A0A061I012_CRIGR Loading...

CD69 antigen

AlphaFold DB , UniProt , Accession A0A061I012, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene LOC100769507, Length 199 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	36.7	Very low	30.5	Very low	227 Å²	227	139.5 Å²	139.5	100%	1.118	79%	0.785	S	S	*	*				0	97	0	-73.2	79.1	134.4	0	0	106
2	N	25.1	Very low	30.6	Very low	151 Å²	151	136.3 Å²	136.3	81%	0.807	78%	0.778	S	S	*	*				49.9	120.7	84.8	-72.6	44.5	0	0	0	109.6
3	S	35	Very low	30.6	Very low	85 Å²	85	134.1 Å²	134.1	59%	0.594	78%	0.776	S	S	*	*			cis	-164	142.2	20	-84.2	0	0	0	0	106.4
4	E	36	Very low	30.7	Very low	157 Å²	157	131.4 Å²	131.4	73%	0.734	77%	0.769	S	S	*	*				51.2	135	91	-75.4	166.8	135.2	0	0	112.5
5	E	32.8	Very low	30.5	Very low	169 Å²	169	135.1 Å²	135.1	79%	0.79	78%	0.776	S	S	*	*			cis	-164.2	158.1	19.7	-114.6	158.4	128.3	0	0	106.1
6	G	26.5	Very low	30.7	Very low	74 Å²	74	135.6 Å²	135.6	76%	0.763	77%	0.774	S	S	*	*			cis	101.4	122.5	41.8	0	0	0	0	0	108.8
7	S	29.9	Very low	30.7	Very low	107 Å²	107	139.4 Å²	139.4	75%	0.748	78%	0.783	S	S	*	*			trans	-94.5	175	-159.9	71.7	0	0	0	0	115.1
8	V	33.6	Very low	30.6	Very low	113 Å²	113	144.8 Å²	144.8	69%	0.685	79%	0.789	S	S	*	*			trans	84.2	131.3	141.2	171.4	0	0	0	0	118.3
9	T	26.8	Very low	30.4	Very low	125 Å²	125	140.5 Å²	140.5	77%	0.767	78%	0.782	S	S	*	*				170	113.8	120.6	35.2	0	0	0	0	107.5
10	E	28.3	Very low	30.3	Very low	178 Å²	178	143 Å²	143	83%	0.832	79%	0.787	S	S	*	*				64.9	114.5	82.9	-99.6	-169	156.6	0	0	117.6
11	N	24.6	Very low	30.7	Very low	149 Å²	149	147.3 Å²	147.3	80%	0.797	79%	0.792	S	S	*	*				89.8	153.1	129.6	-142.5	12.2	0	0	0	122.4
12	S	31.4	Very low	30.5	Very low	101 Å²	101	143.7 Å²	143.7	71%	0.706	78%	0.777	S	S	*	*			trans	-84.1	157.9	-159.6	-45.2	0	0	0	0	115.3
13	S	30.8	Very low	31.1	Very low	107 Å²	107	144.6 Å²	144.6	75%	0.748	78%	0.776	S	S	*	*				149.3	134	117.9	-161.7	0	0	0	0	114.8
14	S	32.7	Very low	31.5	Very low	97 Å²	97	143.9 Å²	143.9	68%	0.678	78%	0.783	S	S	*	*			trans	27.6	128.6	145.9	66.1	0	0	0	0	122.7
15	H	27.3	Very low	31.5	Very low	187 Å²	187	143.1 Å²	143.1	87%	0.866	79%	0.789	S	S	*	*				-167.1	141.4	119	-135	-88.6	0	0	0	113.4
16	L	33	Very low	31.8	Very low	142 Å²	142	142.8 Å²	142.8	74%	0.743	79%	0.787	S	S	*	*			trans	-71.6	149.9	169.3	-100.7	83.8	0	0	0	111.9
17	E	31.3	Very low	32.3	Very low	201 Å²	201	147.5 Å²	147.5	94%	0.939	79%	0.791	S	S	*	*			trans	-150.9	164.5	136.5	-85.3	-143.7	111.1	0	0	112.3
18	R	28.7	Very low	32.5	Very low	236 Å²	236	152.1 Å²	152.1	89%	0.891	79%	0.793	S	S	*	*			trans	-127.8	154.6	-145.5	167.6	-168.9	-70.5	165.2	-2.6	111.6
19	G	27.5	Very low	32.6	Very low	63 Å²	63	155.6 Å²	155.6	65%	0.649	80%	0.8	S	S	*	*			trans	124.7	131.9	164.2	0	0	0	0	0	110.9
20	E	28.1	Very low	33.3	Very low	190 Å²	190	157.6 Å²	157.6	89%	0.888	80%	0.8	S	S	*	*			cis	-163.2	156	35.7	-162.2	85.4	167.1	0	0	108.4
21	R	39.6	Very low	33.9	Very low	234 Å²	234	157.7 Å²	157.7	88%	0.883	80%	0.798	S	S	*	*			trans	-78.3	140.9	175.4	-103.8	175.6	-80.8	161.3	-3.7	111.2
22	D	30.5	Very low	34.7	Very low	152 Å²	152	159 Å²	159	81%	0.813	80%	0.799	S	S	*	*			trans	-155.1	159.9	141.4	-145.9	4.5	0	0	0	115.4
23	H	39.1	Very low	35.3	Very low	169 Å²	169	163 Å²	163	78%	0.782	81%	0.806	S	S	*	*			trans	-79.8	146.8	-155.9	-74.5	67.7	0	0	0	117.4
24	G	42.8	Very low	36.1	Very low	71 Å²	71	165.9 Å²	165.9	73%	0.732	81%	0.808	S	S	*	*			trans	8.4	132.9	154.5	0	0	0	0	0	122.5
25	T	35.2	Very low	36.9	Very low	141 Å²	141	164 Å²	164	87%	0.865	80%	0.804	S	S	*	*				-155.8	116.7	128.2	-54.1	0	0	0	0	108.8	M27	T25-M27 PolarHBondContact O-N 2.75Å
26	H	39.4	Very low	37.9	Very low	161 Å²	161	159.9 Å²	159.9	75%	0.745	80%	0.796	S	S	*	*			trans	-80.2	96.7	178.6	-179.6	-89.9	0	0	0	109.7	Y28	H26-Y28 AromaticContact CE1-CD2 3.7Å; H26-Y28 AromaticContact CE1-CE2 3.95Å; H26-Y28 AromaticContact ND1-CD2 3.96Å
27	M	36.9	Very low	39	Very low	173 Å²	173	160.2 Å²	160.2	85%	0.852	80%	0.797	S	S	*	*			trans	-75.8	119.9	165.4	-100.8	-167.1	-68.1	0	0	109.3	T25 F29	T25-M27 PolarHBondContact O-N 2.75Å; M27-F29 PolarHBondContact O-N 3.25Å; M27-F29 VanDerWaalsContact O-N 3.13Å
28	Y	35.9	Very low	40	Very low	204 Å²	204	159.1 Å²	159.1	80%	0.8	79%	0.792	S	S	*	*			trans	-63.3	109	167.1	-121.6	-99.9	0	0	0	108.4	H26	H26-Y28 AromaticContact CE1-CD2 3.7Å; H26-Y28 AromaticContact CE1-CE2 3.95Å; H26-Y28 AromaticContact ND1-CD2 3.96Å
29	F	34.1	Very low	41.3	Very low	187 Å²	187	151.5 Å²	151.5	82%	0.82	77%	0.772	S	S	*	*			trans	-95.3	105.6	168.2	-159.3	-89.6	0	0	0	107.5	M27 K31	M27-F29 PolarHBondContact O-N 3.25Å; M27-F29 VanDerWaalsContact O-N 3.13Å; F29-K31 PolarHBondContact O-N 2.7Å
30	E	41.2	Very low	43.1	Very low	166 Å²	166	152 Å²	152	78%	0.776	76%	0.763	S	S	*	*			trans	-69	100.1	176	-152.5	154.5	-179	0	0	108.1	H32	E30-H32 PolarHBondContact O-N 3.34Å
31	K	41.3	Very low	44.8	Very low	181 Å²	181	149.5 Å²	149.5	79%	0.787	76%	0.755	S	S	*	*			trans	-67.2	105.8	169.9	-96.2	-177.9	175.4	173.6	0	107.4	F29 H33	F29-K31 PolarHBondContact O-N 2.7Å; K31-H33 PolarHBondContact O-N 2.91Å
32	H	42.7	Very low	46.2	Very low	177 Å²	177	142.4 Å²	142.4	82%	0.819	74%	0.739	S	S	*	*			trans	-52.5	114.6	156.1	-83	-85.6	0	0	0	108	E30 E34	E30-H32 PolarHBondContact O-N 3.34Å; H32-E34 VanDerWaalsContact C-N 3.3Å; H32-E34 PolarHBondContact O-N 3.37Å
33	H	42.1	Very low	48.2	Very low	183 Å²	183	137.7 Å²	137.7	85%	0.847	72%	0.717	S	S	*	*			trans	-65.5	95.5	165.7	-99.4	-86.6	0	0	0	107.3	K31 G35	K31-H33 PolarHBondContact O-N 2.91Å; H33-G35 VanDerWaalsContact C-N 3.32Å; H33-G35 PolarHBondContact O-N 3.49Å
