2	Very low	95 Å²	95	147.3 Å²	147.3	79%	0.785	80%	0.798	S	S	*	*			trans	-175.1	78.5	159.5	0	0	0	0	0	111
39	Y	42.1	Very low	38	Very low	217 Å²	217	152 Å²	152	85%	0.851	80%	0.799	S	S	*	*	S	Bend	trans	-148	84.6	145.7	-159.7	-104.7	0	0	0	110.8
40	V	41.3	Very low	37.8	Very low	92 Å²	92	150 Å²	150	56%	0.558	79%	0.793	S	S	*	*			trans	60.3	100.6	137.3	-171.5	0	0	0	0	117.9	N42	V40-N42 HydrophobicContact CG1-CB 3.79Å; V40-N42 PolarHBondContact O-N 2.89Å
41	L	41.9	Very low	37.6	Very low	177 Å²	177	150.9 Å²	150.9	93%	0.927	79%	0.792	S	S	*	*			trans	-63.5	102.7	141.7	-72.6	166.8	0	0	0	109.1
42	N	39.2	Very low	37.5	Very low	136 Å²	136	153.4 Å²	153.4	73%	0.727	80%	0.798	S	S	*	*			trans	-167.8	107.1	155.3	-97.4	-27.3	0	0	0	103.2	V40	V40-N42 HydrophobicContact CG1-CB 3.79Å; V40-N42 PolarHBondContact O-N 2.89Å
43	I	39.3	Very low	37.3	Very low	167 Å²	167	152.8 Å²	152.8	86%	0.856	80%	0.795	S	S	*	*				-157.6	119.7	76.9	-77	150.5	0	0	0	106.5
44	S	34.4	Very low	37.1	Very low	101 Å²	101	149.1 Å²	149.1	71%	0.706	79%	0.792	S	S	*	*			trans	-120.3	135.9	155.1	67.8	0	0	0	0	107.6
45	K	35.7	Very low	37	Very low	184 Å²	184	146.3 Å²	146.3	80%	0.8	79%	0.786	S	S	*	*			trans	83.9	98.4	173.1	-53.4	172.3	-178.9	172.5	0	115.6
46	I	40.1	Very low	36.7	Very low	150 Å²	150	146.9 Å²	146.9	77%	0.769	79%	0.788	S	S	*	*			trans	-179.6	91.7	133.1	-74.7	137.5	0	0	0	102.2
47	F	32.1	Very low	36.3	Very low	194 Å²	194	146 Å²	146	85%	0.851	78%	0.782	S	S	*	*				-157.8	129.5	82.2	-101.6	-88.2	0	0	0	110.2
48	S	35.8	Very low	36.3	Very low	96 Å²	96	149.6 Å²	149.6	67%	0.671	78%	0.778	S	S	*	*			trans	-60.6	149.3	163.3	42.8	0	0	0	0	113.1
49	R	33.3	Very low	36.1	Very low	221 Å²	221	152.4 Å²	152.4	83%	0.834	77%	0.774	S	S	*	*			trans	43.8	126.7	137.9	-67.1	173	91.5	-169.3	7	118.8
50	E	30.2	Very low	35.5	Very low	159 Å²	159	153.7 Å²	153.7	74%	0.743	78%	0.778	S	S	*	*			trans	166.1	92.4	130.4	-86.3	-63	134.5	0	0	105.3
51	L	34.8	Very low	35.1	Very low	140 Å²	140	159.7 Å²	159.7	73%	0.733	79%	0.792	S	S	*	*				47.6	103	98.8	-74.3	173.9	0	0	0	115.1
52	I	36.4	Very low	34.7	Very low	170 Å²	170	162.7 Å²	162.7	87%	0.872	79%	0.791	S	S	*	*			trans	-140	121.6	142.5	-61.3	-174.7	0	0	0	109.8
53	S	33.2	Very low	34.5	Very low	112 Å²	112	161.7 Å²	161.7	78%	0.783	79%	0.794	S	S	*	*			trans	-58.7	133.3	170.5	-53.3	0	0	0	0	112.6
54	A	36	Very low	34.5	Very low	86 Å²	86	158.6 Å²	158.6	71%	0.711	79%	0.786	S	S	*	*			trans	-141.3	90.1	157.5	0	0	0	0	0	109.1	F56	A54-F56 PolarHBondContact O-N 3.49Å
55	S	33	Very low	34.7	Very low	109 Å²	109	161.9 Å²	161.9	76%	0.762	80%	0.795	S	S	*	*			trans	-57.8	112.7	160.2	40	0	0	0	0	109.8
56	F	35.7	Very low	34.8	Very low	181 Å²	181	161.1 Å²	161.1	79%	0.794	80%	0.795	S	S	*	*			trans	-129.1	107	160.3	-97.1	-85	0	0	0	110.1	A54 F58	A54-F56 PolarHBondContact O-N 3.49Å; F56-F58 HydrophobicContact CD1-CE2 4.35Å
57	Q	35.8	Very low	34.5	Very low	171 Å²	171	165.6 Å²	165.6	80%	0.799	80%	0.802	S	S	*	*			trans	-65.7	127.3	167.3	-65.6	174.9	-27.9	0	0	109
58	F	34.1	Very low	34.7	Very low	184 Å²	184	164.3 Å²	164.3	81%	0.807	80%	0.803	S	S	*	*			trans	-137.8	99.9	149	-88.3	-74.8	0	0	0	110.4	F56	F56-F58 HydrophobicContact CD1-CE2 4.35Å
59	H	32.9	Very low	34.8	Very low	153 Å²	153	165.3 Å²	165.3	71%	0.708	81%	0.807	S	S	*	*			trans	21.9	105.2	143.4	-86.1	-80.5	0	0	0	118.5	Y61	H59-Y61 HydrophobicContact CB-CD2 4.42Å; H59-Y61 HydrophobicContact CB-CE2 4.38Å; H59-Y61 PolarHBondContact O-N 3.46Å
60	R	30.9	Very low	35	Very low	244 Å²	244	159.5 Å²	159.5	92%	0.921	81%	0.807	S	S	*	*			trans	-58.4	107.3	146.8	-75.4	176	165.6	174.7	-4.4	109.3	R62	R60-R62 PolarHBondContact O-N 2.79Å
61	Y	32.7	Very low	35.4	Very low	218 Å²	218	158.6 Å²	158.6	86%	0.855	81%	0.811	S	S	*	*			trans	-77.2	106.5	161.1	-91.9	-89	0	0	0	109.2	H59 S63	H59-Y61 HydrophobicContact CB-CD2 4.42Å; H59-Y61 HydrophobicContact CB-CE2 4.38Å; H59-Y61 PolarHBondContact O-N 3.46Å; Y61-S63 PolarHBondContact O-N 3.39Å
62	R	33.4	Very low	35.7	Very low	241 Å²	241	160.9 Å²	160.9	91%	0.909	82%	0.816	S	S	*	*			trans	-84	100.3	172.4	-162.8	-179.3	-170.3	-170.5	2.6	106.7	R60 C64	R60-R62 PolarHBondContact O-N 2.79Å; R62-C64 PolarHBondContact O-N 3.11Å; R62-C64 VanDerWaalsContact O-N 3.11Å
63	S	35.4	Very low	36	Very low	114 Å²	114	158.7 Å²	158.7	80%	0.797	81%	0.812	S	S	*	*			trans	-71.4	103.6	174.4	49.7	0	0	0	0	109.7	Y61 L65	Y61-S63 PolarHBondContact O-N 3.39Å; S63-L65 PolarHBondContact O-N 3.06Å
64	C	38.6	Very low	36.2	Very low	102 Å²	102	161.2 Å²	161.2	69%	0.689	82%	0.817	S	S	*	*			trans	-78.5	107.6	169.6	-166	0	0	0	0	108.2	R62 Q66	R62-C64 PolarHBondContact O-N 3.11Å; R62-C64 VanDerWaalsContact O-N 3.11Å; C64-Q66 PolarHBondContact O-N 2.83Å; C64-Q66 VanDerWaalsContact O-N 3.15Å
65	L	38.3	Very low	37.1	Very low	171 Å²	171	162.2 Å²	162.2	90%	0.895	82%	0.816	S	S	*	*			trans	-72.4	97.6	167.1	-75.5	168.4	0	0	0	108.4	S63	S63-L65 PolarHBondContact O-N 3.06Å
66	Q	37.8	Very low	37.4	Very low	168 Å²	168	165 Å²	165	79%	0.785	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-87.4	123.6	164.7	-70.4	-177.9	4.9	0	0	108.9	C64	C64-Q66 PolarHBondContact O-N 2.83Å; C64-Q66 VanDerWaalsContact O-N 3.15Å
67	R	33.5	Very low	37.5	Very low	244 Å²	244	161.4 Å²	161.4	92%	0.921	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-69.7	126.7	177.2	-65.9	176.2	-166.8	-158.6	1.1	109.2
68	L	37.6	Very low	37.9	Very low	166 Å²	166	157.6 Å²	157.6	87%	0.869	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-78.8	142	164.4	-68.5	170.1	0	0	0	109.5
69	P	37.8	Very low	38.3	Very low	118 Å²	118	156.6 Å²	156.6	77%	0.766	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-75	140.2	-179.3	28.8	-31.3	0	0	0	111.9	V71	P69-V71 PolarHBondContact O-N 2.94Å
70	A	37.6	Very low	38.6	Very low	99 Å²	99	157 Å²	157	82%	0.818	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-70.7	119.2	176.7	0	0	0	0	0	111.1
71	V	38.6	Very low	39	Very low	139 Å²	139	150.5 Å²	150.5	84%	0.842	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-84	118.9	167.7	178.5	0	0	0	0	107.9	P69	P69-V71 PolarHBondContact O-N 2.94Å
72	K	40.6	Very low	39.6	Very low	189 Å²	189	148.1 Å²	148.1	82%	0.822	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-81.6	136	171.1	-63.1	179.1	-179.1	178.7	0	109.2
73	P	41.3	Very low	40.7	Very low	124 Å²	124	144.4 Å²	144.4	81%	0.805	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-83.1	134.9	162	30.5	-27	0	0	0	110.2
74	N	38.8	Very low	40.7	Very low	164 Å²	164	148.8 Å²	148.8	88%	0.877	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-78.5	147	170.2	-111	1.6	0	0	0	110.3
75	P	53.5	Low	40.5	Very low	108 Å²	108	147.2 Å²	147.2	70%	0.701	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-102.1	131.8	-179.5	35.1	-25.6	0	0	0	111.1
76	L	39.8	Very low	41.2	Very low	168 Å²	168	145.4 Å²	145.4	88%	0.88	81%	0.811	S	S	*	*			trans	-154	120.7	153.1	-78.3	-173.7	0	0	0	111.5
77	S	38.8	Very low	41.7	Very low	104 Å²	104	142 Å²	142	73%	0.727	81%	0.806	S	S	*	*			trans	50.6	107.3	137.8	-44	0	0	0	0	118.9
78	A	42.8	Very low	42.6	Very low	92 Å²	92	135.4 Å²	135.4	76%	0.76	80%	0.803	S	S	*	*				73	128.3	72.4	0	0	0	0	0	115.1
79	L	44.1	Very low	43.2	Very low	162 Å²	162	130.4 Å²	130.4	85%	0.848	78%	0.781	S	S	*	*			trans	89.1	103.3	165.8	-57.2	163.8	0	0	0	117.1
80	L	37.6	Very low	43.6	Very low	162 Å²	162	129.1 Å²	129.1	85%	0.848	77%	0.774	S	S	*	*				-162.7	117.1	101.8	-156.2	71.6	0	0	0	111.1
81	T	40.8	Very low	43.5	Very low	107 Å²	107	134.7 Å²	134.7	66%	0.656	77%	0.773	S	S	*	*			trans	-69	126.9	165.6	-49.3	0	0	0	0	109.2
82	Q	45.5	Very low	44	Very low	168 Å²	168	134.6 Å²	134.6	79%	0.785	76%	0.764	S	S	*	*			trans	-144.2	117.2	137	-73.9	-155.4	12.4	0	0	109.9
83	Q	55.2	Low	44.5	Very low	164 Å²	164	132.1 Å²	132.1	77%	0.766	76%	0.755	S	S	*	*			trans	-61.3	137.2	167.5	-65.3	157.5	-42.2	0	0	109.4
84	F	34.8	Very low	45.1	Very low	205 Å²	205	133.4 Å²	133.4	90%	0.899	75%	0.748	S	S	*	*			trans	-163.5	135.3	137.2	-87.8	-66	0	0	0	109.5
85	G	36.4	Very low	45.9	Very low	70 Å²	70	131.8 Å²	131.8	72%	0.722	74%	0.736	S	S	*	*			trans	106.9	80.8	154.2	0	0	0	0	0	116.6	S87	G85-S87 PolarHBondContact O-N 2.87Å
86	S	53	Low	46	Very low	132 Å²	132	130.2 Å²	130.2	92%	0.923	72%	0.724	S	S	*	*			trans	-48	120.9	156.6	-57.4	0	0	0	0	111.7
87	S	47.8	Very low	46.8	Very low	98 Å²	98	127.8 Å²	127.8	69%	0.685	71%	0.708	S	S	*	*			trans	-150.1	77.3	150.9	53.6	0	0	0	0	109.5	G85 P89	G85-S87 PolarHBondContact O-N 2.87Å; S87-P89 WeakPolarHBondContact O-CD 3.47Å
88	A	52.3	Low	47.5	Very low	105 Å²	105	125.2 Å²	125.2	87%	0.868	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	96	155.7	0	0	0	0	0	107
89	P	50.8	Low	48.1	Very low	61 Å²	61	126.2 Å²	126.2	40%	0.396	69%	0.685	S	S	.	*	T	Hydrogen-bonded Turn		-137.7	28	120.4	38.7	-25.8	0	0	0	112.9	S87 W91 Q92 E93	S87-P89 WeakPolarHBondContact O-CD 3.47Å; P89-W91 VanDerWaalsContact C-N 3.32Å; P89-W91 PolarHBondContact O-N 3.22Å; P89-Q92 PolarHBondContact O-N 3.3Å; P89-E93 PolarHBondContact O-N 2.97Å
90	C	45.4	Very low	48.7	Very low	91 Å²	91	124.2 Å²	124.2	62%	0.615	67%	0.671	S	S	*	*	H	α-helix	trans	-66	-28.8	-172.8	-168.7	0	0	0	0	114.2	F94	C90-F94 PolarHBondContact O-N 2.97Å
91	W	36.1	Very low	49.4	Very low	215 Å²	215	119.1 Å²	119.1	81%	0.814	65%	0.647	S	S	*	*	H	α-helix	trans	-80.5	-33.7	179.9	-62.2	104	0	0	0	113.4	P89 E95	P89-W91 VanDerWaalsContact C-N 3.32Å; P89-W91 PolarHBondContact O-N 3.22Å; W91-E95 WeakPolarHBondContact O-CB 3.31Å; W91-E95 PolarHBondContact O-N 3.16Å
92	Q	48.4	Very low	50.3	Low	138 Å²	138	116.8 Å²	116.8	65%	0.645	64%	0.639	S	S	*	*	H	α-helix	trans	-72.2	-37.2	177.6	-90.4	121.6	-8.8	0	0	112	P89 V96	P89-Q92 PolarHBondContact O-N 3.3Å; Q92-V96 WeakPolarHBondContact O-CB 3.48Å; Q92-V96 WeakPolarHBondContact O-CG2 3.43Å; Q92-V96 PolarHBondContact O-N 3.23Å; Q92-V96 VanDerWaalsContact O-N 3.09Å
93	E	51.5	Low	51.4	Low	137 Å²	137	112.7 Å²	112.7	64%	0.64	62%	0.622	S	S	*	*	H	α-helix	trans	-68.1	-37.8	176.3	-69.6	-172.1	164.7	0	0	112.4	P89 H97	P89-E93 PolarHBondContact O-N 2.97Å; E93-H97 WeakPolarHBondContact O-CB 3.46Å; E93-H97 PolarHBondContact O-N 2.89Å
94	F	53.7	Low	52.8	Low	150 Å²	150	110.6 Å²	110.6	66%	0.658	61%	0.607	S	S	*	*	H	α-helix	trans	-66.2	-40.1	177.7	-174.1	-100.5	0	0	0	112.7	C90 A98	C90-F94 PolarHBondContact O-N 2.97Å; F94-A98 VanDerWaalsContact O-CB 3.25Å; F94-A98 WeakPolarHBondContact O-CB 3.44Å; F94-A98 PolarHBondContact O-N 3.27Å
95	E	55.7	Low	55.3	Low	131 Å²	131	101.9 Å²	101.9	61%	0.612	57%	0.568	S	S	*	*	H	α-helix	trans	-73.9	-37.9	-178.8	-153.9	167.4	-151.3	0	0	111.9	W91 A98 L99	W91-E95 WeakPolarHBondContact O-CB 3.31Å; W91-E95 PolarHBondContact O-N 3.16Å; E95-A98 PolarHBondContact O-N 3.36Å; E95-L99 WeakPolarHBondContact O-CB 3.33Å; E95-L99 PolarHBondContact O-N 2.92Å
96	V	56	Low	57.8	Low	75 Å²	75	103.6 Å²	103.6	46%	0.455	56%	0.556	S	S	.	*	H	α-helix	trans	-68.2	-40.6	173.9	-179.8	0	0	0	0	110.7	Q92 L99 Q100	Q92-V96 WeakPolarHBondContact O-CB 3.48Å; Q92-V96 WeakPolarHBondContact O-CG2 3.43Å; Q92-V96 PolarHBondContact O-N 3.23Å; Q92-V96 VanDerWaalsContact O-N 3.09Å; V96-L99 PolarHBondContact O-N 2.96Å; V96-Q100 HydrophobicContact CG1-CG 4.48Å; V96-Q100 VanDerWaalsContact O-CB 3.31Å; V96-Q100 WeakPolarHBondContact O-CB 3.39Å; V96-Q100 WeakPolarHBondContact O-CG 3.46Å; V96-Q100 PolarHBondContact O-N 3.02Å
97	H	56.5	Low	59.4	Low	116 Å²	116	105.2 Å²	105.2	54%	0.537	55%	0.549	S	S	.	.	H	α-helix	trans	-67.8	-36.5	175.5	-166.6	-90.7	0	0	0	112.2	E93 T101	E93-H97 WeakPolarHBondContact O-CB 3.46Å; E93-H97 PolarHBondContact O-N 2.89Å; H97-T101 VanDerWaalsContact O-CB 3.32Å; H97-T101 WeakPolarHBondContact O-CB 3.39Å; H97-T101 PolarHBondContact O-N 2.94Å; H97-T101 PolarHBondContact O-OG1 3.16Å
98	A	52.6	Low	61.5	Low	51 Å²	51	103.3 Å²	103.3	42%	0.421	53%	0.533	S	S	.	.	H	α-helix	trans	-67.8	-40.1	175.1	0	0	0	0	0	112.6	F94 E95 T101 A102	F94-A98 VanDerWaalsContact O-CB 3.25Å; F94-A98 WeakPolarHBondContact O-CB 3.44Å; F94-A98 PolarHBondContact O-N 3.27Å; E95-A98 PolarHBondContact O-N 3.36Å; A98-T101 PolarHBondContact O-N 3.12Å; A98-A102 PolarHBondContact O-N 3.3Å; A98-A102 VanDerWaalsContact O-N 3.11Å
99	L	55.1	Low	63.5	Low	112 Å²	112	98.4 Å²	98.4	59%	0.586	49%	0.493	S	S	*	.	H	α-helix	trans	-67.9	-43	173.8	-80.9	164.4	0	0	0	112	E95 V96 T101 A102 D103	E95-L99 WeakPolarHBondContact O-CB 3.33Å; E95-L99 PolarHBondContact O-N 2.92Å; V96-L99 PolarHBondContact O-N 2.96Å; L99-T101 VanDerWaalsContact C-N 3.26Å; L99-T101 PolarHBondContact O-N 3.17Å; L99-A102 PolarHBondContact O-N 3.38Å; L99-D103 PolarHBondContact O-N 2.88Å; L99-D103 VanDerWaalsContact O-N 3.14Å