34	E	48.8	Very low	50	Low	168 Å²	168	131.7 Å²	131.7	79%	0.785	70%	0.697	S	S	*	*			trans	-60	105.5	154.6	-156.4	71.7	-155.7	0	0	105.4	H32 S36	H32-E34 VanDerWaalsContact C-N 3.3Å; H32-E34 PolarHBondContact O-N 3.37Å; E34-S36 PolarHBondContact O-N 3.08Å
35	G	48.8	Very low	51.9	Low	58 Å²	58	132.4 Å²	132.4	60%	0.598	69%	0.687	S	S	*	*			trans	-53.7	105.5	-177	0	0	0	0	0	109.5	H33 I37	H33-G35 VanDerWaalsContact C-N 3.32Å; H33-G35 PolarHBondContact O-N 3.49Å; G35-I37 PolarHBondContact O-N 3.1Å
36	S	49.4	Very low	54.4	Low	101 Å²	101	130.9 Å²	130.9	71%	0.706	67%	0.673	S	S	*	*			trans	-68.1	98.9	172.9	-60.1	0	0	0	0	106.9	E34 Q38	E34-S36 PolarHBondContact O-N 3.08Å; S36-Q38 PolarHBondContact O-N 3.3Å
37	I	55.3	Low	56.6	Low	149 Å²	149	126.9 Å²	126.9	76%	0.764	66%	0.659	S	S	*	*			trans	-65.4	88.1	171	-60.1	175.8	0	0	0	106.4	G35 V39	G35-I37 PolarHBondContact O-N 3.1Å; I37-V39 HydrophobicContact CG2-CG2 3.58Å; I37-V39 PolarHBondContact O-N 3.42Å
38	Q	52.6	Low	59.2	Low	178 Å²	178	122.8 Å²	122.8	83%	0.832	64%	0.644	S	S	*	*			trans	-72.9	83.5	167.9	-74	-175.7	-18.3	0	0	107.4	S36 P40	S36-Q38 PolarHBondContact O-N 3.3Å; Q38-P40 WeakPolarHBondContact O-CD 3.44Å
39	V	55.6	Low	62	Low	76 Å²	76	117 Å²	117	46%	0.461	63%	0.63	S	S	.	*			trans	-67.8	120.4	164.6	-172	0	0	0	0	106	I37 I41 C43 A44	I37-V39 HydrophobicContact CG2-CG2 3.58Å; I37-V39 PolarHBondContact O-N 3.42Å; V39-I41 PolarHBondContact O-N 3.4Å; V39-C43 HydrophobicContact CG1-CB 3.66Å; V39-A44 HydrophobicContact CG1-CB 4.37Å
40	P	64.9	Low	64.8	Low	73 Å²	73	112.5 Å²	112.5	47%	0.474	61%	0.613	S	S	.	*			trans	-52.2	132	175.9	-21.4	29.9	0	0	0	108.6	Q38 P42 C43 A44	Q38-P40 WeakPolarHBondContact O-CD 3.44Å; P40-P42 HydrophobicContact CB-CG 3.93Å; P40-P42 VanDerWaalsContact O-N 3.09Å; P40-C43 HydrophobicContact CB-CB 4.26Å; P40-C43 HydrophobicContact CG-CB 4.36Å; P40-C43 VanDerWaalsContact O-CA 3.31Å; P40-C43 WeakPolarHBondContact O-CA 3.49Å; P40-C43 VanDerWaalsContact O-CB 3.26Å; P40-C43 WeakPolarHBondContact O-CB 3.3Å; P40-C43 PolarHBondContact O-N 3.41Å; P40-A44 PolarHBondContact O-N 3.1Å
41	I	63.8	Low	67.3	Low	138 Å²	138	109.5 Å²	109.5	71%	0.708	60%	0.601	S	S	*	*	H	α-helix	trans	-44	-41.6	175.4	-60.1	173.1	0	0	0	112.5	V39 C43 A44 V45	V39-I41 PolarHBondContact O-N 3.4Å; I41-C43 VanDerWaalsContact C-N 3.33Å; I41-C43 PolarHBondContact O-N 3.19Å; I41-A44 PolarHBondContact O-N 2.97Å; I41-V45 WeakPolarHBondContact O-CG2 3.28Å; I41-V45 PolarHBondContact O-N 3.43Å
42	P	69.8	Low	69.8	Low	85 Å²	85	103.9 Å²	103.9	55%	0.552	58%	0.583	S	S	*	*	H	α-helix	trans	-62.5	-34.6	173.3	21.6	-33.3	0	0	0	113.9	P40 L46	P40-P42 HydrophobicContact CB-CG 3.93Å; P40-P42 VanDerWaalsContact O-N 3.09Å; P42-L46 WeakPolarHBondContact O-CB 3.5Å; P42-L46 WeakPolarHBondContact O-CG 3.45Å; P42-L46 PolarHBondContact O-N 3.33Å
43	C	72.3	Confident	72.2	Confident	53 Å²	53	98.4 Å²	98.4	36%	0.358	56%	0.564	S	S	.	*	H	α-helix	trans	-70.2	-38.4	175	-61.7	0	0	0	0	112	V39 P40 I41 L46 V47	V39-C43 HydrophobicContact CG1-CB 3.66Å; P40-C43 HydrophobicContact CB-CB 4.26Å; P40-C43 HydrophobicContact CG-CB 4.36Å; P40-C43 VanDerWaalsContact O-CA 3.31Å; P40-C43 WeakPolarHBondContact O-CA 3.49Å; P40-C43 VanDerWaalsContact O-CB 3.26Å; P40-C43 WeakPolarHBondContact O-CB 3.3Å; P40-C43 PolarHBondContact O-N 3.41Å; I41-C43 VanDerWaalsContact C-N 3.33Å; I41-C43 PolarHBondContact O-N 3.19Å; C43-L46 PolarHBondContact O-N 2.97Å; C43-V47 WeakPolarHBondContact O-CB 3.39Å; C43-V47 WeakPolarHBondContact O-CG2 3.14Å; C43-V47 PolarHBondContact O-N 3.15Å
44	A	76.4	Confident	74.7	Confident	43 Å²	43	95 Å²	95	36%	0.355	55%	0.552	S	S	.	*	H	α-helix	trans	-64.6	-42	175.4	0	0	0	0	0	111.6	V39 P40 I41 V47 V48	V39-A44 HydrophobicContact CG1-CB 4.37Å; P40-A44 PolarHBondContact O-N 3.1Å; I41-A44 PolarHBondContact O-N 2.97Å; A44-V47 PolarHBondContact O-N 2.75Å; A44-V48 VanDerWaalsContact O-CG2 3.31Å; A44-V48 WeakPolarHBondContact O-CG2 3.47Å; A44-V48 PolarHBondContact O-N 3.12Å
45	V	84.4	Confident	76.8	Confident	86 Å²	86	89.8 Å²	89.8	52%	0.521	53%	0.533	S	S	.	.	H	α-helix	trans	-64	-44.6	175.4	174.6	0	0	0	0	111	I41 V47 V48 V49	I41-V45 WeakPolarHBondContact O-CG2 3.28Å; I41-V45 PolarHBondContact O-N 3.43Å; V45-V47 PolarHBondContact O-N 3.15Å; V45-V48 PolarHBondContact O-N 3.24Å; V45-V49 HydrophobicContact CG1-CG2 4.48Å; V45-V49 VanDerWaalsContact O-CG2 3.29Å; V45-V49 WeakPolarHBondContact O-CG2 3.15Å; V45-V49 PolarHBondContact O-N 2.89Å
46	L	86	Confident	78.8	Confident	108 Å²	108	92.6 Å²	92.6	57%	0.565	53%	0.533	S	S	*	.	H	α-helix	trans	-61.9	-42.2	176.1	-73	170	0	0	0	111.9	P42 C43 V49 I50	P42-L46 WeakPolarHBondContact O-CB 3.5Å; P42-L46 WeakPolarHBondContact O-CG 3.45Å; P42-L46 PolarHBondContact O-N 3.33Å; C43-L46 PolarHBondContact O-N 2.97Å; L46-V49 PolarHBondContact O-N 3.38Å; L46-I50 WeakPolarHBondContact O-CB 3.1Å; L46-I50 WeakPolarHBondContact O-CD1 3.32Å; L46-I50 WeakPolarHBondContact O-CG1 3.13Å; L46-I50 PolarHBondContact O-N 2.84Å
47	V	87.4	Confident	80.6	Confident	77 Å²	77	90 Å²	90	47%	0.467	52%	0.519	S	S	.	.	H	α-helix	trans	-62.8	-43.2	176.7	169.1	0	0	0	0	111	C43 A44 V45 I50 I51	C43-V47 WeakPolarHBondContact O-CB 3.39Å; C43-V47 WeakPolarHBondContact O-CG2 3.14Å; C43-V47 PolarHBondContact O-N 3.15Å; A44-V47 PolarHBondContact O-N 2.75Å; V45-V47 PolarHBondContact O-N 3.15Å; V47-I50 PolarHBondContact O-N 2.9Å; V47-I51 HydrophobicContact CG1-CD1 3.68Å; V47-I51 HydrophobicContact CG1-CG1 4.4Å; V47-I51 VanDerWaalsContact O-CG1 3.24Å; V47-I51 WeakPolarHBondContact O-CG1 3.39Å; V47-I51 PolarHBondContact O-N 2.89Å
48	V	91.2	Very high	82.3	Confident	88 Å²	88	87.8 Å²	87.8	53%	0.533	51%	0.508	S	S	.	.	H	α-helix	trans	-63.2	-43.8	176.4	171.7	0	0	0	0	111.2	A44 V45 I50 I51 T52	A44-V48 VanDerWaalsContact O-CG2 3.31Å; A44-V48 WeakPolarHBondContact O-CG2 3.47Å; A44-V48 PolarHBondContact O-N 3.12Å; V45-V48 PolarHBondContact O-N 3.24Å; V48-I50 VanDerWaalsContact C-N 3.32Å; V48-I50 PolarHBondContact O-N 2.76Å; V48-I51 PolarHBondContact O-N 3.26Å; V48-T52 HydrophobicContact CG1-CG2 4.31Å; V48-T52 VanDerWaalsContact O-CG2 3.32Å; V48-T52 WeakPolarHBondContact O-CG2 3.29Å; V48-T52 PolarHBondContact O-N 2.91Å; V48-T52 PolarHBondContact O-OG1 2.79Å; V48-T52 VanDerWaalsContact O-OG1 3.1Å
49	V	94	Very high	84	Confident	82 Å²	82	83.4 Å²	83.4	50%	0.497	49%	0.493	S	S	.	.	H	α-helix	trans	-63.9	-37.5	177.3	172.8	0	0	0	0	111.9	V45 L46 T52 S53	V45-V49 HydrophobicContact CG1-CG2 4.48Å; V45-V49 VanDerWaalsContact O-CG2 3.29Å; V45-V49 WeakPolarHBondContact O-CG2 3.15Å; V45-V49 PolarHBondContact O-N 2.89Å; L46-V49 PolarHBondContact O-N 3.38Å; V49-T52 WeakPolarHBondContact CA-OG1 3.38Å; V49-T52 PolarHBondContact O-OG1 3.33Å; V49-T52 VanDerWaalsContact O-OG1 3.06Å; V49-S53 WeakPolarHBondContact O-CB 3.18Å; V49-S53 PolarHBondContact O-N 3.2Å; V49-S53 PolarHBondContact O-OG 2.76Å
50	I	93.5	Very high	85.3	Confident	92 Å²	92	82.8 Å²	82.8	47%	0.472	50%	0.496	S	S	.	.	H	α-helix	trans	-66.9	-45.1	175	-68.4	164	0	0	0	110.1	L46 V47 V48 T52 S53 L54	L46-I50 WeakPolarHBondContact O-CB 3.1Å; L46-I50 WeakPolarHBondContact O-CD1 3.32Å; L46-I50 WeakPolarHBondContact O-CG1 3.13Å; L46-I50 PolarHBondContact O-N 2.84Å; V47-I50 PolarHBondContact O-N 2.9Å; V48-I50 VanDerWaalsContact C-N 3.32Å; V48-I50 PolarHBondContact O-N 2.76Å; I50-T52 PolarHBondContact O-N 2.82Å; I50-S53 WeakPolarHBondContact CA-OG 3.49Å; I50-S53 PolarHBondContact O-N 3.05Å; I50-S53 PolarHBondContact O-OG 2.83Å; I50-L54 HydrophobicContact CG2-CD1 3.7Å; I50-L54 HydrophobicContact CG2-CG 4.23Å; I50-L54 WeakPolarHBondContact O-CB 3.38Å; I50-L54 WeakPolarHBondContact O-CG 3.04Å; I50-L54 PolarHBondContact O-N 3.12Å
51	I	93.5	Very high	86	Confident	103 Å²	103	85 Å²	85	53%	0.528	50%	0.503	S	S	.	.	H	α-helix	trans	-64.3	-42.1	179.1	-68	166.4	0	0	0	111.3	V47 V48 S55	V47-I51 HydrophobicContact CG1-CD1 3.68Å; V47-I51 HydrophobicContact CG1-CG1 4.4Å; V47-I51 VanDerWaalsContact O-CG1 3.24Å; V47-I51 WeakPolarHBondContact O-CG1 3.39Å; V47-I51 PolarHBondContact O-N 2.89Å; V48-I51 PolarHBondContact O-N 3.26Å; I51-S55 WeakPolarHBondContact O-CB 3.38Å; I51-S55 PolarHBondContact O-N 2.76Å; I51-S55 PolarHBondContact O-OG 3.17Å
52	T	93.6	Very high	86.7	Confident	64 Å²	64	81.1 Å²	81.1	39%	0.393	48%	0.483	S	S	.	.	H	α-helix	trans	-67.9	-41.9	178.4	56.2	0	0	0	0	111.5	V48 V49 I50 S55 I56	V48-T52 HydrophobicContact CG1-CG2 4.31Å; V48-T52 VanDerWaalsContact O-CG2 3.32Å; V48-T52 WeakPolarHBondContact O-CG2 3.29Å; V48-T52 PolarHBondContact O-N 2.91Å; V48-T52 PolarHBondContact O-OG1 2.79Å; V48-T52 VanDerWaalsContact O-OG1 3.1Å; V49-T52 WeakPolarHBondContact CA-OG1 3.38Å; V49-T52 PolarHBondContact O-OG1 3.33Å; V49-T52 VanDerWaalsContact O-OG1 3.06Å; I50-T52 PolarHBondContact O-N 2.82Å; T52-S55 WeakPolarHBondContact CA-OG 3.03Å; T52-S55 PolarHBondContact O-N 2.86Å; T52-S55 PolarHBondContact O-OG 2.78Å; T52-I56 WeakPolarHBondContact O-CB 3.08Å; T52-I56 WeakPolarHBondContact O-CD1 3.41Å; T52-I56 WeakPolarHBondContact O-CG1 3Å; T52-I56 PolarHBondContact O-N 3.24Å
53	S	93.1	Very high	86.9	Confident	61 Å²	61	80.2 Å²	80.2	43%	0.427	48%	0.476	S	S	.	.	H	α-helix	trans	-65.3	-42.1	175.7	57	0	0	0	0	112.8	V49 I50 I56 A57	V49-S53 WeakPolarHBondContact O-CB 3.18Å; V49-S53 PolarHBondContact O-N 3.2Å; V49-S53 PolarHBondContact O-OG 2.76Å; I50-S53 WeakPolarHBondContact CA-OG 3.49Å; I50-S53 PolarHBondContact O-N 3.05Å; I50-S53 PolarHBondContact O-OG 2.83Å; S53-I56 PolarHBondContact O-N 2.94Å; S53-A57 WeakPolarHBondContact O-CB 3.46Å; S53-A57 PolarHBondContact O-N 2.7Å
54	L	93.9	Very high	86.5	Confident	113 Å²	113	79.6 Å²	79.6	59%	0.592	48%	0.479	S	S	*	.	H	α-helix	trans	-65	-42	176.3	-71.8	173.9	0	0	0	112.3	I50 A57 L58	I50-L54 HydrophobicContact CG2-CD1 3.7Å; I50-L54 HydrophobicContact CG2-CG 4.23Å; I50-L54 WeakPolarHBondContact O-CB 3.38Å; I50-L54 WeakPolarHBondContact O-CG 3.04Å; I50-L54 PolarHBondContact O-N 3.12Å; L54-A57 PolarHBondContact O-N 3.03Å; L54-L58 WeakPolarHBondContact O-CB 3.43Å; L54-L58 PolarHBondContact O-N 2.04Å
55	S	92.9	Very high	85.5	Confident	57 Å²	57	82.5 Å²	82.5	40%	0.399	49%	0.485	S	S	.	.	H	α-helix	trans	-67.8	-40.5	177	51.3	0	0	0	0	112.3	I51 T52 L58 V59	I51-S55 WeakPolarHBondContact O-CB 3.38Å; I51-S55 PolarHBondContact O-N 2.76Å; I51-S55 PolarHBondContact O-OG 3.17Å; T52-S55 WeakPolarHBondContact CA-OG 3.03Å; T52-S55 PolarHBondContact O-N 2.86Å; T52-S55 PolarHBondContact O-OG 2.78Å; S55-L58 PolarHBondContact O-N 3.37Å; S55-V59 WeakPolarHBondContact O-CB 3.02Å; S55-V59 VanDerWaalsContact O-CG2 3.28Å; S55-V59 WeakPolarHBondContact O-CG2 3.41Å; S55-V59 PolarHBondContact O-N 2.03Å
56	I	90.4	Very high	84.2	Confident	117 Å²	117	86.6 Å²	86.6	60%	0.6	49%	0.492	S	S	*	.	H	α-helix	trans	-62.6	-45.3	173.5	-68.8	164.7	0	0	0	110.8	T52 S53 L58 V59 A60	T52-I56 WeakPolarHBondContact O-CB 3.08Å; T52-I56 WeakPolarHBondContact O-CD1 3.41Å; T52-I56 WeakPolarHBondContact O-CG1 3Å; T52-I56 PolarHBondContact O-N 3.24Å; S53-I56 PolarHBondContact O-N 2.94Å; I56-L58 PolarHBondContact O-N 2.97Å; I56-V59 PolarHBondContact O-N 2.83Å; I56-A60 WeakPolarHBondContact O-CB 3.33Å; I56-A60 PolarHBondContact O-N 3.45Å