100	Q	56.7	Low	65.5	Low	121 Å²	121	100 Å²	100	57%	0.565	49%	0.491	S	S	*	.	H	α-helix	trans	-61.8	-34.2	173.4	-76.5	172.1	-3.6	0	0	112.1	V96 D103 R104	V96-Q100 HydrophobicContact CG1-CG 4.48Å; V96-Q100 VanDerWaalsContact O-CB 3.31Å; V96-Q100 WeakPolarHBondContact O-CB 3.39Å; V96-Q100 WeakPolarHBondContact O-CG 3.46Å; V96-Q100 PolarHBondContact O-N 3.02Å; Q100-D103 PolarHBondContact O-N 3.09Å; Q100-R104 PolarHBondContact O-N 3.36Å; Q100-R104 VanDerWaalsContact O-N 3.15Å
101	T	54.2	Low	67.8	Low	55 Å²	55	98.8 Å²	98.8	34%	0.337	48%	0.481	S	S	.	.	H	α-helix	trans	-68.4	-38.5	175.6	-58.7	0	0	0	0	111.8	H97 A98 L99 D103	H97-T101 VanDerWaalsContact O-CB 3.32Å; H97-T101 WeakPolarHBondContact O-CB 3.39Å; H97-T101 PolarHBondContact O-N 2.94Å; H97-T101 PolarHBondContact O-OG1 3.16Å; A98-T101 PolarHBondContact O-N 3.12Å; L99-T101 VanDerWaalsContact C-N 3.26Å; L99-T101 PolarHBondContact O-N 3.17Å; T101-D103 VanDerWaalsContact C-N 3.28Å; T101-D103 PolarHBondContact O-N 3.34Å
102	A	59	Low	70.6	Confident	58 Å²	58	89 Å²	89	48%	0.479	44%	0.443	S	S	.	.	H	α-helix	trans	-71.5	-20.5	176.1	0	0	0	0	0	113.7	A98 L99 K106	A98-A102 PolarHBondContact O-N 3.3Å; A98-A102 VanDerWaalsContact O-N 3.11Å; L99-A102 PolarHBondContact O-N 3.38Å; A102-K106 WeakPolarHBondContact O-CE 3.44Å
103	D	68.8	Low	72.8	Confident	81 Å²	81	83.1 Å²	83.1	43%	0.433	42%	0.416	S	S	.	.	H	α-helix	trans	-94.4	-13	178.7	-90.5	-34.5	0	0	0	114.6	L99 Q100 T101 Y105 K106	L99-D103 PolarHBondContact O-N 2.88Å; L99-D103 VanDerWaalsContact O-N 3.14Å; Q100-D103 PolarHBondContact O-N 3.09Å; T101-D103 VanDerWaalsContact C-N 3.28Å; T101-D103 PolarHBondContact O-N 3.34Å; D103-Y105 PolarHBondContact O-N 3.43Å; D103-K106 PolarHBondContact O-N 3.47Å; D103-K106 WeakPolarHBondContact OD1-CD 3.39Å; D103-K106 WeakPolarHBondContact OD1-CE 3.4Å; D103-K106 IonicContact OD1-NZ 2.81Å; D103-K106 PolarHBondContact OD1-NZ 3.33Å
104	R	83.9	Confident	74.9	Confident	121 Å²	121	81.3 Å²	81.3	46%	0.457	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	-40.4	-170.1	-170.5	-176.1	-66.5	163.5	-0.3	114.1	Q100 E117	Q100-R104 PolarHBondContact O-N 3.36Å; Q100-R104 VanDerWaalsContact O-N 3.15Å; R104-E117 IonicContact NH1-OE1 3.83Å; R104-E117 PolarHBondContact NH1-OE1 3.19Å
105	Y	87.6	Confident	76.8	Confident	21 Å²	21	75.1 Å²	75.1	8%	0.082	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	8.2	-174.9	-52.8	-66.2	0	0	0	114.5	D103 T108 P109 V111 Y112 E117 N166	D103-Y105 PolarHBondContact O-N 3.43Å; Y105-T108 CarbonylContact O-C 3.59Å; Y105-P109 WeakPolarHBondContact O-CA 3.3Å; Y105-P109 WeakPolarHBondContact O-CB 3.49Å; Y105-V111 HydrophobicContact CD1-CB 4.45Å; Y105-V111 HydrophobicContact CE1-CG1 4.31Å; Y105-Y112 AromaticContact CD2-CD2 3.78Å; Y105-Y112 HydrophobicContact CD2-CD2 3.78Å; Y105-Y112 HydrophobicContact CD2-CG 4.19Å; Y105-Y112 HydrophobicContact CE1-CD2 4.37Å; Y105-Y112 AromaticContact CE2-CD2 3.49Å; Y105-Y112 HydrophobicContact CE2-CD2 3.49Å; Y105-Y112 VanDerWaalsContact CE2-CD2 3.49Å; Y105-Y112 HydrophobicContact CE2-CE2 4.21Å; Y105-Y112 HydrophobicContact CE2-CG 4.31Å; Y105-Y112 HydrophobicContact CG-CD2 4.33Å; Y105-Y112 HydrophobicContact CG-CG 4.37Å; Y105-Y112 AromaticContact CZ-CD2 3.81Å; Y105-E117 PolarHBondContact OH-OE2 3.02Å; Y105-E117 VanDerWaalsContact OH-OE2 3.14Å; Y105-N166 HydrophobicContact CD2-CB 4.17Å
106	K	88.1	Confident	78.7	Confident	106 Å²	106	76 Å²	76	46%	0.461	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-39.1	-176.9	-72.3	-164.4	-161.1	154.5	0	113.4	A102 D103 I168	A102-K106 WeakPolarHBondContact O-CE 3.44Å; D103-K106 PolarHBondContact O-N 3.47Å; D103-K106 WeakPolarHBondContact OD1-CD 3.39Å; D103-K106 WeakPolarHBondContact OD1-CE 3.4Å; D103-K106 IonicContact OD1-NZ 2.81Å; D103-K106 PolarHBondContact OD1-NZ 3.33Å; K106-I168 HydrophobicContact CB-CD1 4.31Å; K106-I168 HydrophobicContact CG-CD1 3.99Å
107	Q	87.9	Confident	80.5	Confident	166 Å²	166	75.8 Å²	75.8	78%	0.776	39%	0.385	S	S	*	.	S	Bend	trans	-84.2	-36.3	-178.3	-58.2	-59.7	-13.3	0	0	112.3	P109	Q107-P109 VanDerWaalsContact O-CD 3.29Å; Q107-P109 WeakPolarHBondContact O-CD 3.24Å
108	T	91.6	Very high	82.4	Confident	58 Å²	58	71 Å²	71	36%	0.356	36%	0.362	S	S	.	.			trans	-124.6	65.7	-176.9	50.6	0	0	0	0	110.9	Y105 W110 V111	Y105-T108 CarbonylContact O-C 3.59Å; T108-W110 HydrophobicContact CG2-CH2 4.28Å; T108-W110 HydrophobicContact CG2-CZ2 3.75Å; T108-W110 PolarHBondContact O-N 2.56Å; T108-V111 WeakPolarHBondContact O-CB 3.38Å; T108-V111 PolarHBondContact O-N 3.26Å; T108-V111 VanDerWaalsContact O-N 3.11Å
109	P	93.2	Very high	84.4	Confident	3 Å²	3	72.6 Å²	72.6	2%	0.019	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-19.5	-172.6	33.7	-45.7	0	0	0	114.1	Y105 Q107 V111 Y112 I168 N170 N173	Y105-P109 WeakPolarHBondContact O-CA 3.3Å; Y105-P109 WeakPolarHBondContact O-CB 3.49Å; Q107-P109 VanDerWaalsContact O-CD 3.29Å; Q107-P109 WeakPolarHBondContact O-CD 3.24Å; P109-V111 VanDerWaalsContact C-N 3.26Å; P109-V111 PolarHBondContact O-N 3.02Å; P109-Y112 PolarHBondContact O-N 3.22Å; P109-I168 HydrophobicContact CB-CB 3.94Å; P109-N170 HydrophobicContact CG-CB 4.02Å; P109-N170 WeakPolarHBondContact CG-ND2 3.48Å; P109-N173 VanDerWaalsContact CB-ND2 3.3Å; P109-N173 WeakPolarHBondContact CB-ND2 3.46Å; P109-N173 VanDerWaalsContact CG-ND2 3.32Å; P109-N173 WeakPolarHBondContact CG-ND2 3.24Å; P109-N173 WeakPolarHBondContact CG-OD1 3.4Å
110	W	93.4	Very high	86.3	Confident	94 Å²	94	75.2 Å²	75.2	36%	0.356	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-26.9	174.7	47	91.6	0	0	0	112.5	T108 Y112 L113 Q172 N173	T108-W110 HydrophobicContact CG2-CH2 4.28Å; T108-W110 HydrophobicContact CG2-CZ2 3.75Å; T108-W110 PolarHBondContact O-N 2.56Å; W110-Y112 PolarHBondContact O-N 2.81Å; W110-L113 PolarHBondContact O-N 3.47Å; W110-Q172 HydrophobicContact CE3-CB 3.85Å; W110-Q172 HydrophobicContact CZ3-CB 3.8Å; W110-Q172 HydrophobicContact CZ3-CG 4.44Å; W110-N173 VanDerWaalsContact CA-OD1 3.27Å; W110-N173 WeakPolarHBondContact CA-OD1 3.47Å; W110-N173 VanDerWaalsContact CB-OD1 3.24Å; W110-N173 WeakPolarHBondContact CB-OD1 3.28Å; W110-N173 PolarHBondContact N-OD1 2.91Å
111	V	94.8	Very high	88.2	Confident	66 Å²	66	76.3 Å²	76.3	40%	0.4	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-64.2	-32.8	179.9	178.5	0	0	0	0	111.3	Y105 T108 P109 L113 D114 S115	Y105-V111 HydrophobicContact CD1-CB 4.45Å; Y105-V111 HydrophobicContact CE1-CG1 4.31Å; T108-V111 WeakPolarHBondContact O-CB 3.38Å; T108-V111 PolarHBondContact O-N 3.26Å; T108-V111 VanDerWaalsContact O-N 3.11Å; P109-V111 VanDerWaalsContact C-N 3.26Å; P109-V111 PolarHBondContact O-N 3.02Å; V111-L113 VanDerWaalsContact C-N 3.28Å; V111-L113 PolarHBondContact O-N 3.28Å; V111-D114 PolarHBondContact O-N 2.89Å; V111-S115 PolarHBondContact O-N 3.34Å
112	Y	94.8	Very high	90.1	Very high	9 Å²	9	74.7 Å²	74.7	4%	0.035	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-63.7	-32	178.7	179.5	-114.7	0	0	0	113.1	Y105 P109 W110 D114 S115 E117 Y118 N166 I167	Y105-Y112 AromaticContact CD2-CD2 3.78Å; Y105-Y112 HydrophobicContact CD2-CD2 3.78Å; Y105-Y112 HydrophobicContact CD2-CG 4.19Å; Y105-Y112 HydrophobicContact CE1-CD2 4.37Å; Y105-Y112 AromaticContact CE2-CD2 3.49Å; Y105-Y112 HydrophobicContact CE2-CD2 3.49Å; Y105-Y112 VanDerWaalsContact CE2-CD2 3.49Å; Y105-Y112 HydrophobicContact CE2-CE2 4.21Å; Y105-Y112 HydrophobicContact CE2-CG 4.31Å; Y105-Y112 HydrophobicContact CG-CD2 4.33Å; Y105-Y112 HydrophobicContact CG-CG 4.37Å; Y105-Y112 AromaticContact CZ-CD2 3.81Å; P109-Y112 PolarHBondContact O-N 3.22Å; W110-Y112 PolarHBondContact O-N 2.81Å; Y112-D114 PolarHBondContact O-N 3.23Å; Y112-S115 PolarHBondContact O-N 3.24Å; Y112-S115 PolarHBondContact O-OG 3.13Å; Y112-E117 HydrophobicContact CE2-CB 4.33Å; Y112-Y118 HydrophobicContact CD1-CD2 4.37Å; Y112-Y118 AromaticContact CE1-CD2 3.9Å; Y112-Y118 HydrophobicContact CE1-CD2 3.9Å; Y112-Y118 WeakPolarHBondContact O-CB 3.14Å; Y112-N166 HydrophobicContact CD1-CB 3.78Å; Y112-N166 HydrophobicContact CD2-CB 3.83Å; Y112-N166 HydrophobicContact CE1-CB 3.63Å; Y112-N166 HydrophobicContact CE2-CB 3.7Å; Y112-N166 WeakPolarHBondContact CE2-ND2 3.27Å; Y112-N166 HydrophobicContact CG-CB 3.88Å; Y112-I167 HydrophobicContact CD1-CG1 4.28Å; Y112-I167 HydrophobicContact CE1-CG1 3.77Å
113	L	94.6	Very high	91.8	Very high	14 Å²	14	73.4 Å²	73.4	7%	0.073	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-72.7	-21.6	179.9	-67.4	161	0	0	0	112.6	W110 V111 Y118 K175 L176	W110-L113 PolarHBondContact O-N 3.47Å; V111-L113 VanDerWaalsContact C-N 3.28Å; V111-L113 PolarHBondContact O-N 3.28Å; L113-Y118 HydrophobicContact CD2-CD2 3.94Å; L113-Y118 HydrophobicContact CD2-CE1 4.25Å; L113-Y118 HydrophobicContact CD2-CE2 3.52Å; L113-Y118 HydrophobicContact CD2-CG 4.46Å; L113-Y118 WeakPolarHBondContact O-CD1 3.4Å; L113-K175 HydrophobicContact CD1-CB 3.87Å; L113-L176 HydrophobicContact CD1-CB 3.72Å; L113-L176 HydrophobicContact CD2-CD1 4.45Å
114	D	93.9	Very high	93	Very high	100 Å²	100	76.1 Å²	76.1	54%	0.535	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-96.2	-3.6	178.8	-67.2	-24	0	0	0	112.2	V111 Y112 K175	V111-D114 PolarHBondContact O-N 2.89Å; Y112-D114 PolarHBondContact O-N 3.23Å; D114-K175 IonicContact OD1-NZ 3.02Å; D114-K175 PolarHBondContact OD1-NZ 3.45Å; D114-K175 IonicContact OD2-NZ 3.22Å; D114-K175 PolarHBondContact OD2-NZ 2.96Å
115	S	95.1	Very high	93.5	Very high	19 Å²	19	73.9 Å²	73.9	13%	0.133	38%	0.383	C	S	.	.	S	Bend	trans	-77.9	151	178.4	76.2	0	0	0	0	111.8	V111 Y112 E117 Y118 V119	V111-S115 PolarHBondContact O-N 3.34Å; Y112-S115 PolarHBondContact O-N 3.24Å; Y112-S115 PolarHBondContact O-OG 3.13Å; S115-E117 PolarHBondContact O-N 3.39Å; S115-Y118 PolarHBondContact O-N 3.23Å; S115-V119 PolarHBondContact O-N 3.32Å
116	E	94.7	Very high	93.9	Very high	151 Å²	151	74.2 Å²	74.2	71%	0.706	39%	0.39	S	S	*	.	H	α-helix	trans	-57.6	-35.8	173.3	61.9	-168.6	-176.4	0	0	112.2	Y118 V119 E120	E116-Y118 PolarHBondContact O-N 3.17Å; E116-V119 PolarHBondContact O-N 3.36Å; E116-V119 VanDerWaalsContact O-N 3.11Å; E116-E120 WeakPolarHBondContact O-CG 3.12Å; E116-E120 PolarHBondContact O-N 2.47Å
117	E	94.3	Very high	94.3	Very high	70 Å²	70	69.2 Å²	69.2	33%	0.327	37%	0.369	S	S	.	.	H	α-helix	trans	-55.6	-38.8	177	-58	173.4	174.2	0	0	112.3	R104 Y105 Y112 S115 R121	R104-E117 IonicContact NH1-OE1 3.83Å; R104-E117 PolarHBondContact NH1-OE1 3.19Å; Y105-E117 PolarHBondContact OH-OE2 3.02Å; Y105-E117 VanDerWaalsContact OH-OE2 3.14Å; Y112-E117 HydrophobicContact CE2-CB 4.33Å; S115-E117 PolarHBondContact O-N 3.39Å; E117-R121 WeakPolarHBondContact O-CB 3.29Å; E117-R121 PolarHBondContact O-N 2.71Å
118	Y	95.5	Very high	94.7	Very high	14 Å²	14	63.8 Å²	63.8	6%	0.055	34%	0.341	C	S	.	.	H	α-helix	trans	-72.9	-43.6	178.5	177.6	-90	0	0	0	111.1	Y112 L113 S115 E116 E120 R121 Y122 V127 Q179	Y112-Y118 HydrophobicContact CD1-CD2 4.37Å; Y112-Y118 AromaticContact CE1-CD2 3.9Å; Y112-Y118 HydrophobicContact CE1-CD2 3.9Å; Y112-Y118 WeakPolarHBondContact O-CB 3.14Å; L113-Y118 HydrophobicContact CD2-CD2 3.94Å; L113-Y118 HydrophobicContact CD2-CE1 4.25Å; L113-Y118 HydrophobicContact CD2-CE2 3.52Å; L113-Y118 HydrophobicContact CD2-CG 4.46Å; L113-Y118 WeakPolarHBondContact O-CD1 3.4Å; S115-Y118 PolarHBondContact O-N 3.23Å; E116-Y118 PolarHBondContact O-N 3.17Å; Y118-E120 PolarHBondContact O-N 2.79Å; Y118-R121 PolarHBondContact O-N 3.35Å; Y118-Y122 AromaticContact CD2-CD2 3.51Å; Y118-Y122 HydrophobicContact CD2-CD2 3.51Å; Y118-Y122 HydrophobicContact CD2-CE2 4.01Å; Y118-Y122 HydrophobicContact CD2-CG 4.31Å; Y118-Y122 AromaticContact CE2-CD2 3.46Å; Y118-Y122 HydrophobicContact CE2-CD2 3.46Å; Y118-Y122 VanDerWaalsContact CE2-CD2 3.46Å; Y118-Y122 AromaticContact CE2-CE2 3.96Å; Y118-Y122 HydrophobicContact CE2-CE2 3.96Å; Y118-Y122 AromaticContact CE2-CG 3.88Å; Y118-Y122 HydrophobicContact CE2-CG 3.88Å; Y118-Y122 HydrophobicContact CG-CD2 4.19Å; Y118-Y122 WeakPolarHBondContact O-CB 3.45Å; Y118-Y122 PolarHBondContact O-N 3.14Å; Y118-V127 HydrophobicContact CE2-CG2 3.85Å; Y118-V127 WeakPolarHBondContact OH-CG2 2.96Å; Y118-Q179 PolarHBondContact OH-NE2 3.41Å
119	V	95.5	Very high	94.9	Very high	86 Å²	86	63.9 Å²	63.9	52%	0.521	35%	0.348	S	S	.	.	H	α-helix	trans	-64.1	-40.6	-180	-179.6	0	0	0	0	111.2	S115 E116 R121 G123	S115-V119 PolarHBondContact O-N 3.32Å; E116-V119 PolarHBondContact O-N 3.36Å; E116-V119 VanDerWaalsContact O-N 3.11Å; V119-R121 VanDerWaalsContact C-N 3.35Å; V119-R121 PolarHBondContact O-N 3.25Å; V119-G123 WeakPolarHBondContact O-CA 3.46Å; V119-G123 PolarHBondContact O-N 3.1Å
120	E	95.6	Very high	94.8	Very high	166 Å²	166	67.3 Å²	67.3	78%	0.776	38%	0.383	S	S	*	.	H	α-helix	trans	-64.6	-38.7	176	-70.9	-178.3	170.3	0	0	112.5	E116 Y118	E116-E120 WeakPolarHBondContact O-CG 3.12Å; E116-E120 PolarHBondContact O-N 2.47Å; Y118-E120 PolarHBondContact O-N 2.79Å
121	R	95	Very high	95	Very high	144 Å²	144	64.6 Å²	64.6	54%	0.543	37%	0.374	S	S	.	.	H	α-helix	trans	-80.2	-38.9	-175.4	-174.5	173.7	-175.4	87.4	-8	113.7	E117 Y118 V119 D164	E117-R121 WeakPolarHBondContact O-CB 3.29Å; E117-R121 PolarHBondContact O-N 2.71Å; Y118-R121 PolarHBondContact O-N 3.35Å; V119-R121 VanDerWaalsContact C-N 3.35Å; V119-R121 PolarHBondContact O-N 3.25Å; R121-D164 IonicContact CZ-OD1 3.35Å; R121-D164 IonicContact CZ-OD2 2.79Å; R121-D164 IonicContact NE-OD1 3.1Å; R121-D164 PolarHBondContact NE-OD1 3.27Å; R121-D164 IonicContact NE-OD2 2.71Å; R121-D164 PolarHBondContact NE-OD2 3.34Å; R121-D164 IonicContact NH2-OD1 3.38Å; R121-D164 PolarHBondContact NH2-OD1 3.24Å; R121-D164 IonicContact NH2-OD2 3.35Å
122	Y	95.6	Very high	95	Very high	21 Å²	21	71.6 Å²	71.6	8%	0.082	39%	0.393	C	S	.	.	H	α-helix	trans	-114	-26.6	-172.1	-69.8	-82.1	0	0	0	113.5	Y118 S125 V127 R163 D164 I167	Y118-Y122 AromaticContact CD2-CD2 3.51Å; Y118-Y122 HydrophobicContact CD2-CD2 3.51Å; Y118-Y122 HydrophobicContact CD2-CE2 4.01Å; Y118-Y122 HydrophobicContact CD2-CG 4.31Å; Y118-Y122 AromaticContact CE2-CD2 3.46Å; Y118-Y122 HydrophobicContact CE2-CD2 3.46Å; Y118-Y122 VanDerWaalsContact CE2-CD2 3.46Å; Y118-Y122 AromaticContact CE2-CE2 3.96Å; Y118-Y122 HydrophobicContact CE2-CE2 3.96Å; Y118-Y122 AromaticContact CE2-CG 3.88Å; Y118-Y122 HydrophobicContact CE2-CG 3.88Å; Y118-Y122 HydrophobicContact CG-CD2 4.19Å; Y118-Y122 WeakPolarHBondContact O-CB 3.45Å; Y118-Y122 PolarHBondContact O-N 3.14Å; Y122-S125 PolarHBondContact O-N 2.07Å; Y122-V127 HydrophobicContact CD1-CB 4.37Å; Y122-V127 HydrophobicContact CD1-CG2 4.16Å; Y122-V127 HydrophobicContact CE1-CB 3.94Å; Y122-V127 HydrophobicContact CE1-CG1 3.78Å; Y122-V127 HydrophobicContact CE1-CG2 3.93Å; Y122-R163 PolarHBondContact OH-NE 3.05Å; Y122-R163 VanDerWaalsContact OH-NE 3.12Å; Y122-R163 PolarHBondContact OH-NH2 3.16Å; Y122-D164 PolarHBondContact OH-OD2 3.49Å; Y122-I167 HydrophobicContact CE2-CD1 4.03Å; Y122-I167 WeakPolarHBondContact OH-CD1 3.36Å
123	G	93.6	Very high	95	Very high	32 Å²	32	74 Å²	74	33%	0.33	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	-136.9	-171.1	0	0	0	0	0	111.6	V119 S125	V119-G123 WeakPolarHBondContact O-CA 3.46Å; V119-G123 PolarHBondContact O-N 3.1Å; G123-S125 VanDerWaalsContact C-N 3.33Å
124	S	93.8	Very high	95.1	Very high	137 Å²	137	79.5 Å²	79.5	96%	0.958	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-2.8	177.8	-44.9	0	0	0	0	113.7
125	S	94.7	Very high	95.1	Very high	74 Å²	74	78.3 Å²	78.3	52%	0.517	42%	0.422	S	S	.	.	S	Bend	trans	-82.3	151.1	-176.9	-65.9	0	0	0	0	111.6	Y122 G123	Y122-S125 PolarHBondContact O-N 2.07Å; G123-S125 VanDerWaalsContact C-N 3.33Å
126	A	95.8	Very high	95.2	Very high	29 Å²	29	87.2 Å²	87.2	24%	0.24	46%	0.458	C	S	.	.			trans	-62	149	173.2	0	0	0	0	0	111.4	W128 A129 Q179	A126-W128 PolarHBondContact O-N 3.11Å; A126-A129 VanDerWaalsContact O-CB 3.31Å; A126-A129 WeakPolarHBondContact O-CB 3.28Å; A126-A129 PolarHBondContact O-N 2.9Å; A126-Q179 HydrophobicContact CB-CB 4.32Å
127	V	96.9	Very high	95.2	Very high	1 Å²	1	82.9 Å²	82.9	1%	0.006	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-33.4	-176.7	166.8	0	0	0	0	113.2	Y118 Y122 P160 I167 L176 Q179	Y118-V127 HydrophobicContact CE2-CG2 3.85Å; Y118-V127 WeakPolarHBondContact OH-CG2 2.96Å; Y122-V127 HydrophobicContact CD1-CB 4.37Å; Y122-V127 HydrophobicContact CD1-CG2 4.16Å; Y122-V127 HydrophobicContact CE1-CB 3.94Å; Y122-V127 HydrophobicContact CE1-CG1 3.78Å; Y122-V127 HydrophobicContact CE1-CG2 3.93Å; V127-P160 HydrophobicContact CG1-CB 3.84Å; V127-I167 HydrophobicContact CG1-CD1 3.71Å; V127-I167 HydrophobicContact CG2-CD1 3.99Å; V127-L176 HydrophobicContact CG2-CD1 4.23Å; V127-Q179 VanDerWaalsContact CG2-OE1 3.23Å
128	W	95.9	Very high	95.3	Very high	52 Å²	52	83.3 Å²	83.3	20%	0.197	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-5.9	-177	56.5	-94.9	0	0	0	114.6	A126 G130 Y131 P160 Q179 F180 Y189 L193 T194	A126-W128 PolarHBondContact O-N 3.11Å; W128-G130 PolarHBondContact O-N 3.41Å; W128-Y131 WeakPolarHBondContact O-CB 3.48Å; W128-Y131 PolarHBondContact O-N 2.88Å; W128-Y131 VanDerWaalsContact O-N 3.11Å; W128-P160 HydrophobicContact CB-CB 4.12Å; W128-P160 HydrophobicContact CB-CG 3.79Å; W128-Q179 PolarHBondContact NE1-O 3.34Å; W128-F180 AromaticContact CD1-CD1 3.94Å; W128-F180 AromaticContact CD1-CE1 3.58Å; W128-F180 HydrophobicContact CG-CE1 4.37Å; W128-Y189 HydrophobicContact CZ2-CD2 4.11Å; W128-Y189 AromaticContact CZ2-CE2 4Å; W128-Y189 HydrophobicContact CZ2-CE2 4Å; W128-L193 HydrophobicContact CZ3-CG 4.47Å; W128-T194 WeakPolarHBondContact CB-O 3.18Å; W128-T194 HydrophobicContact CD2-CG2 4.25Å; W128-T194 HydrophobicContact CG-CG2 4.32Å
129	A	95.6	Very high	95.3	Very high	59 Å²	59	89.2 Å²	89.2	49%	0.488	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-38.7	-173.6	0	0	0	0	0	113.5	A126 Y131	A126-A129 VanDerWaalsContact O-CB 3.31Å; A126-A129 WeakPolarHBondContact O-CB 3.28Å; A126-A129 PolarHBondContact O-N 2.9Å; A129-Y131 VanDerWaalsContact C-N 3.25Å; A129-Y131 PolarHBondContact O-N 3.46Å
130	G	92.9	Very high	95.3	Very high	75 Å²	75	87.5 Å²	87.5	77%	0.773	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	5.2	178.2	0	0	0	0	0	114.7	W128	W128-G130 PolarHBondContact O-N 3.41Å
131	Y	96.1	Very high	95.4	Very high	38 Å²	38	82.4 Å²	82.4	15%	0.149	48%	0.481	C	S	.	.			trans	-96.2	126.3	-172.3	-176.1	-107.4	0	0	0	112.9	W128 A129 R133 R145 N157 P158 P160 G195	W128-Y131 WeakPolarHBondContact O-CB 3.48Å; W128-Y131 PolarHBondContact O-N 2.88Å; W128-Y131 VanDerWaalsContact O-N 3.11Å; A129-Y131 VanDerWaalsContact C-N 3.25Å; A129-Y131 PolarHBondContact O-N 3.46Å; Y131-R133 HydrophobicContact CE1-CB 4.16Å; Y131-R145 PolarHBondContact OH-NH2 3.46Å; Y131-R145 VanDerWaalsContact OH-NH2 3.09Å; Y131-N157 WeakPolarHBondContact CE2-OD1 3.36Å; Y131-N157 PolarHBondContact OH-OD1 2.99Å; Y131-P158 WeakPolarHBondContact CE2-O 3.42Å; Y131-P158 PolarHBondContact OH-O 3.16Å; Y131-P160 HydrophobicContact CD1-CG 3.85Å; Y131-P160 HydrophobicContact CD2-CG 4.1Å; Y131-P160 HydrophobicContact CG-CG 3.58Å; Y131-G195 WeakPolarHBondContact CE1-O 3.45Å
132	R	95.8	Very high	95.3	Very high	212 Å²	212	82.6 Å²	82.6	80%	0.8	49%	0.488	S	S	*	.			trans	-124.2	130.3	173	-168.9	177.3	179.6	116	-1.2	111.3	N157	R132-N157 PolarHBondContact O-ND2 2.72Å; R132-N157 VanDerWaalsContact O-ND2 3.13Å
133	R	95.3	Very high	95.3	Very high	60 Å²	60	89.4 Å²	89.4	23%	0.226	52%	0.518	C	S	.	.			trans	-93.5	130.3	-178.9	-174	173.8	170.4	-158.4	-2	112.4	Y131 H135 T144	Y131-R133 HydrophobicContact CE1-CB 4.16Å; R133-H135 PolarHBondContact O-N 3.37Å; R133-H135 PolarHBondContact O-ND1 3.46Å; R133-T144 VanDerWaalsContact NH1-CA 3.28Å
134	N	95.4	Very high	95.5	Very high	129 Å²	129	88.5 Å²	88.5	69%	0.69	51%	0.506	S	S	*	.			trans	-76.1	120	173.1	-58.5	-16.5	0	0	0	110.1
135	H	94.9	Very high	95.5	Very high	76 Å²	76	85 Å²	85	35%	0.352	47%	0.471	S	S	.	.			trans	-147.9	162.8	175.1	59.4	-85.4	0	0	0	109.5	R133 P140	R133-H135 PolarHBondContact O-N 3.37Å; R133-H135 PolarHBondContact O-ND1 3.46Å; H135-P140 VanDerWaalsContact CD2-CA 3.43Å; H135-P140 WeakPolarHBondContact CD2-CA 3.13Å
136	K	96.1	Very high	95.6	Very high	205 Å²	205	89.8 Å²	89.8	89%	0.891	48%	0.483	S	S	*	.	S	Bend	trans	-85.2	134.1	-179.6	-174.8	178.6	-179.9	-178	0	110.1
137	G	95.9	Very high	95.7	Very high	60 Å²	60	90.2 Å²	90.2	62%	0.619	48%	0.483	S	S	*	.	S	Bend	trans	80.7	-177	179.1	0	0	0	0	0	113.1
138	G	96.1	Very high	95.7	Very high	79 Å²	79	90.3 Å²	90.3	81%	0.814	48%	0.484	S	S	*	.	S	Bend	trans	-82.8	-23.3	179.8	0	0	0	0	0	114.5
139	I	95.3	Very high	95.7	Very high	138 Å²	138	91.5 Å²	91.5	71%	0.708	49%	0.493	S	S	*	.	S	Bend	trans	-100.5	120.2	-178.3	-58.7	175	0	0	0	109
140	P	96.2	Very high	95.6	Very high	51 Å²	51	98 Å²	98	33%	0.331	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-69.6	154.4	177.3	27.9	-33.8	0	0	0	112	H135 Q142	H135-P140 VanDerWaalsContact CD2-CA 3.43Å; H135-P140 WeakPolarHBondContact CD2-CA 3.13Å; P140-Q142 PolarHBondContact O-N 3.13Å
141	P	96.3	Very high	95.6	Very high	59 Å²	59	97.5 Å²	97.5	38%	0.383	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-62.6	134.9	170	27.2	-33.8	0	0	0	110.1	K143	P141-K143 PolarHBondContact O-N 2.66Å
142	Q	94.1	Very high	95.3	Very high	147 Å²	147	103.6 Å²	103.6	69%	0.687	54%	0.536	S	S	*	.	S	Bend	trans	-60.6	-17.8	-176.8	-65.1	-58	-38	0	0	114.3	P140 T192	P140-Q142 PolarHBondContact O-N 3.13Å; Q142-T192 VanDerWaalsContact O-CG2 3.28Å; Q142-T192 WeakPolarHBondContact O-CG2 3.49Å
143	K	95.3	Very high	95.3	Very high	165 Å²	165	101.7 Å²	101.7	72%	0.717	53%	0.533	S	S	*	.	S	Bend	trans	-118.5	140.4	174.3	-66.5	-175.4	179.1	-178.6	0	110.5	P141	P141-K143 PolarHBondContact O-N 2.66Å
144	T	96.4	Very high	95.2	Very high	12 Å²	12	103.8 Å²	103.8	7%	0.074	55%	0.548	C	S	.	.			trans	-79.6	167.4	171.9	72.8	0	0	0	0	112	R133 P191 V196 M198	R133-T144 VanDerWaalsContact NH1-CA 3.28Å; T144-P191 HydrophobicContact CG2-CB 3.76Å; T144-P191 HydrophobicContact CG2-CG 4.4Å; T144-P191 WeakPolarHBondContact CG2-O 3.43Å; T144-V196 VanDerWaalsContact CB-O 3.27Å; T144-V196 WeakPolarHBondContact CB-O 3.4Å; T144-V196 WeakPolarHBondContact CG2-O 3.32Å; T144-V196 PolarHBondContact OG1-O 2.93Å; T144-M198 WeakPolarHBondContact O-CG 3.38Å; T144-M198 PolarHBondContact OG1-N 3.35Å; T144-M198 PolarHBondContact OG1-SD 2.92Å
145	R	95.4	Very high	95.1	Very high	63 Å²	63	99.5 Å²	99.5	24%	0.238	53%	0.527	C	S	.	.			trans	-59.3	149.9	175.8	63.6	-175	157	-160.9	-8.1	110.2	Y131 C148 C155 N157 C197 M198	Y131-R145 PolarHBondContact OH-NH2 3.46Å; Y131-R145 VanDerWaalsContact OH-NH2 3.09Å; R145-C148 PolarHBondContact NE-SG 3.32Å; R145-C148 PolarHBondContact NH2-SG 3.45Å; R145-C155 PolarHBondContact NH1-SG 2.75Å; R145-N157 PolarHBondContact NH1-O 3.1Å; R145-N157 PolarHBondContact NH2-O 3.1Å; R145-C197 HydrophobicContact CG-CB 4.08Å; R145-C197 WeakPolarHBondContact O-CA 3.49Å; R145-C197 WeakPolarHBondContact O-CB 3.29Å; R145-M198 PolarHBondContact O-N 2.84Å
146	K	96.8	Very high	95.1	Very high	175 Å²	175	100.1 Å²	100.1	76%	0.761	55%	0.554	S	S	*	*	S	Bend	trans	-59.2	-53.8	-179.1	-64.3	-176	179.9	-179.1	0	112.2	M198 K199	K146-M198 PolarHBondContact O-N 3.2Å; K146-K199 WeakPolarHBondContact O-CB 3.21Å; K146-K199 PolarHBondContact O-N 3.1Å
147	T	97.2	Very high	95	Very high	39 Å²	39	92.9 Å²	92.9	24%	0.239	53%	0.525	C	S	.	.			trans	-142.5	149	-179.6	64.1	0	0	0	0	110.9	I149 K199	T147-I149 PolarHBondContact OG1-O 3.2Å; T147-K199 HydrophobicContact CG2-CB 3.82Å; T147-K199 HydrophobicContact CG2-CD 3.67Å; T147-K199 HydrophobicContact CG2-CG 4.35Å
148	C	96.3	Very high	95.1	Very high	3 Å²	3	91.1 Å²	91.1	2%	0.02	50%	0.503	C	S	.	.	S	Bend	trans	-87.8	-36.5	170.6	-62.1	0	0	0	0	112.2	R145 C155 P158 C159 C162 C197	R145-C148 PolarHBondContact NE-SG 3.32Å; R145-C148 PolarHBondContact NH2-SG 3.45Å; C148-C155 VanDerWaalsContact CB-SG 3.56Å; C148-C155 PolarHBondContact O-N 2.85Å; C148-C155 VanDerWaalsContact O-N 3.1Å; C148-C155 PolarHBondContact O-SG 3.41Å; C148-C155 VanDerWaalsContact O-SG 3.32Å; C148-P158 HydrophobicContact CB-CB 4.49Å; C148-C159 VanDerWaalsContact SG-CB 3.53Å; C148-C159 PolarHBondContact SG-N 3.07Å; C148-C159 VanDerWaalsContact SG-N 3.37Å; C148-C162 HydrophobicContact CB-CB 3.74Å; C148-C162 VanDerWaalsContact CB-SG 3.57Å; C148-C162 PolarHBondContact SG-SG 2.96Å; C148-C197 VanDerWaalsContact SG-CB 3.57Å
149	I	95.6	Very high	95.1	Very high	77 Å²	77	87.4 Å²	87.4	40%	0.395	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128.5	-178	-53.4	171.6	0	0	0	107.7	T147 G151 I154	T147-I149 PolarHBondContact OG1-O 3.2Å; I149-G151 VanDerWaalsContact CG2-O 3.22Å; I149-G151 WeakPolarHBondContact CG2-O 3.42Å; I149-I154 HydrophobicContact CG1-CG1 4.47Å