57	A	88.6	Confident	82.9	Confident	48 Å²	48	87 Å²	87	40%	0.397	50%	0.495	S	S	.	.	H	α-helix	trans	-62.1	-42.3	176.8	0	0	0	0	0	111.8	S53 L54 A60 L61	S53-A57 WeakPolarHBondContact O-CB 3.46Å; S53-A57 PolarHBondContact O-N 2.7Å; L54-A57 PolarHBondContact O-N 3.03Å; A57-A60 PolarHBondContact O-N 2.96Å; A57-L61 WeakPolarHBondContact O-CB 3.06Å; A57-L61 VanDerWaalsContact O-CG 3.22Å; A57-L61 WeakPolarHBondContact O-CG 3.42Å; A57-L61 PolarHBondContact O-N 2.87Å
58	L	89.7	Confident	81.7	Confident	101 Å²	101	87.9 Å²	87.9	53%	0.529	50%	0.503	S	S	.	.	H	α-helix	trans	-62.1	-46.7	175.1	-179.7	64.8	0	0	0	111.3	L54 S55 I56 A60 L61 L62	L54-L58 WeakPolarHBondContact O-CB 3.43Å; L54-L58 PolarHBondContact O-N 2.04Å; S55-L58 PolarHBondContact O-N 3.37Å; I56-L58 PolarHBondContact O-N 2.97Å; L58-A60 VanDerWaalsContact C-N 3.32Å; L58-A60 PolarHBondContact O-N 2.93Å; L58-L61 PolarHBondContact O-N 3.41Å; L58-L62 HydrophobicContact CD1-CD1 4.25Å; L58-L62 HydrophobicContact CD1-CG 4.2Å; L58-L62 HydrophobicContact CG-CD1 3.95Å; L58-L62 HydrophobicContact CG-CG 4.32Å; L58-L62 VanDerWaalsContact O-CB 3.29Å; L58-L62 WeakPolarHBondContact O-CB 3.45Å; L58-L62 WeakPolarHBondContact O-CG 3.28Å; L58-L62 PolarHBondContact O-N 3.19Å
59	V	88.4	Confident	80	Confident	86 Å²	86	89.2 Å²	89.2	52%	0.521	51%	0.514	S	S	.	.	H	α-helix	trans	-62.5	-41.2	176.6	172.6	0	0	0	0	110.6	S55 I56 L62 V63	S55-V59 WeakPolarHBondContact O-CB 3.02Å; S55-V59 VanDerWaalsContact O-CG2 3.28Å; S55-V59 WeakPolarHBondContact O-CG2 3.41Å; S55-V59 PolarHBondContact O-N 2.03Å; I56-V59 PolarHBondContact O-N 2.83Å; V59-L62 PolarHBondContact O-N 3.41Å; V59-V63 HydrophobicContact CG1-CG2 4.08Å; V59-V63 WeakPolarHBondContact O-CB 3.48Å; V59-V63 WeakPolarHBondContact O-CG2 3.1Å; V59-V63 PolarHBondContact O-N 3.25Å
60	A	84	Confident	78.2	Confident	63 Å²	63	88.4 Å²	88.4	52%	0.521	52%	0.522	S	S	.	.	H	α-helix	trans	-65.3	-37.3	176.3	0	0	0	0	0	112.6	I56 A57 L58 G64	I56-A60 WeakPolarHBondContact O-CB 3.33Å; I56-A60 PolarHBondContact O-N 3.45Å; A57-A60 PolarHBondContact O-N 2.96Å; L58-A60 VanDerWaalsContact C-N 3.32Å; L58-A60 PolarHBondContact O-N 2.93Å; A60-G64 WeakPolarHBondContact O-CA 3.37Å; A60-G64 PolarHBondContact O-N 2.96Å
61	L	79.4	Confident	76.4	Confident	119 Å²	119	91.8 Å²	91.8	62%	0.623	54%	0.541	S	S	*	.	H	α-helix	trans	-71	-41.1	175	-73.1	170.5	0	0	0	112.1	A57 L58 G64 Q65	A57-L61 WeakPolarHBondContact O-CB 3.06Å; A57-L61 VanDerWaalsContact O-CG 3.22Å; A57-L61 WeakPolarHBondContact O-CG 3.42Å; A57-L61 PolarHBondContact O-N 2.87Å; L58-L61 PolarHBondContact O-N 3.41Å; L61-G64 PolarHBondContact O-N 3.08Å; L61-Q65 WeakPolarHBondContact O-CB 3.24Å; L61-Q65 PolarHBondContact O-N 3Å
62	L	77.4	Confident	74.7	Confident	57 Å²	57	94.4 Å²	94.4	30%	0.298	55%	0.545	S	S	.	.	H	α-helix	trans	-63.6	-50.8	174.7	-73.4	176.5	0	0	0	109.9	L58 V59 G64 Q65 Y66	L58-L62 HydrophobicContact CD1-CD1 4.25Å; L58-L62 HydrophobicContact CD1-CG 4.2Å; L58-L62 HydrophobicContact CG-CD1 3.95Å; L58-L62 HydrophobicContact CG-CG 4.32Å; L58-L62 VanDerWaalsContact O-CB 3.29Å; L58-L62 WeakPolarHBondContact O-CB 3.45Å; L58-L62 WeakPolarHBondContact O-CG 3.28Å; L58-L62 PolarHBondContact O-N 3.19Å; V59-L62 PolarHBondContact O-N 3.41Å; L62-G64 VanDerWaalsContact C-N 3.3Å; L62-G64 PolarHBondContact O-N 3.12Å; L62-Q65 CarbonylContact O-C 3.57Å; L62-Q65 PolarHBondContact O-N 2.62Å; L62-Y66 HydrophobicContact CB-CD2 4.25Å; L62-Y66 HydrophobicContact CB-CE2 3.68Å; L62-Y66 HydrophobicContact CD2-CE2 4.45Å; L62-Y66 WeakPolarHBondContact O-CB 3Å; L62-Y66 WeakPolarHBondContact O-CD2 3.43Å; L62-Y66 WeakPolarHBondContact O-CE2 3.5Å; L62-Y66 PolarHBondContact O-N 3.44Å
63	V	74.5	Confident	72.6	Confident	67 Å²	67	97.9 Å²	97.9	41%	0.406	57%	0.566	S	S	.	*	H	α-helix	trans	-62.3	-36.9	175.2	173	0	0	0	0	111.2	V59 Y66 N67	V59-V63 HydrophobicContact CG1-CG2 4.08Å; V59-V63 WeakPolarHBondContact O-CB 3.48Å; V59-V63 WeakPolarHBondContact O-CG2 3.1Å; V59-V63 PolarHBondContact O-N 3.25Å; V63-Y66 CarbonylContact O-C 3.58Å; V63-Y66 PolarHBondContact O-N 3.23Å; V63-N67 WeakPolarHBondContact CG1-ND2 3.23Å; V63-N67 VanDerWaalsContact O-CB 3.28Å; V63-N67 WeakPolarHBondContact O-CB 3.24Å; V63-N67 PolarHBondContact O-N 3.28Å; V63-N67 PolarHBondContact O-ND2 2.92Å
64	G	63.9	Low	70.9	Confident	40 Å²	40	103 Å²	103	41%	0.412	59%	0.588	S	S	.	*	H	α-helix	trans	-65.7	-37.8	173.6	0	0	0	0	0	113.4	A60 L61 L62 C68	A60-G64 WeakPolarHBondContact O-CA 3.37Å; A60-G64 PolarHBondContact O-N 2.96Å; L61-G64 PolarHBondContact O-N 3.08Å; L62-G64 VanDerWaalsContact C-N 3.3Å; L62-G64 PolarHBondContact O-N 3.12Å; G64-C68 PolarHBondContact O-N 3.01Å
65	Q	56.3	Low	69.1	Low	104 Å²	104	106.1 Å²	106.1	49%	0.486	61%	0.605	S	S	.	*	H	α-helix	trans	-70.7	-34.5	170.1	-82.8	179.4	-28.9	0	0	112.3	L61 L62 C68	L61-Q65 WeakPolarHBondContact O-CB 3.24Å; L61-Q65 PolarHBondContact O-N 3Å; L62-Q65 CarbonylContact O-C 3.57Å; L62-Q65 PolarHBondContact O-N 2.62Å; Q65-C68 CarbonylContact O-C 3.5Å
66	Y	56.1	Low	66.9	Low	171 Å²	171	107.7 Å²	107.7	67%	0.671	62%	0.621	S	S	*	*	H	α-helix	trans	-76.7	-22.4	177.1	-60.6	-49.1	0	0	0	113.2	L62 V63	L62-Y66 HydrophobicContact CB-CD2 4.25Å; L62-Y66 HydrophobicContact CB-CE2 3.68Å; L62-Y66 HydrophobicContact CD2-CE2 4.45Å; L62-Y66 WeakPolarHBondContact O-CB 3Å; L62-Y66 WeakPolarHBondContact O-CD2 3.43Å; L62-Y66 WeakPolarHBondContact O-CE2 3.5Å; L62-Y66 PolarHBondContact O-N 3.44Å; V63-Y66 CarbonylContact O-C 3.58Å; V63-Y66 PolarHBondContact O-N 3.23Å
67	N	58.8	Low	65.6	Low	117 Å²	117	108.3 Å²	108.3	63%	0.626	64%	0.636	S	S	*	*	H	α-helix	trans	-89.8	-13.5	176.8	-73.1	-41.5	0	0	0	113.4	V63	V63-N67 WeakPolarHBondContact CG1-ND2 3.23Å; V63-N67 VanDerWaalsContact O-CB 3.28Å; V63-N67 WeakPolarHBondContact O-CB 3.24Å; V63-N67 PolarHBondContact O-N 3.28Å; V63-N67 PolarHBondContact O-ND2 2.92Å