150	R	95.2	Very high	95.1	Very high	194 Å²	194	80.8 Å²	80.8	73%	0.732	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130	99.3	177.3	-64.7	-176.4	-176.2	170.5	1.1	108.6	D152 K153	R150-D152 PolarHBondContact O-N 3.09Å; R150-K153 PolarHBondContact N-O 2.93Å; R150-K153 PolarHBondContact O-N 3.26Å
151	G	92.1	Very high	95.1	Very high	66 Å²	66	78.7 Å²	78.7	68%	0.68	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	-129.4	-165.8	0	0	0	0	0	109.4	I149 K153	I149-G151 VanDerWaalsContact CG2-O 3.22Å; I149-G151 WeakPolarHBondContact CG2-O 3.42Å; G151-K153 VanDerWaalsContact C-N 3.33Å
152	D	90.8	Very high	95.1	Very high	166 Å²	166	76.3 Å²	76.3	89%	0.888	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-4.3	-179.4	-48.6	-46.7	0	0	0	113.5	R150	R150-D152 PolarHBondContact O-N 3.09Å
153	K	93.8	Very high	95.1	Very high	171 Å²	171	73.4 Å²	73.4	74%	0.743	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	123.3	-175.5	-62.7	-178.1	-176.1	179.4	0	111.2	R150 G151	R150-K153 PolarHBondContact N-O 2.93Å; R150-K153 PolarHBondContact O-N 3.26Å; G151-K153 VanDerWaalsContact C-N 3.33Å
154	I	94.6	Very high	95	Very high	105 Å²	105	66.1 Å²	66.1	54%	0.538	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	135.2	171.6	-52.7	177.4	0	0	0	108.8	I149 P158	I149-I154 HydrophobicContact CG1-CG1 4.47Å; I154-P158 HydrophobicContact CG2-CB 3.79Å; I154-P158 HydrophobicContact CG2-CG 4.14Å
155	C	93	Very high	94.7	Very high	39 Å²	39	70.7 Å²	70.7	26%	0.264	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-65.7	148.5	173.2	60.8	0	0	0	0	112.1	R145 C148 N157 P158	R145-C155 PolarHBondContact NH1-SG 2.75Å; C148-C155 VanDerWaalsContact CB-SG 3.56Å; C148-C155 PolarHBondContact O-N 2.85Å; C148-C155 VanDerWaalsContact O-N 3.1Å; C148-C155 PolarHBondContact O-SG 3.41Å; C148-C155 VanDerWaalsContact O-SG 3.32Å; C155-N157 PolarHBondContact O-N 2.87Å; C155-P158 VanDerWaalsContact O-CD 3.32Å; C155-P158 WeakPolarHBondContact O-CD 3.43Å; C155-P158 VanDerWaalsContact SG-CA 3.56Å
156	G	94	Very high	94.6	Very high	88 Å²	88	69.7 Å²	69.7	91%	0.907	38%	0.382	S	S	*	.	S	Bend	trans	-58	-36.8	-172	0	0	0	0	0	116.5	P158	G156-P158 WeakPolarHBondContact O-CD 3.47Å
157	N	95.5	Very high	94.5	Very high	53 Å²	53	61.8 Å²	61.8	28%	0.283	35%	0.348	S	S	.	.	S	Bend	trans	-113.6	83.4	171.1	179.9	-3.1	0	0	0	108.6	Y131 R132 R145 C155	Y131-N157 WeakPolarHBondContact CE2-OD1 3.36Å; Y131-N157 PolarHBondContact OH-OD1 2.99Å; R132-N157 PolarHBondContact O-ND2 2.72Å; R132-N157 VanDerWaalsContact O-ND2 3.13Å; R145-N157 PolarHBondContact NH1-O 3.1Å; R145-N157 PolarHBondContact NH2-O 3.1Å; C155-N157 PolarHBondContact O-N 2.87Å
158	P	96.6	Very high	94.4	Very high	24 Å²	24	62.1 Å²	62.1	16%	0.156	35%	0.348	C	S	.	.			trans	-72.4	167.1	-176.5	29.9	-33.6	0	0	0	113.1	Y131 C148 I154 C155 G156 C162 R163	Y131-P158 WeakPolarHBondContact CE2-O 3.42Å; Y131-P158 PolarHBondContact OH-O 3.16Å; C148-P158 HydrophobicContact CB-CB 4.49Å; I154-P158 HydrophobicContact CG2-CB 3.79Å; I154-P158 HydrophobicContact CG2-CG 4.14Å; C155-P158 VanDerWaalsContact O-CD 3.32Å; C155-P158 WeakPolarHBondContact O-CD 3.43Å; C155-P158 VanDerWaalsContact SG-CA 3.56Å; G156-P158 WeakPolarHBondContact O-CD 3.47Å; P158-C162 HydrophobicContact CB-CB 4.18Å; P158-R163 HydrophobicContact CB-CB 4.31Å; P158-R163 HydrophobicContact CG-CB 3.66Å
159	C	96.6	Very high	94.4	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	35%	0.352	C	S	.	.			trans	-70.2	160.6	178	85.4	0	0	0	0	111.8	C148 I161 C162 R163	C148-C159 VanDerWaalsContact SG-CB 3.53Å; C148-C159 PolarHBondContact SG-N 3.07Å; C148-C159 VanDerWaalsContact SG-N 3.37Å; C159-I161 PolarHBondContact O-N 3.36Å; C159-I161 VanDerWaalsContact O-N 3.14Å; C159-C162 HydrophobicContact CB-CB 4.04Å; C159-C162 WeakPolarHBondContact CB-SG 3.27Å; C159-C162 CarbonylContact O-C 3.58Å; C159-C162 PolarHBondContact O-N 3.47Å; C159-C162 WeakPolarHBondContact SG-CB 3.32Å; C159-C162 PolarHBondContact SG-N 3.11Å; C159-C162 CovalentContact SG-SG 2.07Å; C159-C162 PolarHBondContact SG-SG 2.91Å; C159-R163 PolarHBondContact O-N 3.33Å
160	P	96	Very high	94.4	Very high	0 Å²	0	62 Å²	62	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-52.7	-38.5	179.3	-25.7	32.8	0	0	0	113.8	V127 W128 Y131 R163	V127-P160 HydrophobicContact CG1-CB 3.84Å; W128-P160 HydrophobicContact CB-CB 4.12Å; W128-P160 HydrophobicContact CB-CG 3.79Å; Y131-P160 HydrophobicContact CD1-CG 3.85Å; Y131-P160 HydrophobicContact CD2-CG 4.1Å; Y131-P160 HydrophobicContact CG-CG 3.58Å; P160-R163 WeakPolarHBondContact O-CG 3.32Å
161	I	96.5	Very high	94.5	Very high	7 Å²	7	55.3 Å²	55.3	4%	0.036	32%	0.324	C	S	.	.	H	α-helix	trans	-78.6	-29.8	177.2	-58.3	173.8	0	0	0	111.9	C159 I167 I169 F180 V196 Q200 L204	C159-I161 PolarHBondContact O-N 3.36Å; C159-I161 VanDerWaalsContact O-N 3.14Å; I161-I167 HydrophobicContact CG2-CG2 4.32Å; I161-I169 HydrophobicContact CD1-CD1 4.03Å; I161-I169 HydrophobicContact CD1-CG1 4.3Å; I161-I169 HydrophobicContact CG2-CD1 4.07Å; I161-I169 HydrophobicContact CG2-CG1 4.09Å; I161-F180 HydrophobicContact CD1-CE1 4.14Å; I161-F180 HydrophobicContact CD1-CE2 4.23Å; I161-F180 HydrophobicContact CD1-CZ 3.67Å; I161-F180 HydrophobicContact CG1-CZ 3.89Å; I161-V196 HydrophobicContact CD1-CG1 3.84Å; I161-V196 HydrophobicContact CG1-CG1 4.25Å; I161-Q200 HydrophobicContact CD1-CB 4.44Å; I161-Q200 HydrophobicContact CG2-CG 4.45Å; I161-L204 HydrophobicContact CD1-CD1 3.75Å; I161-L204 HydrophobicContact CD1-CD2 4.2Å; I161-L204 HydrophobicContact CD1-CG 4.12Å
162	C	95.3	Very high	94.7	Very high	9 Å²	9	56.9 Å²	56.9	6%	0.061	31%	0.314	C	S	.	.	H	α-helix	trans	-88.2	-16	-172.8	-47	0	0	0	0	112.6	C148 P158 C159	C148-C162 HydrophobicContact CB-CB 3.74Å; C148-C162 VanDerWaalsContact CB-SG 3.57Å; C148-C162 PolarHBondContact SG-SG 2.96Å; P158-C162 HydrophobicContact CB-CB 4.18Å; C159-C162 HydrophobicContact CB-CB 4.04Å; C159-C162 WeakPolarHBondContact CB-SG 3.27Å; C159-C162 CarbonylContact O-C 3.58Å; C159-C162 PolarHBondContact O-N 3.47Å; C159-C162 WeakPolarHBondContact SG-CB 3.32Å; C159-C162 PolarHBondContact SG-N 3.11Å; C159-C162 CovalentContact SG-SG 2.07Å; C159-C162 PolarHBondContact SG-SG 2.91Å
163	R	94.1	Very high	94.9	Very high	85 Å²	85	49 Å²	49	32%	0.321	27%	0.272	S	S	.	.	H	α-helix	trans	-76.3	-35.8	-179	83.5	-170.8	-177.9	163.2	4.6	111	Y122 P158 C159 P160	Y122-R163 PolarHBondContact OH-NE 3.05Å; Y122-R163 VanDerWaalsContact OH-NE 3.12Å; Y122-R163 PolarHBondContact OH-NH2 3.16Å; P158-R163 HydrophobicContact CB-CB 4.31Å; P158-R163 HydrophobicContact CG-CB 3.66Å; C159-R163 PolarHBondContact O-N 3.33Å; P160-R163 WeakPolarHBondContact O-CG 3.32Å
164	D	93.2	Very high	95	Very high	13 Å²	13	43 Å²	43	7%	0.07	25%	0.249	C	C	.	.			trans	-113.7	114.8	-177.7	-66.9	-15.9	0	0	0	109.2	R121 Y122 N166 I167	R121-D164 IonicContact CZ-OD1 3.35Å; R121-D164 IonicContact CZ-OD2 2.79Å; R121-D164 IonicContact NE-OD1 3.1Å; R121-D164 PolarHBondContact NE-OD1 3.27Å; R121-D164 IonicContact NE-OD2 2.71Å; R121-D164 PolarHBondContact NE-OD2 3.34Å; R121-D164 IonicContact NH2-OD1 3.38Å; R121-D164 PolarHBondContact NH2-OD1 3.24Å; R121-D164 IonicContact NH2-OD2 3.35Å; Y122-D164 PolarHBondContact OH-OD2 3.49Å; D164-N166 PolarHBondContact O-N 3.46Å; D164-I167 HydrophobicContact CB-CD1 4.12Å; D164-I167 HydrophobicContact CB-CG1 4.15Å; D164-I167 PolarHBondContact O-N 2.9Å
165	P	90.8	Very high	95.1	Very high	108 Å²	108	43.3 Å²	43.3	70%	0.701	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-20.8	-177.6	28.1	-34.5	0	0	0	113.1	I167	P165-I167 VanDerWaalsContact C-N 3.25Å; P165-I167 PolarHBondContact O-N 3.11Å
166	N	92.6	Very high	95.3	Very high	41 Å²	41	41.5 Å²	41.5	22%	0.219	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-21.5	179.7	-59.9	-6.3	0	0	0	112.3	Y105 Y112 D164 I168	Y105-N166 HydrophobicContact CD2-CB 4.17Å; Y112-N166 HydrophobicContact CD1-CB 3.78Å; Y112-N166 HydrophobicContact CD2-CB 3.83Å; Y112-N166 HydrophobicContact CE1-CB 3.63Å; Y112-N166 HydrophobicContact CE2-CB 3.7Å; Y112-N166 WeakPolarHBondContact CE2-ND2 3.27Å; Y112-N166 HydrophobicContact CG-CB 3.88Å; D164-N166 PolarHBondContact O-N 3.46Å; N166-I168 PolarHBondContact O-N 3.35Å; N166-I168 VanDerWaalsContact O-N 3.12Å
167	I	94.4	Very high	95.4	Very high	10 Å²	10	37.3 Å²	37.3	5%	0.051	19%	0.191	C	C	.	.			trans	-82.8	93.7	177	-58.3	-179.4	0	0	0	108.9	Y112 Y122 V127 I161 D164 P165 L176	Y112-I167 HydrophobicContact CD1-CG1 4.28Å; Y112-I167 HydrophobicContact CE1-CG1 3.77Å; Y122-I167 HydrophobicContact CE2-CD1 4.03Å; Y122-I167 WeakPolarHBondContact OH-CD1 3.36Å; V127-I167 HydrophobicContact CG1-CD1 3.71Å; V127-I167 HydrophobicContact CG2-CD1 3.99Å; I161-I167 HydrophobicContact CG2-CG2 4.32Å; D164-I167 HydrophobicContact CB-CD1 4.12Å; D164-I167 HydrophobicContact CB-CG1 4.15Å; D164-I167 PolarHBondContact O-N 2.9Å; P165-I167 VanDerWaalsContact C-N 3.25Å; P165-I167 PolarHBondContact O-N 3.11Å; I167-L176 HydrophobicContact CG2-CD1 3.81Å; I167-L176 HydrophobicContact CG2-CD2 3.77Å; I167-L176 HydrophobicContact CG2-CG 4.47Å
168	I	94.9	Very high	95.5	Very high	46 Å²	46	40.7 Å²	40.7	24%	0.236	21%	0.205	C	C	.	.			trans	-102.6	125.4	180	-53.7	172	0	0	0	109.2	K106 P109 N166 N170 N173	K106-I168 HydrophobicContact CB-CD1 4.31Å; K106-I168 HydrophobicContact CG-CD1 3.99Å; P109-I168 HydrophobicContact CB-CB 3.94Å; N166-I168 PolarHBondContact O-N 3.35Å; N166-I168 VanDerWaalsContact O-N 3.12Å; I168-N170 VanDerWaalsContact CG2-ND2 3.28Å; I168-N170 WeakPolarHBondContact CG2-ND2 3.45Å; I168-N170 PolarHBondContact O-N 3.14Å; I168-N173 PolarHBondContact O-ND2 3.21Å
169	I	96.6	Very high	95.5	Very high	23 Å²	23	41.5 Å²	41.5	12%	0.118	21%	0.207	C	C	.	.			trans	-73.8	113.8	175.5	-58.4	164.1	0	0	0	108.4	I161 L177 Q200 K203 L204 A207	I161-I169 HydrophobicContact CD1-CD1 4.03Å; I161-I169 HydrophobicContact CD1-CG1 4.3Å; I161-I169 HydrophobicContact CG2-CD1 4.07Å; I161-I169 HydrophobicContact CG2-CG1 4.09Å; I169-L177 HydrophobicContact CG2-CD2 4.43Å; I169-Q200 HydrophobicContact CD1-CB 4.14Å; I169-K203 HydrophobicContact CD1-CB 3.99Å; I169-L204 HydrophobicContact CD1-CD2 4Å; I169-L204 HydrophobicContact CD1-CG 3.86Å; I169-L204 HydrophobicContact CG1-CD2 3.91Å; I169-L204 HydrophobicContact CG1-CG 4.34Å; I169-L204 HydrophobicContact CG2-CD2 3.95Å; I169-A207 HydrophobicContact CG2-CB 3.66Å
170	N	96.3	Very high	95.5	Very high	53 Å²	53	41.6 Å²	41.6	28%	0.283	21%	0.207	S	C	.	.			trans	-140.3	150.8	173.3	-83.2	-52.3	0	0	0	110	P109 I168 Q172 N173	P109-N170 HydrophobicContact CG-CB 4.02Å; P109-N170 WeakPolarHBondContact CG-ND2 3.48Å; I168-N170 VanDerWaalsContact CG2-ND2 3.28Å; I168-N170 WeakPolarHBondContact CG2-ND2 3.45Å; I168-N170 PolarHBondContact O-N 3.14Å; N170-Q172 VanDerWaalsContact C-N 3.3Å; N170-Q172 PolarHBondContact O-N 3.38Å; N170-N173 WeakPolarHBondContact O-CB 3.11Å; N170-N173 PolarHBondContact O-N 2.86Å; N170-N173 VanDerWaalsContact O-N 3.16Å
171	H	96.9	Very high	95.5	Very high	54 Å²	54	42.7 Å²	42.7	25%	0.25	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-33.4	-177.6	60.4	-76.9	0	0	0	112.3	N173 K210 A211 D214	H171-N173 PolarHBondContact O-N 3.23Å; H171-K210 HydrophobicContact CB-CB 4Å; H171-A211 HydrophobicContact CB-CB 4.2Å; H171-A211 WeakPolarHBondContact O-CB 2.97Å; H171-D214 IonicContact CD2-OD2 3.98Å; H171-D214 PolarHBondContact CD2-OD2 3.09Å; H171-D214 IonicContact CG-OD2 2.62Å; H171-D214 IonicContact NE2-OD2 2.67Å
172	Q	95.9	Very high	95.5	Very high	99 Å²	99	43.1 Å²	43.1	46%	0.463	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-18.9	175.2	-70.7	166.2	-13.1	0	0	113.5	W110 N170 V174 L216	W110-Q172 HydrophobicContact CE3-CB 3.85Å; W110-Q172 HydrophobicContact CZ3-CB 3.8Å; W110-Q172 HydrophobicContact CZ3-CG 4.44Å; N170-Q172 VanDerWaalsContact C-N 3.3Å; N170-Q172 PolarHBondContact O-N 3.38Å; Q172-V174 VanDerWaalsContact C-N 3.3Å; Q172-V174 PolarHBondContact O-N 2.97Å; Q172-L216 HydrophobicContact CG-CD1 4.43Å
173	N	96.1	Very high	95.4	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.011	25%	0.246	C	C	.	.			trans	-83.8	67.2	-177.1	-68.7	-10.9	0	0	0	112.3	P109 W110 I168 N170 H171 K175 L176 L177	P109-N173 VanDerWaalsContact CB-ND2 3.3Å; P109-N173 WeakPolarHBondContact CB-ND2 3.46Å; P109-N173 VanDerWaalsContact CG-ND2 3.32Å; P109-N173 WeakPolarHBondContact CG-ND2 3.24Å; P109-N173 WeakPolarHBondContact CG-OD1 3.4Å; W110-N173 VanDerWaalsContact CA-OD1 3.27Å; W110-N173 WeakPolarHBondContact CA-OD1 3.47Å; W110-N173 VanDerWaalsContact CB-OD1 3.24Å; W110-N173 WeakPolarHBondContact CB-OD1 3.28Å; W110-N173 PolarHBondContact N-OD1 2.91Å; I168-N173 PolarHBondContact O-ND2 3.21Å; N170-N173 WeakPolarHBondContact O-CB 3.11Å; N170-N173 PolarHBondContact O-N 2.86Å; N170-N173 VanDerWaalsContact O-N 3.16Å; H171-N173 PolarHBondContact O-N 3.23Å; N173-K175 VanDerWaalsContact C-N 3.29Å; N173-K175 PolarHBondContact O-N 3.3Å; N173-L176 HydrophobicContact CB-CB 4.11Å; N173-L176 PolarHBondContact O-N 3.39Å; N173-L176 VanDerWaalsContact O-N 3.13Å; N173-L177 WeakPolarHBondContact O-CG 3.41Å; N173-L177 PolarHBondContact O-N 2.83Å