68	C	61.7	Low	64.1	Low	95 Å²	95	109.9 Å²	109.9	64%	0.642	64%	0.644	S	S	*	*			trans	-139.4	87.6	173.6	-72.7	0	0	0	0	111.8	G64 Q65 G70	G64-C68 PolarHBondContact O-N 3.01Å; Q65-C68 CarbonylContact O-C 3.5Å; C68-G70 PolarHBondContact O-N 2.8Å
69	P	56.8	Low	62.6	Low	116 Å²	116	112.6 Å²	112.6	75%	0.753	66%	0.659	S	S	*	*			trans	-80.2	92.7	164.2	30.9	-27.3	0	0	0	108.6
70	G	56.7	Low	61.1	Low	65 Å²	65	115.4 Å²	115.4	67%	0.67	67%	0.666	S	S	*	*			trans	-158.7	7.8	-176.1	0	0	0	0	0	118.7	C68	C68-G70 PolarHBondContact O-N 2.8Å
71	L	54.8	Low	60	Low	164 Å²	164	118.1 Å²	118.1	86%	0.859	68%	0.679	S	S	*	*	S	Bend	trans	-140.4	40.6	-174.4	-149.6	76.4	0	0	0	115.6
72	Y	58.3	Low	59.3	Low	158 Å²	158	118.1 Å²	118.1	62%	0.62	68%	0.683	S	S	*	*	S	Bend	trans	-163.9	76.4	163.4	36	-92.5	0	0	0	109.4
73	T	48.4	Very low	58.9	Low	137 Å²	137	117.3 Å²	117.3	84%	0.84	69%	0.685	S	S	*	*			trans	176	74.4	151.3	30.4	0	0	0	0	109.2
74	N	56.9	Low	59.4	Low	167 Å²	167	117.5 Å²	117.5	89%	0.893	69%	0.689	S	S	*	*			trans	-126.2	61.2	153	-87.2	-50.7	0	0	0	108
75	L	56.6	Low	60.8	Low	180 Å²	180	116.4 Å²	116.4	94%	0.942	68%	0.675	S	S	*	*			trans	-130.9	61.5	163.6	-108.1	98	0	0	0	108.6
76	A	48.1	Very low	62.3	Low	89 Å²	89	114 Å²	114	74%	0.736	66%	0.664	S	S	*	*			trans	-159.2	83.6	157.7	0	0	0	0	0	107.8	S78	A76-S78 VanDerWaalsContact C-N 3.31Å; A76-S78 PolarHBondContact O-N 3Å
77	S	61.3	Low	63.6	Low	131 Å²	131	113.2 Å²	113.2	92%	0.916	67%	0.671	S	S	*	*			trans	-58.4	101.3	154.8	156.6	0	0	0	0	106.8
78	S	57.3	Low	65	Low	80 Å²	80	116.1 Å²	116.1	56%	0.559	68%	0.681	S	S	*	*			trans	-113	115.1	162.4	179.9	0	0	0	0	105.8	A76 H80	A76-S78 VanDerWaalsContact C-N 3.31Å; A76-S78 PolarHBondContact O-N 3Å; S78-H80 PolarHBondContact O-N 2.92Å
79	D	60	Low	66.6	Low	159 Å²	159	112.9 Å²	112.9	85%	0.85	66%	0.655	S	S	*	*			trans	-71.5	63.2	178.9	-165.6	22	0	0	0	110.9
80	H	56.8	Low	68.5	Low	144 Å²	144	110.7 Å²	110.7	67%	0.667	64%	0.637	S	S	*	*	S	Bend	trans	-119.3	141.7	160.7	-82.7	16.4	0	0	0	106.2	S78 V82	S78-H80 PolarHBondContact O-N 2.92Å; H80-V82 VanDerWaalsContact C-N 3.31Å; H80-V82 PolarHBondContact O-N 2.95Å
81	P	60	Low	70.3	Confident	120 Å²	120	110.7 Å²	110.7	78%	0.779	63%	0.63	S	S	*	*			trans	-56.1	104	168.3	-15.5	27.6	0	0	0	106.6	A83	P81-A83 VanDerWaalsContact C-N 3.29Å; P81-A83 PolarHBondContact O-N 2.03Å
82	V	63.8	Low	72.3	Confident	119 Å²	119	106.1 Å²	106.1	72%	0.721	60%	0.602	S	S	*	*			trans	-67.4	103.5	173.4	177.3	0	0	0	0	103.6	H80 S84	H80-V82 VanDerWaalsContact C-N 3.31Å; H80-V82 PolarHBondContact O-N 2.95Å; V82-S84 VanDerWaalsContact O-CB 3.29Å; V82-S84 WeakPolarHBondContact O-CB 3.23Å; V82-S84 PolarHBondContact O-N 2.84Å
83	A	70.8	Confident	73.9	Confident	41 Å²	41	104.6 Å²	104.6	34%	0.339	60%	0.595	S	S	.	*			trans	-55.9	104.4	179.4	0	0	0	0	0	107.7	P81 F198 R199	P81-A83 VanDerWaalsContact C-N 3.29Å; P81-A83 PolarHBondContact O-N 2.03Å; A83-F198 HydrophobicContact CB-CB 3.77Å; A83-F198 HydrophobicContact CB-CD2 3.87Å; A83-F198 HydrophobicContact CB-CG 4.32Å; A83-F198 VanDerWaalsContact O-CD2 3.23Å; A83-F198 WeakPolarHBondContact O-CD2 3.41Å; A83-R199 WeakPolarHBondContact CA-O 3.36Å; A83-R199 VanDerWaalsContact CB-O 3.24Å; A83-R199 WeakPolarHBondContact CB-O 3.17Å
84	S	84.2	Confident	76	Confident	71 Å²	71	107.2 Å²	107.2	50%	0.497	59%	0.59	S	S	.	*			trans	-135.3	155.6	-167.5	-171.9	0	0	0	0	109.8	V82	V82-S84 VanDerWaalsContact O-CB 3.29Å; V82-S84 WeakPolarHBondContact O-CB 3.23Å; V82-S84 PolarHBondContact O-N 2.84Å
85	C	92.4	Very high	77.8	Confident	17 Å²	17	100.4 Å²	100.4	12%	0.115	55%	0.552	C	S	.	*	P	Polyproline II helix	trans	-84.4	156.9	170.1	-58.4	0	0	0	0	110.2	W89 A91 C96 F198	C85-W89 HydrophobicContact CB-CB 3.83Å; C85-A91 HydrophobicContact CB-CB 4.4Å; C85-A91 VanDerWaalsContact SG-CB 3.6Å; C85-C96 WeakPolarHBondContact CA-SG 3.4Å; C85-C96 HydrophobicContact CB-CB 3.7Å; C85-C96 WeakPolarHBondContact CB-SG 3.46Å; C85-C96 WeakPolarHBondContact SG-CA 2.96Å; C85-C96 WeakPolarHBondContact SG-CB 3.3Å; C85-C96 CovalentContact SG-SG 2.03Å; C85-C96 PolarHBondContact SG-SG 3.06Å; C85-F198 WeakPolarHBondContact SG-CE1 3.26Å
86	E	88.7	Confident	79.7	Confident	53 Å²	53	91.9 Å²	91.9	25%	0.248	51%	0.508	C	S	.	.	P	Polyproline II helix	trans	-64.2	161.8	167.9	-60.1	94.9	168.9	0	0	111.1	W89 K196 R199	E86-W89 WeakPolarHBondContact O-CB 2.97Å; E86-W89 PolarHBondContact O-N 2.91Å; E86-W89 VanDerWaalsContact O-N 3.15Å; E86-K196 IonicContact OE1-NZ 2.92Å; E86-K196 PolarHBondContact OE1-NZ 3.07Å; E86-K196 WeakPolarHBondContact OE2-CE 3.26Å; E86-K196 IonicContact OE2-NZ 3.85Å; E86-K196 PolarHBondContact OE2-NZ 3.33Å; E86-R199 IonicContact OE1-CZ 3.3Å; E86-R199 VanDerWaalsContact OE1-CZ 3.3Å; E86-R199 IonicContact OE1-NH1 2.7Å; E86-R199 PolarHBondContact OE1-NH1 3.25Å; E86-R199 IonicContact OE1-NH2 3.57Å
87	D	83.4	Confident	82.1	Confident	154 Å²	154	87.7 Å²	87.7	82%	0.824	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	145.9	170	-61.1	-35.5	0	0	0	109.7	W89	D87-W89 PolarHBondContact O-N 2.77Å
88	E	88.3	Confident	83.9	Confident	178 Å²	178	84.1 Å²	84.1	83%	0.832	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	-9.9	-172.9	-51	-87.8	116	0	0	116
89	W	95.8	Very high	85.8	Confident	27 Å²	27	82.1 Å²	82.1	10%	0.102	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-93.5	138.5	175.3	-70.4	66.4	0	0	0	112	C85 E86 D87 C96 Y97 F98 E116 A118 C194 K196	C85-W89 HydrophobicContact CB-CB 3.83Å; E86-W89 WeakPolarHBondContact O-CB 2.97Å; E86-W89 PolarHBondContact O-N 2.91Å; E86-W89 VanDerWaalsContact O-N 3.15Å; D87-W89 PolarHBondContact O-N 2.77Å; W89-C96 HydrophobicContact CB-CB 4.27Å; W89-C96 HydrophobicContact CD2-CB 4.33Å; W89-C96 HydrophobicContact CE3-CB 3.66Å; W89-C96 HydrophobicContact CZ3-CB 4.42Å; W89-Y97 VanDerWaalsContact CE3-C 3.45Å; W89-F98 HydrophobicContact CD2-CB 3.66Å; W89-F98 HydrophobicContact CE3-CB 3.64Å; W89-F98 HydrophobicContact CG-CB 4.38Å; W89-F98 HydrophobicContact CH2-CB 3.67Å; W89-F98 HydrophobicContact CZ2-CB 3.67Å; W89-F98 HydrophobicContact CZ2-CG 4.26Å; W89-F98 HydrophobicContact CZ3-CB 3.66Å; W89-E116 HydrophobicContact CH2-CB 4.23Å; W89-E116 HydrophobicContact CZ2-CB 3.72Å; W89-E116 HydrophobicContact CZ2-CG 4.12Å; W89-A118 HydrophobicContact CH2-CB 3.67Å; W89-A118 HydrophobicContact CZ3-CB 4.19Å; W89-C194 HydrophobicContact CH2-CB 3.66Å; W89-C194 HydrophobicContact CZ3-CB 3.95Å; W89-K196 HydrophobicContact CH2-CD 4.49Å; W89-K196 HydrophobicContact CZ3-CD 4.45Å; W89-K196 HydrophobicContact CZ3-CG 4.1Å
90	L	95.6	Very high	87.7	Confident	71 Å²	71	74.9 Å²	74.9	37%	0.372	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	120.1	176.3	-58.7	179.5	0	0	0	110.7	C96 Y97 F99 F131	L90-C96 CarbonylContact O-C 3.5Å; L90-C96 WeakPolarHBondContact O-CA 3.49Å; L90-Y97 PolarHBondContact N-O 2.91Å; L90-Y97 PolarHBondContact O-N 3.14Å; L90-F99 HydrophobicContact CD1-CD2 3.97Å; L90-F99 HydrophobicContact CD1-CE2 3.97Å; L90-F131 HydrophobicContact CB-CZ 3.99Å; L90-F131 HydrophobicContact CD1-CZ 4.22Å
91	A	95.3	Very high	89.6	Confident	64 Å²	64	74 Å²	74	53%	0.529	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	119.6	175.9	0	0	0	0	0	111.4	C85 F198	C85-A91 HydrophobicContact CB-CB 4.4Å; C85-A91 VanDerWaalsContact SG-CB 3.6Å; A91-F198 HydrophobicContact CB-CE1 4.01Å; A91-F198 HydrophobicContact CB-CZ 3.94Å
92	Y	95.5	Very high	91.4	Very high	68 Å²	68	72.1 Å²	72.1	27%	0.267	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	125.1	173	-173.7	-105.4	0	0	0	111.4	R94 K95 Y97 K127 F131	Y92-R94 PolarHBondContact O-N 3.28Å; Y92-K95 PolarHBondContact N-O 2.79Å; Y92-K95 PolarHBondContact O-N 3.15Å; Y92-K95 VanDerWaalsContact O-O 3.05Å; Y92-Y97 HydrophobicContact CD1-CE2 4.41Å; Y92-K127 HydrophobicContact CE1-CB 4.41Å; Y92-F131 HydrophobicContact CD1-CB 3.74Å; Y92-F131 HydrophobicContact CD1-CD1 4.02Å; Y92-F131 AromaticContact CD1-CD2 3.93Å; Y92-F131 HydrophobicContact CD1-CD2 3.93Å; Y92-F131 AromaticContact CD1-CG 3.62Å; Y92-F131 HydrophobicContact CD1-CG 3.62Å; Y92-F131 AromaticContact CD2-CD2 3.62Å; Y92-F131 HydrophobicContact CD2-CD2 3.62Å; Y92-F131 HydrophobicContact CD2-CE2 4.04Å; Y92-F131 HydrophobicContact CD2-CG 4.19Å; Y92-F131 HydrophobicContact CE1-CB 3.58Å; Y92-F131 HydrophobicContact CE1-CD2 4.35Å; Y92-F131 AromaticContact CE1-CG 3.99Å; Y92-F131 HydrophobicContact CE1-CG 3.99Å; Y92-F131 HydrophobicContact CE2-CB 4.45Å; Y92-F131 HydrophobicContact CE2-CD2 4.08Å; Y92-F131 HydrophobicContact CG-CB 4.25Å; Y92-F131 HydrophobicContact CG-CD1 4.2Å; Y92-F131 AromaticContact CG-CD2 3.54Å; Y92-F131 HydrophobicContact CG-CD2 3.54Å; Y92-F131 AromaticContact CG-CE2 3.88Å; Y92-F131 HydrophobicContact CG-CE2 3.88Å; Y92-F131 AromaticContact CG-CG 3.73Å; Y92-F131 HydrophobicContact CG-CG 3.73Å; Y92-F131 HydrophobicContact CG-CZ 4.36Å
93	R	92.1	Very high	93.1	Very high	126 Å²	126	69.7 Å²	69.7	48%	0.475	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.4	53.2	173.7	-63.7	-168.7	69.3	-143.8	0.3	115.1	K95 S125 D128	R93-K95 PolarHBondContact O-N 2.83Å; R93-S125 PolarHBondContact NH1-OG 2.95Å; R93-D128 IonicContact CZ-OD1 2.76Å; R93-D128 IonicContact NH1-OD1 2.62Å; R93-D128 PolarHBondContact NH1-OD1 2.79Å
94	R	92.6	Very high	94.4	Very high	193 Å²	193	70.6 Å²	70.6	73%	0.728	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	18.7	179.7	-52.1	-175.2	64.6	122	4.4	114.7	Y92 F198	Y92-R94 PolarHBondContact O-N 3.28Å; R94-F198 VanDerWaalsContact C-CE1 3.5Å; R94-F198 HydrophobicContact CB-CD2 4.37Å; R94-F198 PolarHBondContact O-N 3.13Å
95	K	95.6	Very high	95.1	Very high	23 Å²	23	67.8 Å²	67.8	10%	0.1	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	146.1	172.1	-68.3	173.7	174.3	177.9	0	110.9	Y92 R93 Y97 V122 D124 D128 K196 F198	Y92-K95 PolarHBondContact N-O 2.79Å; Y92-K95 PolarHBondContact O-N 3.15Å; Y92-K95 VanDerWaalsContact O-O 3.05Å; R93-K95 PolarHBondContact O-N 2.83Å; K95-Y97 HydrophobicContact CB-CD2 4.27Å; K95-Y97 HydrophobicContact CB-CE2 3.56Å; K95-Y97 HydrophobicContact CD-CE2 4.3Å; K95-Y97 WeakPolarHBondContact CD-OH 3.23Å; K95-V122 PolarHBondContact NZ-O 3.12Å; K95-D124 WeakPolarHBondContact CE-OD2 3.34Å; K95-D124 IonicContact NZ-OD1 2.97Å; K95-D124 IonicContact NZ-OD2 3.96Å; K95-D124 PolarHBondContact NZ-OD2 3.35Å; K95-D128 IonicContact NZ-OD2 2.76Å; K95-D128 PolarHBondContact NZ-OD2 2.85Å; K95-K196 CarbonylContact C-O 3.43Å; K95-K196 VanDerWaalsContact CA-O 3.23Å; K95-K196 WeakPolarHBondContact CA-O 3.18Å; K95-F198 VanDerWaalsContact C-CE1 3.46Å; K95-F198 VanDerWaalsContact N-CE1 3.32Å; K95-F198 VanDerWaalsContact O-CE1 3.24Å; K95-F198 WeakPolarHBondContact O-CE1 3.35Å
96	C	97.2	Very high	95.4	Very high	2 Å²	2	68.1 Å²	68.1	1%	0.014	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	133.8	170.3	-56	0	0	0	0	108.5	C85 W89 L90 S195 K196 F198	C85-C96 WeakPolarHBondContact CA-SG 3.4Å; C85-C96 HydrophobicContact CB-CB 3.7Å; C85-C96 WeakPolarHBondContact CB-SG 3.46Å; C85-C96 WeakPolarHBondContact SG-CA 2.96Å; C85-C96 WeakPolarHBondContact SG-CB 3.3Å; C85-C96 CovalentContact SG-SG 2.03Å; C85-C96 PolarHBondContact SG-SG 3.06Å; W89-C96 HydrophobicContact CB-CB 4.27Å; W89-C96 HydrophobicContact CD2-CB 4.33Å; W89-C96 HydrophobicContact CE3-CB 3.66Å; W89-C96 HydrophobicContact CZ3-CB 4.42Å; L90-C96 CarbonylContact O-C 3.5Å; L90-C96 WeakPolarHBondContact O-CA 3.49Å; C96-S195 VanDerWaalsContact O-CA 3.23Å; C96-S195 WeakPolarHBondContact O-CA 3.35Å; C96-K196 HydrophobicContact CB-CG 4.04Å; C96-K196 PolarHBondContact N-O 3.04Å; C96-K196 PolarHBondContact O-N 3.07Å; C96-F198 VanDerWaalsContact SG-CD1 3.57Å