174	V	95.8	Very high	95.4	Very high	43 Å²	43	51.8 Å²	51.8	26%	0.261	27%	0.268	S	S	.	.	H	α-helix	trans	-55.2	-44.3	-179.1	177	0	0	0	0	111.8	Q172 L176 L177 Q178 L216 L217	Q172-V174 VanDerWaalsContact C-N 3.3Å; Q172-V174 PolarHBondContact O-N 2.97Å; V174-L176 VanDerWaalsContact C-N 3.28Å; V174-L176 PolarHBondContact O-N 2.94Å; V174-L177 PolarHBondContact O-N 3.28Å; V174-Q178 VanDerWaalsContact O-CB 3.29Å; V174-Q178 WeakPolarHBondContact O-CB 3.33Å; V174-Q178 PolarHBondContact O-N 3.12Å; V174-L216 HydrophobicContact CG2-CB 3.96Å; V174-L217 HydrophobicContact CG1-CD2 3.81Å
175	K	95.8	Very high	95.4	Very high	112 Å²	112	54.7 Å²	54.7	49%	0.487	29%	0.29	S	S	.	.	H	α-helix	trans	-57.4	-37.1	179.4	-67.5	177.9	-179.3	173.7	0	113.3	L113 D114 N173 Q179	L113-K175 HydrophobicContact CD1-CB 3.87Å; D114-K175 IonicContact OD1-NZ 3.02Å; D114-K175 PolarHBondContact OD1-NZ 3.45Å; D114-K175 IonicContact OD2-NZ 3.22Å; D114-K175 PolarHBondContact OD2-NZ 2.96Å; N173-K175 VanDerWaalsContact C-N 3.29Å; N173-K175 PolarHBondContact O-N 3.3Å; K175-Q179 WeakPolarHBondContact O-CG 3.24Å
176	L	96.8	Very high	95.5	Very high	2 Å²	2	51 Å²	51	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-76.9	-48.7	177.1	-179.7	66.9	0	0	0	110.8	L113 V127 I167 N173 V174 Q178 Q179 F180	L113-L176 HydrophobicContact CD1-CB 3.72Å; L113-L176 HydrophobicContact CD2-CD1 4.45Å; V127-L176 HydrophobicContact CG2-CD1 4.23Å; I167-L176 HydrophobicContact CG2-CD1 3.81Å; I167-L176 HydrophobicContact CG2-CD2 3.77Å; I167-L176 HydrophobicContact CG2-CG 4.47Å; N173-L176 HydrophobicContact CB-CB 4.11Å; N173-L176 PolarHBondContact O-N 3.39Å; N173-L176 VanDerWaalsContact O-N 3.13Å; V174-L176 VanDerWaalsContact C-N 3.28Å; V174-L176 PolarHBondContact O-N 2.94Å; L176-Q178 VanDerWaalsContact C-N 3.28Å; L176-Q178 PolarHBondContact O-N 3.16Å; L176-Q179 WeakPolarHBondContact O-CB 3.22Å; L176-Q179 PolarHBondContact O-N 2.81Å; L176-Q179 VanDerWaalsContact O-N 3.16Å; L176-F180 HydrophobicContact CD1-CE2 3.9Å; L176-F180 HydrophobicContact CG-CE2 4.15Å; L176-F180 VanDerWaalsContact O-CD2 3.28Å; L176-F180 WeakPolarHBondContact O-CD2 3.27Å
177	L	97.2	Very high	95.7	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62	-37.8	-176.1	-64.7	-177	0	0	0	111.8	I169 N173 V174 Q179 F180 I181 L204 A207 I208 A211 L217	I169-L177 HydrophobicContact CG2-CD2 4.43Å; N173-L177 WeakPolarHBondContact O-CG 3.41Å; N173-L177 PolarHBondContact O-N 2.83Å; V174-L177 PolarHBondContact O-N 3.28Å; L177-Q179 PolarHBondContact O-N 2.92Å; L177-F180 PolarHBondContact O-N 3.31Å; L177-I181 WeakPolarHBondContact O-CG1 3.44Å; L177-L204 HydrophobicContact CD2-CD2 3.96Å; L177-A207 HydrophobicContact CD1-CB 4.45Å; L177-A207 HydrophobicContact CD2-CB 4.27Å; L177-I208 HydrophobicContact CB-CG1 4.23Å; L177-I208 HydrophobicContact CD1-CG1 4.23Å; L177-I208 HydrophobicContact CD2-CG1 3.97Å; L177-I208 HydrophobicContact CG-CG1 4.36Å; L177-A211 HydrophobicContact CD1-CB 4Å; L177-L217 HydrophobicContact CB-CD1 4.15Å; L177-L217 HydrophobicContact CD1-CD1 4.11Å
178	Q	96.4	Very high	95.8	Very high	124 Å²	124	56.9 Å²	56.9	58%	0.579	30%	0.302	S	S	*	.	H	α-helix	trans	-60	-30.5	178.1	-167.7	172.6	12.4	0	0	112.7	V174 L176 F180 I181	V174-Q178 VanDerWaalsContact O-CB 3.29Å; V174-Q178 WeakPolarHBondContact O-CB 3.33Å; V174-Q178 PolarHBondContact O-N 3.12Å; L176-Q178 VanDerWaalsContact C-N 3.28Å; L176-Q178 PolarHBondContact O-N 3.16Å; Q178-F180 PolarHBondContact O-N 3.26Å; Q178-I181 PolarHBondContact O-N 3.43Å
179	Q	96.4	Very high	95.9	Very high	41 Å²	41	57.6 Å²	57.6	19%	0.192	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-22	175.7	-58.4	176	14.3	0	0	113.4	Y118 A126 V127 W128 K175 L176 L177	Y118-Q179 PolarHBondContact OH-NE2 3.41Å; A126-Q179 HydrophobicContact CB-CB 4.32Å; V127-Q179 VanDerWaalsContact CG2-OE1 3.23Å; W128-Q179 PolarHBondContact NE1-O 3.34Å; K175-Q179 WeakPolarHBondContact O-CG 3.24Å; L176-Q179 WeakPolarHBondContact O-CB 3.22Å; L176-Q179 PolarHBondContact O-N 2.81Å; L176-Q179 VanDerWaalsContact O-N 3.16Å; L177-Q179 PolarHBondContact O-N 2.92Å
180	F	97.3	Very high	95.9	Very high	2 Å²	2	61.9 Å²	61.9	1%	0.009	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	2.8	179	-65.8	-80.1	0	0	0	112.7	W128 I161 L176 L177 Q178 Y189 T194 V196 L204	W128-F180 AromaticContact CD1-CD1 3.94Å; W128-F180 AromaticContact CD1-CE1 3.58Å; W128-F180 HydrophobicContact CG-CE1 4.37Å; I161-F180 HydrophobicContact CD1-CE1 4.14Å; I161-F180 HydrophobicContact CD1-CE2 4.23Å; I161-F180 HydrophobicContact CD1-CZ 3.67Å; I161-F180 HydrophobicContact CG1-CZ 3.89Å; L176-F180 HydrophobicContact CD1-CE2 3.9Å; L176-F180 HydrophobicContact CG-CE2 4.15Å; L176-F180 VanDerWaalsContact O-CD2 3.28Å; L176-F180 WeakPolarHBondContact O-CD2 3.27Å; L177-F180 PolarHBondContact O-N 3.31Å; Q178-F180 PolarHBondContact O-N 3.26Å; F180-Y189 VanDerWaalsContact C-CD2 3.4Å; F180-Y189 VanDerWaalsContact O-CD2 3.3Å; F180-Y189 WeakPolarHBondContact O-CD2 3.3Å; F180-Y189 PolarHBondContact O-N 2.99Å; F180-T194 HydrophobicContact CD1-CG2 4Å; F180-T194 HydrophobicContact CE1-CG2 4.44Å; F180-V196 HydrophobicContact CE1-CG1 3.97Å; F180-L204 HydrophobicContact CD1-CD1 3.83Å; F180-L204 HydrophobicContact CD2-CD1 4.33Å; F180-L204 HydrophobicContact CD2-CD2 3.91Å; F180-L204 HydrophobicContact CE1-CD1 4.09Å; F180-L204 HydrophobicContact CE2-CD2 4.22Å; F180-L204 HydrophobicContact CG-CD1 3.96Å; F180-L204 HydrophobicContact CG-CD2 4.26Å; F180-L204 HydrophobicContact CZ-CD1 4.47Å
181	I	97.1	Very high	96	Very high	22 Å²	22	60.1 Å²	60.1	11%	0.113	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-115.3	141.3	-179.6	-61.4	168	0	0	0	109	L177 Q178 V188 Y189 I208 L217	L177-I181 WeakPolarHBondContact O-CG1 3.44Å; Q178-I181 PolarHBondContact O-N 3.43Å; I181-V188 HydrophobicContact CG1-CG2 4.46Å; I181-Y189 WeakPolarHBondContact O-CE2 3.43Å; I181-I208 HydrophobicContact CD1-CD1 4.16Å; I181-I208 HydrophobicContact CD1-CG1 4.26Å; I181-I208 HydrophobicContact CD1-CG2 4.04Å; I181-I208 HydrophobicContact CG1-CD1 4.05Å; I181-L217 HydrophobicContact CD1-CD1 3.85Å; I181-L217 HydrophobicContact CD1-CD2 4.43Å
182	S	95.7	Very high	95.9	Very high	17 Å²	17	60.3 Å²	60.3	12%	0.119	32%	0.322	C	S	.	.			trans	-67.9	124.9	170.1	173	0	0	0	0	110.3	H184 S185 G186 M187 Y189	S182-H184 PolarHBondContact O-N 3.28Å; S182-S185 PolarHBondContact OG-N 3.01Å; S182-G186 WeakPolarHBondContact O-CA 3.32Å; S182-G186 PolarHBondContact O-N 2.91Å; S182-M187 PolarHBondContact N-O 3.18Å; S182-Y189 WeakPolarHBondContact CA-OH 3.48Å
183	P	93.9	Very high	95.9	Very high	104 Å²	104	60.4 Å²	60.4	68%	0.675	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-26.2	-179.3	26.3	-34.2	0	0	0	112.7
184	H	93.4	Very high	95.9	Very high	171 Å²	171	60.4 Å²	60.4	79%	0.792	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-43.2	-178.1	-58.7	-66.3	0	0	0	112.8	S182	S182-H184 PolarHBondContact O-N 3.28Å
185	S	93.8	Very high	95.9	Very high	75 Å²	75	58.8 Å²	58.8	52%	0.524	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-17.6	-174.1	-46.9	0	0	0	0	113.1	S182 M187	S182-S185 PolarHBondContact OG-N 3.01Å; S185-M187 PolarHBondContact O-N 3.39Å
186	G	93.4	Very high	96	Very high	30 Å²	30	53.5 Å²	53.5	31%	0.309	29%	0.294	S	S	.	.			trans	64.9	6.8	-171.5	0	0	0	0	0	114.2	S182 R212	S182-G186 WeakPolarHBondContact O-CA 3.32Å; S182-G186 PolarHBondContact O-N 2.91Å; G186-R212 PolarHBondContact O-NH2 3.46Å
187	M	95.3	Very high	96	Very high	135 Å²	135	53.5 Å²	53.5	67%	0.665	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-83.4	141.4	178.7	-65.8	-178.3	69.8	0	0	110.7	S182 S185	S182-M187 PolarHBondContact N-O 3.18Å; S185-M187 PolarHBondContact O-N 3.39Å
188	V	97.4	Very high	96.1	Very high	40 Å²	40	56.9 Å²	56.9	24%	0.242	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-72.2	135.5	174.4	-174.1	0	0	0	0	109.2	I181 I208	I181-V188 HydrophobicContact CG1-CG2 4.46Å; V188-I208 HydrophobicContact CG1-CD1 3.94Å; V188-I208 HydrophobicContact CG2-CD1 3.76Å; V188-I208 HydrophobicContact CG2-CG2 4.2Å
189	Y	97.3	Very high	96.1	Very high	61 Å²	61	56.4 Å²	56.4	24%	0.239	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-67	142.5	178	-67.5	-56.2	0	0	0	112.5	W128 F180 I181 S182 L193 T194 Q201	W128-Y189 HydrophobicContact CZ2-CD2 4.11Å; W128-Y189 AromaticContact CZ2-CE2 4Å; W128-Y189 HydrophobicContact CZ2-CE2 4Å; F180-Y189 VanDerWaalsContact C-CD2 3.4Å; F180-Y189 VanDerWaalsContact O-CD2 3.3Å; F180-Y189 WeakPolarHBondContact O-CD2 3.3Å; F180-Y189 PolarHBondContact O-N 2.99Å; I181-Y189 WeakPolarHBondContact O-CE2 3.43Å; S182-Y189 WeakPolarHBondContact CA-OH 3.48Å; Y189-L193 HydrophobicContact CD1-CD2 3.41Å; Y189-L193 VanDerWaalsContact CD1-CD2 3.41Å; Y189-L193 HydrophobicContact CE1-CD2 3.97Å; Y189-L193 HydrophobicContact CG-CD2 3.84Å; Y189-T194 HydrophobicContact CD2-CG2 4.42Å; Y189-T194 HydrophobicContact CG-CG2 4.35Å; Y189-Q201 PolarHBondContact O-NE2 3.4Å
190	D	96.6	Very high	96.2	Very high	112 Å²	112	55.8 Å²	55.8	60%	0.599	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-65.4	149.1	174.7	-78.4	-41.6	0	0	0	112	T192 L193 T194	D190-T192 PolarHBondContact O-N 2.97Å; D190-L193 WeakPolarHBondContact O-CB 3.47Å; D190-L193 PolarHBondContact O-N 2.99Å; D190-T194 PolarHBondContact O-N 3.27Å; D190-T194 VanDerWaalsContact O-N 3.16Å; D190-T194 PolarHBondContact O-OG1 3.1Å
191	P	96.8	Very high	96.2	Very high	17 Å²	17	56.4 Å²	56.4	11%	0.11	31%	0.307	C	S	.	.	H	α-helix	trans	-67.3	-18.4	179.5	29.6	-37.1	0	0	0	112.7	T144 L193 G195 V196 M198 Q201	T144-P191 HydrophobicContact CG2-CB 3.76Å; T144-P191 HydrophobicContact CG2-CG 4.4Å; T144-P191 WeakPolarHBondContact CG2-O 3.43Å; P191-L193 VanDerWaalsContact C-N 3.34Å; P191-G195 VanDerWaalsContact O-CA 3.24Å; P191-G195 WeakPolarHBondContact O-CA 3.5Å; P191-G195 PolarHBondContact O-N 3.02Å; P191-V196 HydrophobicContact CB-CG2 4.04Å; P191-M198 HydrophobicContact CB-SD 4.46Å; P191-M198 HydrophobicContact CG-SD 4.05Å; P191-Q201 HydrophobicContact CB-CB 4.45Å; P191-Q201 HydrophobicContact CB-CG 4.31Å; P191-Q201 HydrophobicContact CG-CG 4.4Å
192	T	95.6	Very high	96.3	Very high	58 Å²	58	61.7 Å²	61.7	36%	0.356	33%	0.329	S	S	.	.	H	α-helix	trans	-68.2	-34.1	172.6	46.4	0	0	0	0	112	Q142 D190	Q142-T192 VanDerWaalsContact O-CG2 3.28Å; Q142-T192 WeakPolarHBondContact O-CG2 3.49Å; D190-T192 PolarHBondContact O-N 2.97Å
193	L	95.4	Very high	96.4	Very high	101 Å²	101	65.4 Å²	65.4	53%	0.529	34%	0.343	S	S	.	.	H	α-helix	trans	-77.9	-52.7	176.3	-176.4	69.4	0	0	0	111	W128 Y189 D190 P191	W128-L193 HydrophobicContact CZ3-CG 4.47Å; Y189-L193 HydrophobicContact CD1-CD2 3.41Å; Y189-L193 VanDerWaalsContact CD1-CD2 3.41Å; Y189-L193 HydrophobicContact CE1-CD2 3.97Å; Y189-L193 HydrophobicContact CG-CD2 3.84Å; D190-L193 WeakPolarHBondContact O-CB 3.47Å; D190-L193 PolarHBondContact O-N 2.99Å; P191-L193 VanDerWaalsContact C-N 3.34Å
194	T	96.7	Very high	96.6	Very high	2 Å²	2	60.4 Å²	60.4	1%	0.012	31%	0.311	C	S	.	.	H	α-helix	trans	-78.5	-21.3	-174.5	60.1	0	0	0	0	113.3	W128 F180 Y189 D190 V196	W128-T194 WeakPolarHBondContact CB-O 3.18Å; W128-T194 HydrophobicContact CD2-CG2 4.25Å; W128-T194 HydrophobicContact CG-CG2 4.32Å; F180-T194 HydrophobicContact CD1-CG2 4Å; F180-T194 HydrophobicContact CE1-CG2 4.44Å; Y189-T194 HydrophobicContact CD2-CG2 4.42Å; Y189-T194 HydrophobicContact CG-CG2 4.35Å; D190-T194 PolarHBondContact O-N 3.27Å; D190-T194 VanDerWaalsContact O-N 3.16Å; D190-T194 PolarHBondContact O-OG1 3.1Å; T194-V196 VanDerWaalsContact C-N 3.27Å; T194-V196 PolarHBondContact O-N 3.17Å; T194-V196 WeakPolarHBondContact OG1-CG2 3.49Å
195	G	96.3	Very high	96.8	Very high	9 Å²	9	55.2 Å²	55.2	9%	0.093	29%	0.289	C	S	.	.			trans	74.2	12.1	-178.9	0	0	0	0	0	115	Y131 P191	Y131-G195 WeakPolarHBondContact CE1-O 3.45Å; P191-G195 VanDerWaalsContact O-CA 3.24Å; P191-G195 WeakPolarHBondContact O-CA 3.5Å; P191-G195 PolarHBondContact O-N 3.02Å