97	Y	98.1	Very high	95.9	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	137	178.1	-63.4	-89.2	0	0	0	111.4	W89 L90 Y92 K95 F131 L132 V193 C194	W89-Y97 VanDerWaalsContact CE3-C 3.45Å; L90-Y97 PolarHBondContact N-O 2.91Å; L90-Y97 PolarHBondContact O-N 3.14Å; Y92-Y97 HydrophobicContact CD1-CE2 4.41Å; K95-Y97 HydrophobicContact CB-CD2 4.27Å; K95-Y97 HydrophobicContact CB-CE2 3.56Å; K95-Y97 HydrophobicContact CD-CE2 4.3Å; K95-Y97 WeakPolarHBondContact CD-OH 3.23Å; Y97-F131 HydrophobicContact CD1-CE1 4.41Å; Y97-F131 HydrophobicContact CD2-CD1 4.19Å; Y97-F131 AromaticContact CD2-CE1 3.51Å; Y97-F131 HydrophobicContact CD2-CE1 3.51Å; Y97-F131 HydrophobicContact CD2-CZ 4.19Å; Y97-F131 HydrophobicContact CE2-CD1 4.19Å; Y97-F131 AromaticContact CE2-CE1 3.97Å; Y97-F131 HydrophobicContact CE2-CE1 3.97Å; Y97-F131 HydrophobicContact CG-CD1 4.5Å; Y97-F131 AromaticContact CG-CE1 3.74Å; Y97-F131 HydrophobicContact CG-CE1 3.74Å; Y97-L132 HydrophobicContact CD1-CD2 3.63Å; Y97-L132 HydrophobicContact CE1-CD1 4.38Å; Y97-L132 HydrophobicContact CE1-CD2 3.76Å; Y97-L132 HydrophobicContact CE1-CG 4.3Å; Y97-L132 HydrophobicContact CG-CD2 4.41Å; Y97-V193 HydrophobicContact CD1-CG1 4.21Å; Y97-C194 VanDerWaalsContact CA-O 3.27Å; Y97-C194 WeakPolarHBondContact CA-O 3.27Å
98	F	98.2	Very high	96.6	Very high	56 Å²	56	63 Å²	63	25%	0.246	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	126.8	174.3	172.7	-95	0	0	0	109.4	W89 V193 C194	W89-F98 HydrophobicContact CD2-CB 3.66Å; W89-F98 HydrophobicContact CE3-CB 3.64Å; W89-F98 HydrophobicContact CG-CB 4.38Å; W89-F98 HydrophobicContact CH2-CB 3.67Å; W89-F98 HydrophobicContact CZ2-CB 3.67Å; W89-F98 HydrophobicContact CZ2-CG 4.26Å; W89-F98 HydrophobicContact CZ3-CB 3.66Å; F98-V193 CarbonylContact O-C 3.43Å; F98-V193 VanDerWaalsContact O-CA 3.24Å; F98-V193 WeakPolarHBondContact O-CA 3.41Å; F98-V193 WeakPolarHBondContact O-CG1 3.36Å; F98-C194 HydrophobicContact CB-CB 4.19Å; F98-C194 PolarHBondContact N-O 2.99Å; F98-C194 VanDerWaalsContact N-O 3.12Å; F98-C194 PolarHBondContact O-N 3.23Å
99	F	98.3	Very high	97.1	Very high	38 Å²	38	54.5 Å²	54.5	17%	0.167	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	120.6	176.8	-72.6	-104	0	0	0	108.5	L90 F131 L132 H135 A136 H141 V193	L90-F99 HydrophobicContact CD1-CD2 3.97Å; L90-F99 HydrophobicContact CD1-CE2 3.97Å; F99-F131 HydrophobicContact CE2-CE1 4.38Å; F99-L132 HydrophobicContact CE2-CD2 4.49Å; F99-L132 HydrophobicContact CZ-CD2 3.83Å; F99-H135 HydrophobicContact CD1-CB 4.43Å; F99-H135 HydrophobicContact CE1-CB 3.69Å; F99-H135 HydrophobicContact CE2-CB 3.83Å; F99-H135 HydrophobicContact CZ-CB 3.36Å; F99-A136 HydrophobicContact CE1-CB 4.33Å; F99-H141 AromaticContact CD1-CD2 3.93Å; F99-H141 AromaticContact CD1-NE2 3.88Å; F99-V193 HydrophobicContact CD1-CG1 4.29Å; F99-V193 HydrophobicContact CD1-CG2 3.55Å; F99-V193 HydrophobicContact CD2-CG1 4.09Å; F99-V193 HydrophobicContact CE1-CB 4.4Å; F99-V193 HydrophobicContact CE1-CG1 4.06Å; F99-V193 HydrophobicContact CE1-CG2 3.4Å; F99-V193 VanDerWaalsContact CE1-CG2 3.4Å; F99-V193 HydrophobicContact CE2-CG1 3.84Å; F99-V193 HydrophobicContact CG-CG1 4.29Å; F99-V193 HydrophobicContact CG-CG2 4.26Å; F99-V193 HydrophobicContact CZ-CG1 3.81Å; F99-V193 HydrophobicContact CZ-CG2 4Å
100	S	98.4	Very high	97.2	Very high	7 Å²	7	54.7 Å²	54.7	5%	0.049	29%	0.287	C	S	.	.			trans	-68.5	141.3	-177.1	65.8	0	0	0	0	112.3	T102 H191 W192	S100-T102 PolarHBondContact OG-O 3.35Å; S100-T102 VanDerWaalsContact OG-O 3.06Å; S100-H191 PolarHBondContact O-ND1 2.79Å; S100-H191 VanDerWaalsContact O-ND1 3.12Å; S100-H191 WeakPolarHBondContact OG-CA 3.32Å; S100-H191 WeakPolarHBondContact OG-CB 3.43Å; S100-W192 VanDerWaalsContact CB-CE3 3.43Å; S100-W192 PolarHBondContact N-O 3.47Å; S100-W192 PolarHBondContact OG-N 2.78Å; S100-W192 PolarHBondContact OG-O 2.94Å
101	T	97.4	Very high	97.4	Very high	126 Å²	126	55.7 Å²	55.7	77%	0.773	29%	0.293	S	S	*	.	S	Bend	trans	-87.7	-11.2	171.5	54.7	0	0	0	0	113.4
102	T	98.3	Very high	97.5	Very high	81 Å²	81	54.3 Å²	54.3	50%	0.497	28%	0.28	S	S	.	.	S	Bend	trans	-115.3	174.3	178.2	57.5	0	0	0	0	110.8	S100 H191 W192	S100-T102 PolarHBondContact OG-O 3.35Å; S100-T102 VanDerWaalsContact OG-O 3.06Å; T102-H191 PolarHBondContact O-ND1 2.96Å; T102-W192 VanDerWaalsContact O-CZ3 3.3Å; T102-W192 WeakPolarHBondContact O-CZ3 3.17Å; T102-W192 VanDerWaalsContact OG1-CH2 3.28Å; T102-W192 WeakPolarHBondContact OG1-CH2 3.29Å
103	T	98.8	Very high	97.7	Very high	67 Å²	67	51.1 Å²	51.1	41%	0.411	27%	0.267	S	S	.	.			trans	-117.6	149.7	177.8	63.1	0	0	0	0	111.7	L190	T103-L190 CarbonylContact C-O 3.47Å; T103-L190 WeakPolarHBondContact CA-O 3.44Å; T103-L190 WeakPolarHBondContact CB-O 3.24Å
104	N	98.7	Very high	98	Very high	61 Å²	61	48 Å²	48	33%	0.326	26%	0.264	S	S	.	.	B	Isolated β-bridge	trans	-160.1	172.7	177	-142.5	-38.3	0	0	0	111.9	S108 W142 L190 W192	N104-S108 WeakPolarHBondContact ND2-CB 3.5Å; N104-S108 WeakPolarHBondContact OD1-CB 3.35Å; N104-S108 PolarHBondContact OD1-OG 2.87Å; N104-W142 PolarHBondContact O-NE1 3.26Å; N104-L190 PolarHBondContact N-O 3.03Å; N104-L190 PolarHBondContact O-N 2.73Å; N104-L190 VanDerWaalsContact O-N 3.14Å; N104-W192 HydrophobicContact CB-CE3 4.38Å; N104-W192 HydrophobicContact CB-CZ3 3.95Å