196	V	97.8	Very high	97	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.282	C	S	.	.			trans	-71.2	152.8	177.4	-57.4	0	0	0	0	112	T144 I161 F180 P191 T194 Q201	T144-V196 VanDerWaalsContact CB-O 3.27Å; T144-V196 WeakPolarHBondContact CB-O 3.4Å; T144-V196 WeakPolarHBondContact CG2-O 3.32Å; T144-V196 PolarHBondContact OG1-O 2.93Å; I161-V196 HydrophobicContact CD1-CG1 3.84Å; I161-V196 HydrophobicContact CG1-CG1 4.25Å; F180-V196 HydrophobicContact CE1-CG1 3.97Å; P191-V196 HydrophobicContact CB-CG2 4.04Å; T194-V196 VanDerWaalsContact C-N 3.27Å; T194-V196 PolarHBondContact O-N 3.17Å; T194-V196 WeakPolarHBondContact OG1-CG2 3.49Å; V196-Q201 HydrophobicContact CG2-CB 3.99Å
197	C	97.5	Very high	97.2	Very high	3 Å²	3	54.6 Å²	54.6	2%	0.02	27%	0.271	C	S	.	.			trans	-75.6	153.9	173.3	71.2	0	0	0	0	111.4	R145 C148 K199 Q200 Q201	R145-C197 HydrophobicContact CG-CB 4.08Å; R145-C197 WeakPolarHBondContact O-CA 3.49Å; R145-C197 WeakPolarHBondContact O-CB 3.29Å; C148-C197 VanDerWaalsContact SG-CB 3.57Å; C197-K199 PolarHBondContact O-N 2.96Å; C197-K199 VanDerWaalsContact O-N 3.16Å; C197-Q200 PolarHBondContact O-N 3.44Å; C197-Q200 WeakPolarHBondContact SG-CG 3.29Å; C197-Q201 PolarHBondContact O-N 3.02Å
198	M	97.8	Very high	97.4	Very high	71 Å²	71	48.1 Å²	48.1	35%	0.35	24%	0.239	S	C	.	.	H	α-helix	trans	-58.3	-34.1	-175.4	-63.7	-59.1	-52.5	0	0	113.5	T144 R145 K146 P191 Q201 K202	T144-M198 WeakPolarHBondContact O-CG 3.38Å; T144-M198 PolarHBondContact OG1-N 3.35Å; T144-M198 PolarHBondContact OG1-SD 2.92Å; R145-M198 PolarHBondContact O-N 2.84Å; K146-M198 PolarHBondContact O-N 3.2Å; P191-M198 HydrophobicContact CB-SD 4.46Å; P191-M198 HydrophobicContact CG-SD 4.05Å; M198-Q201 PolarHBondContact O-N 3.18Å; M198-K202 PolarHBondContact O-N 3.39Å
199	K	97.6	Very high	97.4	Very high	113 Å²	113	50 Å²	50	49%	0.491	25%	0.248	S	C	.	.	H	α-helix	trans	-63	-42.7	175	179.2	178.3	179.4	-178.1	0	112.1	K146 T147 C197 K203	K146-K199 WeakPolarHBondContact O-CB 3.21Å; K146-K199 PolarHBondContact O-N 3.1Å; T147-K199 HydrophobicContact CG2-CB 3.82Å; T147-K199 HydrophobicContact CG2-CD 3.67Å; T147-K199 HydrophobicContact CG2-CG 4.35Å; C197-K199 PolarHBondContact O-N 2.96Å; C197-K199 VanDerWaalsContact O-N 3.16Å; K199-K203 WeakPolarHBondContact O-CG 3.42Å; K199-K203 PolarHBondContact O-N 3.43Å
200	Q	97.5	Very high	97.4	Very high	29 Å²	29	52.8 Å²	52.8	14%	0.136	26%	0.261	C	S	.	.	H	α-helix	trans	-75.1	-35.5	178.1	-61.7	-61	8.8	0	0	111.2	I161 I169 C197 K202 K203 L204	I161-Q200 HydrophobicContact CD1-CB 4.44Å; I161-Q200 HydrophobicContact CG2-CG 4.45Å; I169-Q200 HydrophobicContact CD1-CB 4.14Å; C197-Q200 PolarHBondContact O-N 3.44Å; C197-Q200 WeakPolarHBondContact SG-CG 3.29Å; Q200-K202 VanDerWaalsContact C-N 3.3Å; Q200-K202 PolarHBondContact O-N 3.13Å; Q200-K203 PolarHBondContact O-N 2.67Å; Q200-L204 WeakPolarHBondContact O-CG 3.28Å; Q200-L204 PolarHBondContact O-N 2.67Å
201	Q	98.1	Very high	97.5	Very high	15 Å²	15	47.4 Å²	47.4	7%	0.07	23%	0.232	C	C	.	.	H	α-helix	trans	-57.2	-44.8	172.1	-172.7	68.7	33.5	0	0	111.5	Y189 P191 V196 C197 M198 K203 L204 N205	Y189-Q201 PolarHBondContact O-NE2 3.4Å; P191-Q201 HydrophobicContact CB-CB 4.45Å; P191-Q201 HydrophobicContact CB-CG 4.31Å; P191-Q201 HydrophobicContact CG-CG 4.4Å; V196-Q201 HydrophobicContact CG2-CB 3.99Å; C197-Q201 PolarHBondContact O-N 3.02Å; M198-Q201 PolarHBondContact O-N 3.18Å; Q201-K203 VanDerWaalsContact C-N 3.32Å; Q201-K203 PolarHBondContact O-N 3.2Å; Q201-L204 WeakPolarHBondContact O-CB 3.39Å; Q201-L204 PolarHBondContact O-N 3.25Å; Q201-N205 PolarHBondContact NE2-OD1 3.15Å; Q201-N205 VanDerWaalsContact NE2-OD1 3.1Å; Q201-N205 VanDerWaalsContact O-CG 3.31Å; Q201-N205 PolarHBondContact O-N 2.96Å; Q201-N205 PolarHBondContact O-OD1 3.06Å
202	K	98.3	Very high	97.5	Very high	133 Å²	133	49.4 Å²	49.4	58%	0.578	24%	0.237	S	C	*	.	H	α-helix	trans	-60.2	-44.1	177.3	-167	-179.4	-173.2	-91.9	0	111.6	M198 Q200 N205 E206	M198-K202 PolarHBondContact O-N 3.39Å; Q200-K202 VanDerWaalsContact C-N 3.3Å; Q200-K202 PolarHBondContact O-N 3.13Å; K202-N205 PolarHBondContact O-N 3.04Å; K202-E206 IonicContact NZ-OE1 2.56Å; K202-E206 PolarHBondContact NZ-OE1 3.01Å; K202-E206 VanDerWaalsContact O-CG 3.32Å; K202-E206 WeakPolarHBondContact O-CG 3.49Å; K202-E206 PolarHBondContact O-N 3.36Å
203	K	98	Very high	97.6	Very high	94 Å²	94	53 Å²	53	41%	0.409	26%	0.255	S	S	.	.	H	α-helix	trans	-64.9	-38.5	176.4	-72.8	-177.7	169.3	-160.9	0	113	I169 K199 Q200 Q201 A207	I169-K203 HydrophobicContact CD1-CB 3.99Å; K199-K203 WeakPolarHBondContact O-CG 3.42Å; K199-K203 PolarHBondContact O-N 3.43Å; Q200-K203 PolarHBondContact O-N 2.67Å; Q201-K203 VanDerWaalsContact C-N 3.32Å; Q201-K203 PolarHBondContact O-N 3.2Å; K203-A207 VanDerWaalsContact O-CB 3.29Å; K203-A207 WeakPolarHBondContact O-CB 3.2Å; K203-A207 PolarHBondContact O-N 3.11Å
204	L	97.9	Very high	97.7	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-60.9	-50.7	173.9	-79.4	173.2	0	0	0	110.3	I161 I169 L177 F180 Q200 Q201 E206 A207 I208	I161-L204 HydrophobicContact CD1-CD1 3.75Å; I161-L204 HydrophobicContact CD1-CD2 4.2Å; I161-L204 HydrophobicContact CD1-CG 4.12Å; I169-L204 HydrophobicContact CD1-CD2 4Å; I169-L204 HydrophobicContact CD1-CG 3.86Å; I169-L204 HydrophobicContact CG1-CD2 3.91Å; I169-L204 HydrophobicContact CG1-CG 4.34Å; I169-L204 HydrophobicContact CG2-CD2 3.95Å; L177-L204 HydrophobicContact CD2-CD2 3.96Å; F180-L204 HydrophobicContact CD1-CD1 3.83Å; F180-L204 HydrophobicContact CD2-CD1 4.33Å; F180-L204 HydrophobicContact CD2-CD2 3.91Å; F180-L204 HydrophobicContact CE1-CD1 4.09Å; F180-L204 HydrophobicContact CE2-CD2 4.22Å; F180-L204 HydrophobicContact CG-CD1 3.96Å; F180-L204 HydrophobicContact CG-CD2 4.26Å; F180-L204 HydrophobicContact CZ-CD1 4.47Å; Q200-L204 WeakPolarHBondContact O-CG 3.28Å; Q200-L204 PolarHBondContact O-N 2.67Å; Q201-L204 WeakPolarHBondContact O-CB 3.39Å; Q201-L204 PolarHBondContact O-N 3.25Å; L204-E206 PolarHBondContact O-N 3.14Å; L204-A207 PolarHBondContact O-N 3.42Å; L204-A207 VanDerWaalsContact O-N 3.16Å; L204-I208 WeakPolarHBondContact O-CB 3.32Å; L204-I208 WeakPolarHBondContact O-CG1 3.32Å; L204-I208 PolarHBondContact O-N 3.38Å
205	N	98.1	Very high	97.7	Very high	61 Å²	61	55.7 Å²	55.7	33%	0.326	28%	0.284	S	S	.	.	H	α-helix	trans	-58.4	-48.9	178.4	-65.8	3.5	0	0	0	110.8	Q201 K202 A207 I208 D209	Q201-N205 PolarHBondContact NE2-OD1 3.15Å; Q201-N205 VanDerWaalsContact NE2-OD1 3.1Å; Q201-N205 VanDerWaalsContact O-CG 3.31Å; Q201-N205 PolarHBondContact O-N 2.96Å; Q201-N205 PolarHBondContact O-OD1 3.06Å; K202-N205 PolarHBondContact O-N 3.04Å; N205-A207 VanDerWaalsContact C-N 3.29Å; N205-A207 PolarHBondContact O-N 3.05Å; N205-I208 PolarHBondContact O-N 3.37Å; N205-D209 WeakPolarHBondContact O-CB 3.22Å; N205-D209 PolarHBondContact O-N 2.91Å
206	E	98.4	Very high	97.7	Very high	84 Å²	84	58.9 Å²	58.9	39%	0.393	30%	0.299	S	S	.	.	H	α-helix	trans	-58.6	-38.4	176.6	-72.5	168.5	-170.7	0	0	112.8	K202 L204 K210	K202-E206 IonicContact NZ-OE1 2.56Å; K202-E206 PolarHBondContact NZ-OE1 3.01Å; K202-E206 VanDerWaalsContact O-CG 3.32Å; K202-E206 WeakPolarHBondContact O-CG 3.49Å; K202-E206 PolarHBondContact O-N 3.36Å; L204-E206 PolarHBondContact O-N 3.14Å; E206-K210 WeakPolarHBondContact O-CB 3.31Å; E206-K210 WeakPolarHBondContact O-CG 3.14Å; E206-K210 PolarHBondContact O-N 2.62Å; E206-K210 VanDerWaalsContact O-N 3.13Å
207	A	98.1	Very high	97.6	Very high	8 Å²	8	59.3 Å²	59.3	7%	0.066	30%	0.301	C	S	.	.	H	α-helix	trans	-74.6	-34.9	178.3	0	0	0	0	0	112.9	I169 L177 K203 L204 N205 A211	I169-A207 HydrophobicContact CG2-CB 3.66Å; L177-A207 HydrophobicContact CD1-CB 4.45Å; L177-A207 HydrophobicContact CD2-CB 4.27Å; K203-A207 VanDerWaalsContact O-CB 3.29Å; K203-A207 WeakPolarHBondContact O-CB 3.2Å; K203-A207 PolarHBondContact O-N 3.11Å; L204-A207 PolarHBondContact O-N 3.42Å; L204-A207 VanDerWaalsContact O-N 3.16Å; N205-A207 VanDerWaalsContact C-N 3.29Å; N205-A207 PolarHBondContact O-N 3.05Å; A207-A211 VanDerWaalsContact O-CB 3.24Å; A207-A211 WeakPolarHBondContact O-CB 3.38Å; A207-A211 PolarHBondContact O-N 2.9Å
208	I	98.1	Very high	97.4	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-68.8	-45.4	175.5	-69.7	167.4	0	0	0	110.1	L177 I181 V188 L204 N205 A211 R212 L217	L177-I208 HydrophobicContact CB-CG1 4.23Å; L177-I208 HydrophobicContact CD1-CG1 4.23Å; L177-I208 HydrophobicContact CD2-CG1 3.97Å; L177-I208 HydrophobicContact CG-CG1 4.36Å; I181-I208 HydrophobicContact CD1-CD1 4.16Å; I181-I208 HydrophobicContact CD1-CG1 4.26Å; I181-I208 HydrophobicContact CD1-CG2 4.04Å; I181-I208 HydrophobicContact CG1-CD1 4.05Å; V188-I208 HydrophobicContact CG1-CD1 3.94Å; V188-I208 HydrophobicContact CG2-CD1 3.76Å; V188-I208 HydrophobicContact CG2-CG2 4.2Å; L204-I208 WeakPolarHBondContact O-CB 3.32Å; L204-I208 WeakPolarHBondContact O-CG1 3.32Å; L204-I208 PolarHBondContact O-N 3.38Å; N205-I208 PolarHBondContact O-N 3.37Å; I208-A211 PolarHBondContact O-N 2.89Å; I208-R212 WeakPolarHBondContact O-CG 3.25Å; I208-R212 PolarHBondContact O-N 2.9Å; I208-L217 HydrophobicContact CG2-CD1 4.18Å
209	D	97.5	Very high	97.2	Very high	79 Å²	79	66.4 Å²	66.4	42%	0.422	34%	0.343	S	S	.	.	H	α-helix	trans	-60.3	-48	177.5	-65.5	-24.2	0	0	0	109.8	N205 A211 R212 D213	N205-D209 WeakPolarHBondContact O-CB 3.22Å; N205-D209 PolarHBondContact O-N 2.91Å; D209-A211 PolarHBondContact O-N 2.99Å; D209-R212 WeakPolarHBondContact O-CB 3.03Å; D209-R212 PolarHBondContact O-N 3.22Å; D209-R212 VanDerWaalsContact O-N 3.11Å; D209-D213 VanDerWaalsContact O-CG 3.23Å; D209-D213 PolarHBondContact O-N 3.21Å
210	K	98.3	Very high	97	Very high	119 Å²	119	69.5 Å²	69.5	52%	0.517	36%	0.359	S	S	.	.	H	α-helix	trans	-58.3	-44.5	173.1	-74.4	176	-178.6	-170.5	0	113.3	H171 E206 R212 D213 D214	H171-K210 HydrophobicContact CB-CB 4Å; E206-K210 WeakPolarHBondContact O-CB 3.31Å; E206-K210 WeakPolarHBondContact O-CG 3.14Å; E206-K210 PolarHBondContact O-N 2.62Å; E206-K210 VanDerWaalsContact O-N 3.13Å; K210-R212 PolarHBondContact O-N 3.46Å; K210-D213 PolarHBondContact O-N 3.02Å; K210-D214 WeakPolarHBondContact O-CB 3.46Å; K210-D214 PolarHBondContact O-N 3.46Å
211	A	98	Very high	96.8	Very high	0 Å²	0	74.3 Å²	74.3	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-66.2	-26.5	178.8	0	0	0	0	0	113	H171 L177 A207 I208 D209 G215 L216 L217	H171-A211 HydrophobicContact CB-CB 4.2Å; H171-A211 WeakPolarHBondContact O-CB 2.97Å; L177-A211 HydrophobicContact CD1-CB 4Å; A207-A211 VanDerWaalsContact O-CB 3.24Å; A207-A211 WeakPolarHBondContact O-CB 3.38Å; A207-A211 PolarHBondContact O-N 2.9Å; I208-A211 PolarHBondContact O-N 2.89Å; D209-A211 PolarHBondContact O-N 2.99Å; A211-G215 PolarHBondContact O-N 3.45Å; A211-L216 HydrophobicContact CB-CB 4.39Å; A211-L216 PolarHBondContact O-N 3.33Å; A211-L217 HydrophobicContact CB-CB 4.41Å; A211-L217 HydrophobicContact CB-CD1 3.74Å; A211-L217 HydrophobicContact CB-CG 3.99Å; A211-L217 PolarHBondContact O-N 3.28Å; A211-L217 VanDerWaalsContact O-N 3.1Å
212	R	97	Very high	96.6	Very high	58 Å²	58	78.4 Å²	78.4	22%	0.219	41%	0.412	C	S	.	.	H	α-helix	trans	-74.3	-43.4	171.1	-72.3	170.7	176.6	-179.8	-4.7	111.2	G186 I208 D209 K210 D214 G215 L217 F219	G186-R212 PolarHBondContact O-NH2 3.46Å; I208-R212 WeakPolarHBondContact O-CG 3.25Å; I208-R212 PolarHBondContact O-N 2.9Å; D209-R212 WeakPolarHBondContact O-CB 3.03Å; D209-R212 PolarHBondContact O-N 3.22Å; D209-R212 VanDerWaalsContact O-N 3.11Å; K210-R212 PolarHBondContact O-N 3.46Å; R212-D214 VanDerWaalsContact C-N 3.3Å; R212-D214 PolarHBondContact O-N 2.94Å; R212-G215 PolarHBondContact O-N 3.25Å; R212-G215 VanDerWaalsContact O-N 3.07Å; R212-L217 HydrophobicContact CG-CB 4.22Å; R212-F219 HydrophobicContact CB-CD1 3.89Å; R212-F219 HydrophobicContact CB-CE1 3.8Å; R212-F219 HydrophobicContact CG-CD1 3.78Å; R212-F219 HydrophobicContact CG-CE1 4.22Å; R212-F219 HydrophobicContact CG-CG 4.32Å
213	D	97.3	Very high	96.4	Very high	135 Å²	135	79.7 Å²	79.7	72%	0.722	42%	0.419	S	S	*	.	H	α-helix	trans	-61.3	-40.4	176.3	-63	-23.7	0	0	0	111.3	D209 K210 G215	D209-D213 VanDerWaalsContact O-CG 3.23Å; D209-D213 PolarHBondContact O-N 3.21Å; K210-D213 PolarHBondContact O-N 3.02Å; D213-G215 PolarHBondContact O-N 2.97Å
214	D	97.1	Very high	96.2	Very high	96 Å²	96	79.1 Å²	79.1	51%	0.513	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-8.4	176.5	-64.4	-25.4	0	0	0	113.1	H171 K210 R212 L216	H171-D214 IonicContact CD2-OD2 3.98Å; H171-D214 PolarHBondContact CD2-OD2 3.09Å; H171-D214 IonicContact CG-OD2 2.62Å; H171-D214 IonicContact NE2-OD2 2.67Å; K210-D214 WeakPolarHBondContact O-CB 3.46Å; K210-D214 PolarHBondContact O-N 3.46Å; R212-D214 VanDerWaalsContact C-N 3.3Å; R212-D214 PolarHBondContact O-N 2.94Å; D214-L216 VanDerWaalsContact C-N 3.29Å; D214-L216 HydrophobicContact CB-CD1 4.29Å; D214-L216 HydrophobicContact CB-CG 4.05Å; D214-L216 PolarHBondContact O-N 3.43Å
215	G	96.5	Very high	95.8	Very high	62 Å²	62	84.6 Å²	84.6	64%	0.639	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	14.6	-177.6	0	0	0	0	0	115.2	A211 R212 D213	A211-G215 PolarHBondContact O-N 3.45Å; R212-G215 PolarHBondContact O-N 3.25Å; R212-G215 VanDerWaalsContact O-N 3.07Å; D213-G215 PolarHBondContact O-N 2.97Å
216	L	96.6	Very high	95.4	Very high	76 Å²	76	88.2 Å²	88.2	40%	0.398	47%	0.466	S	S	.	.			trans	-76.8	-32.6	177.5	-62.1	177	0	0	0	112.7	Q172 V174 A211 D214	Q172-L216 HydrophobicContact CG-CD1 4.43Å; V174-L216 HydrophobicContact CG2-CB 3.96Å; A211-L216 HydrophobicContact CB-CB 4.39Å; A211-L216 PolarHBondContact O-N 3.33Å; D214-L216 VanDerWaalsContact C-N 3.29Å; D214-L216 HydrophobicContact CB-CD1 4.29Å; D214-L216 HydrophobicContact CB-CG 4.05Å; D214-L216 PolarHBondContact O-N 3.43Å
217	L	96	Very high	94.7	Very high	10 Å²	10	89.7 Å²	89.7	5%	0.052	49%	0.486	C	S	.	.	S	Bend	trans	-105.3	125.9	177.5	-81.7	174.8	0	0	0	111.1	V174 L177 I181 I208 A211 R212	V174-L217 HydrophobicContact CG1-CD2 3.81Å; L177-L217 HydrophobicContact CB-CD1 4.15Å; L177-L217 HydrophobicContact CD1-CD1 4.11Å; I181-L217 HydrophobicContact CD1-CD1 3.85Å; I181-L217 HydrophobicContact CD1-CD2 4.43Å; I208-L217 HydrophobicContact CG2-CD1 4.18Å; A211-L217 HydrophobicContact CB-CB 4.41Å; A211-L217 HydrophobicContact CB-CD1 3.74Å; A211-L217 HydrophobicContact CB-CG 3.99Å; A211-L217 PolarHBondContact O-N 3.28Å; A211-L217 VanDerWaalsContact O-N 3.1Å; R212-L217 HydrophobicContact CG-CB 4.22Å
218	P	93.1	Very high	93.9	Very high	125 Å²	125	93 Å²	93	81%	0.812	52%	0.521	S	S	*	.			trans	-71.1	136.7	173.6	29.7	-33.5	0	0	0	110.5
219	F	94.4	Very high	93.2	Very high	98 Å²	98	99.1 Å²	99.1	43%	0.43	55%	0.549	S	S	.	.			trans	-143.9	160.6	171.7	68.5	-79.9	0	0	0	110.3	R212 I221	R212-F219 HydrophobicContact CB-CD1 3.89Å; R212-F219 HydrophobicContact CB-CE1 3.8Å; R212-F219 HydrophobicContact CG-CD1 3.78Å; R212-F219 HydrophobicContact CG-CE1 4.22Å; R212-F219 HydrophobicContact CG-CG 4.32Å; F219-I221 HydrophobicContact CD2-CG1 3.91Å; F219-I221 HydrophobicContact CE1-CD1 4.43Å; F219-I221 HydrophobicContact CE2-CD1 4Å; F219-I221 HydrophobicContact CE2-CG1 3.39Å; F219-I221 HydrophobicContact CZ-CD1 3.81Å; F219-I221 HydrophobicContact CZ-CG1 3.75Å; F219-I221 PolarHBondContact O-N 3.28Å
220	Q	92.1	Very high	92.7	Very high	177 Å²	177	102.8 Å²	102.8	83%	0.827	57%	0.569	S	S	*	*			trans	-79.3	120.9	179.3	-68	-174.8	-42.5	0	0	110.2
221	I	93.9	Very high	92	Very high	130 Å²	130	104 Å²	104	67%	0.667	57%	0.571	S	S	*	*			trans	-105	114.1	172.2	-59.4	170.3	0	0	0	106.9	F219	F219-I221 HydrophobicContact CD2-CG1 3.91Å; F219-I221 HydrophobicContact CE1-CD1 4.43Å; F219-I221 HydrophobicContact CE2-CD1 4Å; F219-I221 HydrophobicContact CE2-CG1 3.39Å; F219-I221 HydrophobicContact CZ-CD1 3.81Å; F219-I221 HydrophobicContact CZ-CG1 3.75Å; F219-I221 PolarHBondContact O-N 3.28Å
222	P	93.8	Very high	91.6	Very high	101 Å²	101	107.5 Å²	107.5	66%	0.656	60%	0.596	S	S	*	*			trans	-66.9	141.9	175.6	28.5	-33.2	0	0	0	109.8
223	H	94.7	Very high	91.2	Very high	160 Å²	160	111 Å²	111	74%	0.741	62%	0.619	S	S	*	*			trans	-67.5	134.6	166.5	-170	64.1	0	0	0	109	D225	H223-D225 IonicContact CD2-OD1 3.58Å; H223-D225 PolarHBondContact CD2-OD1 3.28Å; H223-D225 VanDerWaalsContact CD2-OD1 3.22Å; H223-D225 IonicContact NE2-OD1 3.6Å; H223-D225 PolarHBondContact NE2-OD1 3.18Å
224	V	92.9	Very high	90.8	Very high	82 Å²	82	110.3 Å²	110.3	50%	0.497	62%	0.62	S	S	.	*			trans	-120.7	114.5	177	-179.7	0	0	0	0	107.1	F226	V224-F226 HydrophobicContact CB-CZ 4.46Å; V224-F226 HydrophobicContact CG1-CE1 4.23Å; V224-F226 HydrophobicContact CG1-CE2 4.49Å; V224-F226 HydrophobicContact CG1-CZ 4.11Å; V224-F226 WeakPolarHBondContact O-CD2 3.22Å; V224-F226 WeakPolarHBondContact O-CE2 3.5Å
225	D	90.9	Very high	90.4	Very high	116 Å²	116	112 Å²	112	62%	0.62	62%	0.624	S	S	*	*			trans	-81.1	133.5	176.1	-66.2	-53.5	0	0	0	110.1	H223	H223-D225 IonicContact CD2-OD1 3.58Å; H223-D225 PolarHBondContact CD2-OD1 3.28Å; H223-D225 VanDerWaalsContact CD2-OD1 3.22Å; H223-D225 IonicContact NE2-OD1 3.6Å; H223-D225 PolarHBondContact NE2-OD1 3.18Å
226	F	88.2	Confident	90.1	Very high	137 Å²	137	114.6 Å²	114.6	60%	0.601	62%	0.624	S	S	*	*			trans	-108	19.1	175.9	-55.2	-87.4	0	0	0	112.9	V224 G228 Y231	V224-F226 HydrophobicContact CB-CZ 4.46Å; V224-F226 HydrophobicContact CG1-CE1 4.23Å; V224-F226 HydrophobicContact CG1-CE2 4.49Å; V224-F226 HydrophobicContact CG1-CZ 4.11Å; V224-F226 WeakPolarHBondContact O-CD2 3.22Å; V224-F226 WeakPolarHBondContact O-CE2 3.5Å; F226-G228 PolarHBondContact O-N 3.39Å; F226-Y231 WeakPolarHBondContact CB-OH 3.23Å; F226-Y231 PolarHBondContact O-OH 3.28Å
227	S	83.3	Confident	89.8	Confident	114 Å²	114	114.9 Å²	114.9	80%	0.797	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	9.2	-170.3	53.9	0	0	0	0	116.6
228	G	82	Confident	89.6	Confident	78 Å²	78	119.1 Å²	119.1	80%	0.804	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	-0.5	-179.1	0	0	0	0	0	115.5	F226	F226-G228 PolarHBondContact O-N 3.39Å
229	E	83.3	Confident	89.3	Confident	128 Å²	128	114.9 Å²	114.9	60%	0.598	64%	0.642	S	S	*	*	S	Bend	trans	-117.3	141.1	-174.6	-59.7	175.3	167.8	0	0	111.6	Y231	E229-Y231 HydrophobicContact CB-CE1 4.23Å; E229-Y231 HydrophobicContact CB-CE2 4.16Å; E229-Y231 VanDerWaalsContact O-CD2 3.27Å; E229-Y231 WeakPolarHBondContact O-CD2 3.49Å; E229-Y231 WeakPolarHBondContact O-CE2 3.04Å; E229-Y231 PolarHBondContact O-N 2.9Å; E229-Y231 PolarHBondContact OE2-OH 3.41Å
230	D	86.7	Confident	89	Confident	156 Å²	156	118.8 Å²	118.8	83%	0.834	67%	0.666	S	S	*	*			trans	-78.8	103.3	172.9	-65.5	-34.7	0	0	0	109.5	S232	D230-S232 PolarHBondContact O-N 3.43Å
231	Y	85.1	Confident	88.7	Confident	144 Å²	144	115.5 Å²	115.5	57%	0.565	66%	0.659	S	S	*	*			trans	-77.8	38.7	179.9	-65.6	-70.7	0	0	0	114.1	F226 E229	F226-Y231 WeakPolarHBondContact CB-OH 3.23Å; F226-Y231 PolarHBondContact O-OH 3.28Å; E229-Y231 HydrophobicContact CB-CE1 4.23Å; E229-Y231 HydrophobicContact CB-CE2 4.16Å; E229-Y231 VanDerWaalsContact O-CD2 3.27Å; E229-Y231 WeakPolarHBondContact O-CD2 3.49Å; E229-Y231 WeakPolarHBondContact O-CE2 3.04Å; E229-Y231 PolarHBondContact O-N 2.9Å; E229-Y231 PolarHBondContact OE2-OH 3.41Å
232	S	88.7	Confident	88.3	Confident	75 Å²	75	114 Å²	114	52%	0.524	66%	0.66	S	S	.	*			trans	-91.7	115.8	175.8	65.2	0	0	0	0	111.1	D230 T234	D230-S232 PolarHBondContact O-N 3.43Å; S232-T234 PolarHBondContact O-N 3.1Å
233	N	88.6	Confident	87.8	Confident	131 Å²	131	114.5 Å²	114.5	70%	0.701	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	29.4	172.7	-68.8	-30.8	0	0	0	113
234	T	88.1	Confident	87.4	Confident	121 Å²	121	108.7 Å²	108.7	74%	0.742	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-13.9	-177	-49.2	0	0	0	0	112.4	S232	S232-T234 PolarHBondContact O-N 3.1Å
235	H	89.9	Confident	86.5	Confident	130 Å²	130	111.2 Å²	111.2	60%	0.602	66%	0.657	S	S	*	*	S	Bend	trans	-72.8	133.8	-179.6	-172.5	-94	0	0	0	111.8	A237 V238 G239	H235-A237 VanDerWaalsContact CE1-CB 3.5Å; H235-A237 WeakPolarHBondContact CE1-CB 3.5Å; H235-A237 WeakPolarHBondContact ND1-CB 3.38Å; H235-A237 PolarHBondContact ND1-N 3.06Å; H235-A237 PolarHBondContact O-N 3.12Å; H235-V238 PolarHBondContact O-N 3.31Å; H235-G239 PolarHBondContact O-N 3.11Å
236	D	89.4	Confident	85.7	Confident	118 Å²	118	112 Å²	112	63%	0.631	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	-21	-174.6	-66.9	-26.4	0	0	0	114.8	V238 T241	D236-V238 VanDerWaalsContact C-N 3.31Å; D236-T241 PolarHBondContact O-OG1 3.38Å
237	A	89.8	Confident	84.8	Confident	81 Å²	81	107.1 Å²	107.1	67%	0.669	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-25.2	175.7	0	0	0	0	0	113.7	H235	H235-A237 VanDerWaalsContact CE1-CB 3.5Å; H235-A237 WeakPolarHBondContact CE1-CB 3.5Å; H235-A237 WeakPolarHBondContact ND1-CB 3.38Å; H235-A237 PolarHBondContact ND1-N 3.06Å; H235-A237 PolarHBondContact O-N 3.12Å
238	V	91.6	Very high	84.4	Confident	100 Å²	100	103.3 Å²	103.3	61%	0.606	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	-30	174.7	-170.8	0	0	0	0	110.1	H235 D236	H235-V238 PolarHBondContact O-N 3.31Å; D236-V238 VanDerWaalsContact C-N 3.31Å
239	G	87.7	Confident	84	Confident	36 Å²	36	106.9 Å²	106.9	37%	0.371	62%	0.623	S	S	.	*	S	Bend	trans	-75.5	175.7	176.4	0	0	0	0	0	114.2	H235 T241	H235-G239 PolarHBondContact O-N 3.11Å; G239-T241 PolarHBondContact O-N 3.08Å
240	L	87.4	Confident	83.7	Confident	179 Å²	179	106.6 Å²	106.6	94%	0.937	64%	0.635	S	S	*	*			trans	-73.1	112.8	169.3	-64.6	174.8	0	0	0	109.1	S242	L240-S242 PolarHBondContact O-N 3.07Å
241	T	87.1	Confident	83.5	Confident	109 Å²	109	104.9 Å²	104.9	67%	0.669	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-72.4	124.8	169.8	-46.2	0	0	0	0	108.8	D236 G239	D236-T241 PolarHBondContact O-OG1 3.38Å; G239-T241 PolarHBondContact O-N 3.08Å
242	S	84.9	Confident	83.6	Confident	98 Å²	98	100.5 Å²	100.5	69%	0.685	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-56.7	137.8	176.9	55	0	0	0	0	110.6	L240	L240-S242 PolarHBondContact O-N 3.07Å
243	P	84.1	Confident	83.4	Confident	111 Å²	111	103.6 Å²	103.6	72%	0.721	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-62.6	145	178.1	27.5	-34	0	0	0	110
244	P	84.8	Confident	83.4	Confident	39 Å²	39	103 Å²	103	25%	0.253	60%	0.601	S	S	.	*	P	Polyproline II helix	trans	-59.9	138.2	177.5	22.6	-31.6	0	0	0	110.5	F246 L247 W253	P244-F246 HydrophobicContact CB-CE1 4.29Å; P244-F246 HydrophobicContact CB-CZ 4.36Å; P244-F246 PolarHBondContact O-N 3.07Å; P244-L247 HydrophobicContact CB-CD1 4.34Å; P244-L247 HydrophobicContact CB-CG 4.46Å; P244-L247 HydrophobicContact CG-CB 4.02Å; P244-L247 HydrophobicContact CG-CD1 3.59Å; P244-L247 HydrophobicContact CG-CG 3.98Å; P244-L247 PolarHBondContact O-N 3.49Å; P244-W253 HydrophobicContact CB-CH2 4.38Å; P244-W253 HydrophobicContact CB-CZ3 4.42Å; P244-W253 HydrophobicContact CG-CH2 4.21Å; P244-W253 HydrophobicContact CG-CZ3 3.79Å
245	P	75.5	Confident	83.2	Confident	134 Å²	134	106.4 Å²	106.4	87%	0.87	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-13.5	-167	25.1	-33.9	0	0	0	114.6
246	F	72.9	Confident	83.2	Confident	132 Å²	132	108 Å²	108	58%	0.579	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	0.1	-173.6	58.1	-95.9	0	0	0	114.1	P244	P244-F246 HydrophobicContact CB-CE1 4.29Å; P244-F246 HydrophobicContact CB-CZ 4.36Å; P244-F246 PolarHBondContact O-N 3.07Å
247	L	70.1	Confident	83.2	Confident	36 Å²	36	108.9 Å²	108.9	19%	0.188	60%	0.601	C	S	.	*			trans	-104.8	115.4	177.2	-61.3	177.4	0	0	0	109.7	P244 E251 P252 W253	P244-L247 HydrophobicContact CB-CD1 4.34Å; P244-L247 HydrophobicContact CB-CG 4.46Å; P244-L247 HydrophobicContact CG-CB 4.02Å; P244-L247 HydrophobicContact CG-CD1 3.59Å; P244-L247 HydrophobicContact CG-CG 3.98Å; P244-L247 PolarHBondContact O-N 3.49Å; L247-E251 HydrophobicContact CD2-CB 4.42Å; L247-P252 WeakPolarHBondContact CD2-O 3.35Å; L247-W253 HydrophobicContact CD1-CB 4.32Å; L247-W253 HydrophobicContact CD1-CD2 3.89Å; L247-W253 HydrophobicContact CD1-CE3 3.39Å; L247-W253 HydrophobicContact CD1-CG 4.31Å; L247-W253 HydrophobicContact CD1-CZ3 3.94Å
248	G	75.1	Confident	83	Confident	33 Å²	33	106.5 Å²	106.5	34%	0.34	58%	0.584	S	S	.	*			trans	-62.1	161.4	162.2	0	0	0	0	0	110.9	S250 E251	G248-S250 PolarHBondContact O-N 2.9Å; G248-E251 PolarHBondContact O-N 3.44Å
249	P	72.8	Confident	82.8	Confident	153 Å²	153	111.1 Å²	111.1	99%	0.994	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	-20.5	-172.8	-27	33.9	0	0	0	116.2
250	S	77	Confident	82.9	Confident	122 Å²	122	114.4 Å²	114.4	85%	0.853	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.3	16.4	179.6	92	0	0	0	0	114.1	G248	G248-S250 PolarHBondContact O-N 2.9Å
251	E	83.6	Confident	83	Confident	120 Å²	120	111.9 Å²	111.9	56%	0.561	60%	0.6	S	S	*	*			trans	-90.3	135	-179.7	-160.3	169.1	179	0	0	110.7	L247 G248	L247-E251 HydrophobicContact CD2-CB 4.42Å; G248-E251 PolarHBondContact O-N 3.44Å
252	P	86.6	Confident	83.2	Confident	53 Å²	53	110.7 Å²	110.7	34%	0.344	59%	0.594	S	S	.	*			trans	-65.7	147.2	178.9	25.8	-33.8	0	0	0	111.7	L247 Y254 Y257	L247-P252 WeakPolarHBondContact CD2-O 3.35Å; P252-Y254 PolarHBondContact O-N 3.33Å; P252-Y254 VanDerWaalsContact O-N 3.11Å; P252-Y257 HydrophobicContact CB-CD2 4.27Å
253	W	84.4	Confident	83.7	Confident	140 Å²	140	110.6 Å²	110.6	53%	0.53	59%	0.586	S	S	.	*	S	Bend	trans	-54	-36.4	-177.2	-170.2	-81.4	0	0	0	114.4	P244 L247	P244-W253 HydrophobicContact CB-CH2 4.38Å; P244-W253 HydrophobicContact CB-CZ3 4.42Å; P244-W253 HydrophobicContact CG-CH2 4.21Å; P244-W253 HydrophobicContact CG-CZ3 3.79Å; L247-W253 HydrophobicContact CD1-CB 4.32Å; L247-W253 HydrophobicContact CD1-CD2 3.89Å; L247-W253 HydrophobicContact CD1-CE3 3.39Å; L247-W253 HydrophobicContact CD1-CG 4.31Å; L247-W253 HydrophobicContact CD1-CZ3 3.94Å
254	Y	87.9	Confident	84.1	Confident	119 Å²	119	111 Å²	111	47%	0.467	58%	0.582	S	S	.	*	S	Bend	trans	-122.5	143.5	172.7	-58.5	-69.3	0	0	0	110.3	P252 W256 Y257	P252-Y254 PolarHBondContact O-N 3.33Å; P252-Y254 VanDerWaalsContact O-N 3.11Å; Y254-W256 VanDerWaalsContact CB-NE1 3.26Å; Y254-W256 HydrophobicContact CD2-CZ2 4.22Å; Y254-W256 AromaticContact CD2-NE1 4Å; Y254-W256 AromaticContact CG-NE1 3.63Å; Y254-W256 PolarHBondContact O-N 3.15Å; Y254-Y257 HydrophobicContact CD2-CD2 4.39Å; Y254-Y257 AromaticContact CD2-CE2 3.71Å; Y254-Y257 HydrophobicContact CD2-CE2 3.71Å; Y254-Y257 AromaticContact CD2-CZ 3.95Å; Y254-Y257 WeakPolarHBondContact O-CB 3.49Å; Y254-Y257 PolarHBondContact O-N 3.14Å; Y254-Y257 VanDerWaalsContact O-N 3.08Å
255	K	85.1	Confident	84.6	Confident	191 Å²	191	117 Å²	117	83%	0.83	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-53.8	-31.6	179.7	-171.8	172.5	-178	174.2	0	114.1	Y257 G258	K255-Y257 VanDerWaalsContact C-N 3.31Å; K255-Y257 PolarHBondContact O-N 3.33Å; K255-G258 PolarHBondContact O-N 3.1Å
256	W	88.9	Confident	85.4	Confident	164 Å²	164	116.7 Å²	116.7	62%	0.621	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-80.8	-4.7	-176.7	62.5	-94.5	0	0	0	115.2	Y254 I260	Y254-W256 VanDerWaalsContact CB-NE1 3.26Å; Y254-W256 HydrophobicContact CD2-CZ2 4.22Å; Y254-W256 AromaticContact CD2-NE1 4Å; Y254-W256 AromaticContact CG-NE1 3.63Å; Y254-W256 PolarHBondContact O-N 3.15Å; W256-I260 HydrophobicContact CB-CD1 4.08Å
257	Y	89.8	Confident	86.3	Confident	136 Å²	136	112.2 Å²	112.2	53%	0.533	57%	0.572	S	S	.	*	G	3₁₀ helix	trans	-80.2	-21.2	167.6	-69.2	-27	0	0	0	112.8	P252 Y254 K255	P252-Y257 HydrophobicContact CB-CD2 4.27Å; Y254-Y257 HydrophobicContact CD2-CD2 4.39Å; Y254-Y257 AromaticContact CD2-CE2 3.71Å; Y254-Y257 HydrophobicContact CD2-CE2 3.71Å; Y254-Y257 AromaticContact CD2-CZ 3.95Å; Y254-Y257 WeakPolarHBondContact O-CB 3.49Å; Y254-Y257 PolarHBondContact O-N 3.14Å; Y254-Y257 VanDerWaalsContact O-N 3.08Å; K255-Y257 VanDerWaalsContact C-N 3.31Å; K255-Y257 PolarHBondContact O-N 3.33Å
258	G	85.9	Confident	87.4	Confident	31 Å²	31	114.8 Å²	114.8	32%	0.32	59%	0.586	S	S	.	*	S	Bend	trans	-74.8	166	173.8	0	0	0	0	0	112.2	K255 I260	K255-G258 PolarHBondContact O-N 3.1Å; G258-I260 PolarHBondContact O-N 3.44Å; G258-I260 VanDerWaalsContact O-N 3.15Å
259	E	87.2	Confident	88.3	Confident	197 Å²	197	118.2 Å²	118.2	92%	0.921	59%	0.594	S	S	*	*			trans	-66.8	113.2	172.3	-170.8	167.8	-166.2	0	0	109.5
260	I	90	Very high	89.3	Confident	106 Å²	106	114.6 Å²	114.6	54%	0.544	57%	0.568	S	S	.	*			trans	-103.7	121	174.8	-61.2	167.5	0	0	0	107.6	W256 G258 P262	W256-I260 HydrophobicContact CB-CD1 4.08Å; G258-I260 PolarHBondContact O-N 3.44Å; G258-I260 VanDerWaalsContact O-N 3.15Å; I260-P262 VanDerWaalsContact O-CD 3.25Å; I260-P262 WeakPolarHBondContact O-CD 3.25Å
261	T	89.9	Confident	90	Very high	126 Å²	126	113.7 Å²	113.7	77%	0.773	55%	0.549	S	S	*	.			trans	-75.2	112.2	167.6	51.4	0	0	0	0	109.1
262	P	90.9	Very high	90.5	Very high	84 Å²	84	116.4 Å²	116.4	55%	0.545	56%	0.559	S	S	.	*			trans	-69.8	153.6	179.2	30.6	-35.6	0	0	0	111.3	I260 D264 V267	I260-P262 VanDerWaalsContact O-CD 3.25Å; I260-P262 WeakPolarHBondContact O-CD 3.25Å; P262-D264 PolarHBondContact O-N 3.4Å; P262-V267 HydrophobicContact CB-CG2 3.77Å; P262-V267 HydrophobicContact CG-CG2 3.5Å
263	D	95	Very high	90.9	Very high	95 Å²	95	119.2 Å²	119.2	51%	0.508	57%	0.57	S	S	.	*			trans	-64.9	128.2	173.5	176.7	19.5	0	0	0	110.9	K265 K266 V267	D263-K265 PolarHBondContact O-N 3.42Å; D263-K265 VanDerWaalsContact O-N 3.15Å; D263-K265 PolarHBondContact OD1-N 2.93Å; D263-K266 HydrophobicContact CB-CG 4.34Å; D263-K266 WeakPolarHBondContact O-CB 3.32Å; D263-K266 PolarHBondContact O-N 3.15Å; D263-V267 PolarHBondContact O-N 3.05Å
264	D	93.4	Very high	91.4	Very high	121 Å²	121	118.9 Å²	118.9	65%	0.647	57%	0.569	S	S	*	*	H	α-helix	trans	-54.7	-37.2	-175.9	-67.3	-35.3	0	0	0	112	P262 K266 V267 D268	P262-D264 PolarHBondContact O-N 3.4Å; D264-K266 VanDerWaalsContact C-N 3.29Å; D264-K266 PolarHBondContact O-N 3.35Å; D264-V267 WeakPolarHBondContact O-CB 3.34Å; D264-V267 PolarHBondContact O-N 3.48Å; D264-D268 WeakPolarHBondContact O-CB 3.44Å; D264-D268 VanDerWaalsContact O-CG 3.31Å; D264-D268 PolarHBondContact O-N 2.97Å
265	K	94.8	Very high	91.5	Very high	165 Å²	165	121.4 Å²	121.4	72%	0.717	58%	0.583	S	S	*	*	H	α-helix	trans	-61	-38.3	177.5	-66.1	178.8	-179.3	174.5	0	112.5	D263 Q269	D263-K265 PolarHBondContact O-N 3.42Å; D263-K265 VanDerWaalsContact O-N 3.15Å; D263-K265 PolarHBondContact OD1-N 2.93Å; K265-Q269 WeakPolarHBondContact O-CB 3.48Å; K265-Q269 PolarHBondContact O-N 3.16Å
266	K	92.1	Very high	91.8	Very high	126 Å²	126	116.5 Å²	116.5	55%	0.548	58%	0.578	S	S	.	*	H	α-helix	trans	-75.6	-38.4	178.6	-65.6	-65	-175.4	179.3	0	110.8	D263 D264 D268 Q269 V270	D263-K266 HydrophobicContact CB-CG 4.34Å; D263-K266 WeakPolarHBondContact O-CB 3.32Å; D263-K266 PolarHBondContact O-N 3.15Å; D264-K266 VanDerWaalsContact C-N 3.29Å; D264-K266 PolarHBondContact O-N 3.35Å; K266-D268 VanDerWaalsContact C-N 3.31Å; K266-D268 PolarHBondContact O-N 3.32Å; K266-Q269 PolarHBondContact O-N 3.18Å; K266-V270 VanDerWaalsContact O-CG2 3.32Å; K266-V270 WeakPolarHBondContact O-CG2 3.31Å; K266-V270 PolarHBondContact O-N 3.06Å
267	V	92.8	Very high	91.8	Very high	38 Å²	38	117.9 Å²	117.9	23%	0.23	59%	0.585	C	S	.	*	H	α-helix	trans	-59.5	-44.9	172.8	177	0	0	0	0	110.4	P262 D263 D264 V270 K271	P262-V267 HydrophobicContact CB-CG2 3.77Å; P262-V267 HydrophobicContact CG-CG2 3.5Å; D263-V267 PolarHBondContact O-N 3.05Å; D264-V267 WeakPolarHBondContact O-CB 3.34Å; D264-V267 PolarHBondContact O-N 3.48Å; V267-V270 PolarHBondContact O-N 2.84Å; V267-K271 HydrophobicContact CG1-CD 4.04Å; V267-K271 VanDerWaalsContact CG1-CE 3.48Å; V267-K271 HydrophobicContact CG1-CG 4.34Å; V267-K271 WeakPolarHBondContact O-CB 3.37Å; V267-K271 VanDerWaalsContact O-CG 3.31Å; V267-K271 WeakPolarHBondContact O-CG 3.43Å; V267-K271 PolarHBondContact O-N 3.22Å
268	D	92.9	Very high	91.9	Very high	91 Å²	91	115.1 Å²	115.1	49%	0.487	58%	0.579	S	S	.	*	H	α-helix	trans	-66.4	-39.6	178.4	-72.1	-17.5	0	0	0	112.6	D264 K266 V270 K271 K272	D264-D268 WeakPolarHBondContact O-CB 3.44Å; D264-D268 VanDerWaalsContact O-CG 3.31Å; D264-D268 PolarHBondContact O-N 2.97Å; K266-D268 VanDerWaalsContact C-N 3.31Å; K266-D268 PolarHBondContact O-N 3.32Å; D268-V270 VanDerWaalsContact C-N 3.34Å; D268-V270 PolarHBondContact O-N 3.38Å; D268-K271 PolarHBondContact O-N 2.81Å; D268-K271 IonicContact OD1-NZ 3.82Å; D268-K272 WeakPolarHBondContact O-CB 3.47Å; D268-K272 PolarHBondContact O-N 3.26Å
269	Q	94	Very high	91.7	Very high	105 Å²	105	123.4 Å²	123.4	49%	0.491	61%	0.606	S	S	.	*	H	α-helix	trans	-58.1	-46.3	172.1	-173.9	177.6	14	0	0	111.2	K265 K266 K272 I273	K265-Q269 WeakPolarHBondContact O-CB 3.48Å; K265-Q269 PolarHBondContact O-N 3.16Å; K266-Q269 PolarHBondContact O-N 3.18Å; Q269-K272 PolarHBondContact O-N 3.47Å; Q269-I273 HydrophobicContact CG-CD1 4.31Å; Q269-I273 WeakPolarHBondContact O-CG1 3.3Å; Q269-I273 PolarHBondContact O-N 3.03Å; Q269-I273 VanDerWaalsContact O-N 3.16Å
270	V	92.9	Very high	90.8	Very high	77 Å²	77	126.2 Å²	126.2	47%	0.467	62%	0.618	S	S	.	*	H	α-helix	trans	-66.4	-43	177.5	172.9	0	0	0	0	111	K266 V267 D268 K272 I273 Y274	K266-V270 VanDerWaalsContact O-CG2 3.32Å; K266-V270 WeakPolarHBondContact O-CG2 3.31Å; K266-V270 PolarHBondContact O-N 3.06Å; V267-V270 PolarHBondContact O-N 2.84Å; D268-V270 VanDerWaalsContact C-N 3.34Å; D268-V270 PolarHBondContact O-N 3.38Å; V270-K272 VanDerWaalsContact C-N 3.28Å; V270-K272 PolarHBondContact O-N 3.35Å; V270-I273 PolarHBondContact O-N 2.94Å; V270-Y274 HydrophobicContact CG1-CD2 3.8Å; V270-Y274 HydrophobicContact CG1-CE2 4.25Å; V270-Y274 WeakPolarHBondContact O-CD2 3.48Å; V270-Y274 PolarHBondContact O-N 2.89Å
271	K	92.5	Very high	90.8	Very high	103 Å²	103	127.2 Å²	127.2	45%	0.448	62%	0.622	S	S	.	*	H	α-helix	trans	-59.5	-38.2	175.6	-75.8	172.3	179.9	164.9	0	112.1	V267 D268 K275 L278	V267-K271 HydrophobicContact CG1-CD 4.04Å; V267-K271 VanDerWaalsContact CG1-CE 3.48Å; V267-K271 HydrophobicContact CG1-CG 4.34Å; V267-K271 WeakPolarHBondContact O-CB 3.37Å; V267-K271 VanDerWaalsContact O-CG 3.31Å; V267-K271 WeakPolarHBondContact O-CG 3.43Å; V267-K271 PolarHBondContact O-N 3.22Å; D268-K271 PolarHBondContact O-N 2.81Å; D268-K271 IonicContact OD1-NZ 3.82Å; K271-K275 VanDerWaalsContact O-CA 3.3Å; K271-K275 WeakPolarHBondContact O-CA 3.45Å; K271-K275 WeakPolarHBondContact O-CB 3.49Å; K271-K275 PolarHBondContact O-N 3.34Å; K271-L278 HydrophobicContact CB-CD1 3.99Å; K271-L278 HydrophobicContact CG-CD1 3.98Å
272	K	93.4	Very high	90.9	Very high	177 Å²	177	127.3 Å²	127.3	77%	0.77	61%	0.614	S	S	*	*	H	α-helix	trans	-65.5	-43	175.9	-173.2	177.9	179.7	179	0	111.9	D268 Q269 V270	D268-K272 WeakPolarHBondContact O-CB 3.47Å; D268-K272 PolarHBondContact O-N 3.26Å; Q269-K272 PolarHBondContact O-N 3.47Å; V270-K272 VanDerWaalsContact C-N 3.28Å; V270-K272 PolarHBondContact O-N 3.35Å
273	I	95	Very high	90.9	Very high	112 Å²	112	129.7 Å²	129.7	57%	0.574	62%	0.618	S	S	*	*	H	α-helix	trans	-66.6	-44.6	179.4	-66.7	165.2	0	0	0	110.9	Q269 V270	Q269-I273 HydrophobicContact CG-CD1 4.31Å; Q269-I273 WeakPolarHBondContact O-CG1 3.3Å; Q269-I273 PolarHBondContact O-N 3.03Å; Q269-I273 VanDerWaalsContact O-N 3.16Å; V270-I273 PolarHBondContact O-N 2.94Å
274	Y	94.5	Very high	90.6	Very high	132 Å²	132	131.7 Å²	131.7	52%	0.518	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.1	16	-172.7	-66.3	-78.5	0	0	0	114.4	V270 A276 Y277 L278	V270-Y274 HydrophobicContact CG1-CD2 3.8Å; V270-Y274 HydrophobicContact CG1-CE2 4.25Å; V270-Y274 WeakPolarHBondContact O-CD2 3.48Å; V270-Y274 PolarHBondContact O-N 2.89Å; Y274-A276 PolarHBondContact O-N 3.23Å; Y274-Y277 PolarHBondContact O-N 3.42Å; Y274-L278 WeakPolarHBondContact O-CG 3.47Å; Y274-L278 PolarHBondContact O-N 3Å
275	K	90.9	Very high	90.5	Very high	172 Å²	172	132.4 Å²	132.4	75%	0.748	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-46.8	-39.5	-172	-173.6	179.7	178	-177.7	0	114.6	K271 Y277	K271-K275 VanDerWaalsContact O-CA 3.3Å; K271-K275 WeakPolarHBondContact O-CA 3.45Å; K271-K275 WeakPolarHBondContact O-CB 3.49Å; K271-K275 PolarHBondContact O-N 3.34Å; K275-Y277 VanDerWaalsContact C-N 3.28Å; K275-Y277 PolarHBondContact O-N 2.84Å
276	A	90.3	Very high	90.2	Very high	89 Å²	89	130.2 Å²	130.2	74%	0.736	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-74.6	-13.8	-178.4	0	0	0	0	0	114.5	Y274	Y274-A276 PolarHBondContact O-N 3.23Å
277	Y	90.3	Very high	90	Very high	193 Å²	193	130.5 Å²	130.5	76%	0.757	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-123.6	4.5	-172.2	-54.9	-76	0	0	0	113.3	Y274 K275	Y274-Y277 PolarHBondContact O-N 3.42Å; K275-Y277 VanDerWaalsContact C-N 3.28Å; K275-Y277 PolarHBondContact O-N 2.84Å
278	L	90.6	Very high	89.8	Confident	77 Å²	77	137.6 Å²	137.6	40%	0.403	65%	0.652	S	S	.	*			trans	-68.1	133.9	175.9	-66	176.6	0	0	0	109.8	K271 Y274	K271-L278 HydrophobicContact CB-CD1 3.99Å; K271-L278 HydrophobicContact CG-CD1 3.98Å; Y274-L278 WeakPolarHBondContact O-CG 3.47Å; Y274-L278 PolarHBondContact O-N 3Å
279	K	81.6	Confident	89.6	Confident	206 Å²	206	141.5 Å²	141.5	90%	0.896	67%	0.666	S	S	*	*			trans	-86.5	131.7	170	-64.8	-177.3	179.4	-178.7	0	108.3
280	H	69.1	Low	89.2	Confident	255 Å²	255	144.8 Å²	144.8	100%	1.181	68%	0.681	S	S	*	*			trans	-82.1	0	173.2	-71.6	-69.6	0	0	0	111.3

Retrieved 280 of 280 residues in 558.3 ms (Link to these results)

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