105	S	98.9	Very high	98.2	Very high	12 Å²	12	45.3 Å²	45.3	8%	0.084	26%	0.26	C	S	.	.			trans	-64.4	157.7	170.3	72.7	0	0	0	0	111.3	A107 S108 A109 C186 A188	S105-A107 PolarHBondContact O-N 2.78Å; S105-S108 PolarHBondContact O-N 2.75Å; S105-S108 PolarHBondContact OG-N 3.06Å; S105-S108 PolarHBondContact OG-OG 2.94Å; S105-S108 VanDerWaalsContact OG-OG 3.12Å; S105-A109 WeakPolarHBondContact O-CB 3.35Å; S105-A109 PolarHBondContact O-N 3.28Å; S105-C186 WeakPolarHBondContact CB-O 3.32Å; S105-A188 WeakPolarHBondContact CA-O 3.29Å
106	W	98.7	Very high	98.3	Very high	24 Å²	24	49.2 Å²	49.2	9%	0.091	28%	0.279	C	S	.	.	H	α-helix	trans	-57.2	-40.6	-178.8	-172.6	97.6	0	0	0	111.8	A109 Q110 L120 W142 I143 K146 C173 C186	W106-A109 PolarHBondContact O-N 3.02Å; W106-Q110 HydrophobicContact CE3-CB 4.35Å; W106-Q110 HydrophobicContact CH2-CB 4.45Å; W106-Q110 HydrophobicContact CH2-CG 4.41Å; W106-Q110 HydrophobicContact CZ3-CB 4.08Å; W106-Q110 HydrophobicContact CZ3-CG 4.29Å; W106-Q110 WeakPolarHBondContact O-CB 3.22Å; W106-Q110 PolarHBondContact O-N 2.91Å; W106-L120 HydrophobicContact CD2-CD1 3.79Å; W106-L120 VanDerWaalsContact CE2-CD1 3.4Å; W106-L120 HydrophobicContact CE3-CD1 4.44Å; W106-L120 HydrophobicContact CG-CD1 4.08Å; W106-L120 HydrophobicContact CH2-CD1 4.4Å; W106-L120 HydrophobicContact CZ2-CD1 3.76Å; W106-W142 HydrophobicContact CB-CD2 4.11Å; W106-W142 HydrophobicContact CB-CE3 4.49Å; W106-W142 HydrophobicContact CB-CG 4.43Å; W106-W142 HydrophobicContact CB-CZ2 4.37Å; W106-W142 AromaticContact CD1-CD2 3.79Å; W106-W142 AromaticContact CD1-CE3 3.67Å; W106-W142 AromaticContact CD1-CG 3.99Å; W106-W142 HydrophobicContact CG-CD2 4.38Å; W106-I143 PolarHBondContact NE1-O 2.82Å; W106-K146 HydrophobicContact CD2-CD 4.31Å; W106-K146 HydrophobicContact CE3-CD 3.98Å; W106-K146 HydrophobicContact CH2-CB 4.16Å; W106-K146 HydrophobicContact CH2-CD 3.95Å; W106-K146 HydrophobicContact CZ2-CB 3.82Å; W106-K146 HydrophobicContact CZ2-CD 4.25Å; W106-K146 HydrophobicContact CZ3-CD 3.8Å; W106-C173 HydrophobicContact CB-CB 4.12Å; W106-C173 HydrophobicContact CG-CB 3.91Å; W106-C186 HydrophobicContact CB-CB 4.4Å; W106-C186 PolarHBondContact N-O 3.22Å
107	A	98.5	Very high	98.2	Very high	55 Å²	55	52.2 Å²	52.2	46%	0.455	31%	0.31	S	S	.	.	H	α-helix	trans	-66.5	-43.8	179.6	0	0	0	0	0	112.2	S105 Q110 N111	S105-A107 PolarHBondContact O-N 2.78Å; A107-Q110 PolarHBondContact O-N 3.14Å; A107-N111 PolarHBondContact O-N 3.33Å
108	S	98.8	Very high	98.2	Very high	43 Å²	43	52.6 Å²	52.6	30%	0.301	31%	0.313	S	S	.	.	H	α-helix	trans	-67.3	-37.4	176.8	-63.6	0	0	0	0	112.2	N104 S105 N111 S112	N104-S108 WeakPolarHBondContact ND2-CB 3.5Å; N104-S108 WeakPolarHBondContact OD1-CB 3.35Å; N104-S108 PolarHBondContact OD1-OG 2.87Å; S105-S108 PolarHBondContact O-N 2.75Å; S105-S108 PolarHBondContact OG-N 3.06Å; S105-S108 PolarHBondContact OG-OG 2.94Å; S105-S108 VanDerWaalsContact OG-OG 3.12Å; S108-N111 PolarHBondContact O-N 3.3Å; S108-S112 PolarHBondContact O-N 3.29Å; S108-S112 PolarHBondContact O-OG 2.88Å
109	A	98.8	Very high	98.2	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-63.5	-45.4	174.1	0	0	0	0	0	111.5	S105 W106 N111 S112 C113 L120 W192	S105-A109 WeakPolarHBondContact O-CB 3.35Å; S105-A109 PolarHBondContact O-N 3.28Å; W106-A109 PolarHBondContact O-N 3.02Å; A109-N111 VanDerWaalsContact C-N 3.33Å; A109-N111 PolarHBondContact O-N 3.24Å; A109-S112 WeakPolarHBondContact O-CB 3.5Å; A109-S112 PolarHBondContact O-N 3.49Å; A109-S112 VanDerWaalsContact O-N 3.15Å; A109-C113 PolarHBondContact O-N 2.86Å; A109-C113 PolarHBondContact O-SG 3.03Å; A109-C113 VanDerWaalsContact O-SG 3.37Å; A109-L120 HydrophobicContact CB-CD1 4.49Å; A109-L120 HydrophobicContact CB-CD2 4Å; A109-W192 HydrophobicContact CB-CB 3.66Å; A109-W192 HydrophobicContact CB-CD2 3.69Å; A109-W192 HydrophobicContact CB-CE3 4.03Å; A109-W192 HydrophobicContact CB-CG 3.56Å
110	Q	98.7	Very high	98.2	Very high	31 Å²	31	49.6 Å²	49.6	15%	0.145	30%	0.302	C	S	.	.	H	α-helix	trans	-59.5	-41.8	172.9	179	60	32.3	0	0	112.4	W106 A107 S112 C113 S114 L120	W106-Q110 HydrophobicContact CE3-CB 4.35Å; W106-Q110 HydrophobicContact CH2-CB 4.45Å; W106-Q110 HydrophobicContact CH2-CG 4.41Å; W106-Q110 HydrophobicContact CZ3-CB 4.08Å; W106-Q110 HydrophobicContact CZ3-CG 4.29Å; W106-Q110 WeakPolarHBondContact O-CB 3.22Å; W106-Q110 PolarHBondContact O-N 2.91Å; A107-Q110 PolarHBondContact O-N 3.14Å; Q110-S112 VanDerWaalsContact C-N 3.32Å; Q110-C113 PolarHBondContact O-N 3.48Å; Q110-S114 WeakPolarHBondContact O-CB 3.18Å; Q110-S114 PolarHBondContact O-N 2.88Å; Q110-S114 PolarHBondContact O-OG 3.45Å; Q110-L120 HydrophobicContact CB-CD1 3.84Å; Q110-L120 HydrophobicContact CB-CG 4.13Å; Q110-L120 VanDerWaalsContact OE1-CB 3.24Å
111	N	98.7	Very high	98.2	Very high	92 Å²	92	49.2 Å²	49.2	49%	0.492	30%	0.3	S	S	.	.	H	α-helix	trans	-63.4	-39.7	175.3	-175.2	53.3	0	0	0	111.7	A107 S108 A109 S114 Q115	A107-N111 PolarHBondContact O-N 3.33Å; S108-N111 PolarHBondContact O-N 3.3Å; A109-N111 VanDerWaalsContact C-N 3.33Å; A109-N111 PolarHBondContact O-N 3.24Å; N111-S114 WeakPolarHBondContact O-CB 3.38Å; N111-S114 PolarHBondContact O-N 3.18Å; N111-Q115 PolarHBondContact ND2-NE2 3.33Å; N111-Q115 VanDerWaalsContact ND2-NE2 3.15Å; N111-Q115 WeakPolarHBondContact O-CG 3.3Å; N111-Q115 PolarHBondContact O-N 3.01Å; N111-Q115 VanDerWaalsContact O-N 3.1Å
112	S	98.6	Very high	98.3	Very high	36 Å²	36	43.5 Å²	43.5	25%	0.252	27%	0.265	S	S	.	.	H	α-helix	trans	-62.5	-44.5	176.4	-55.7	0	0	0	0	111.2	S108 A109 Q110 S114 Q115	S108-S112 PolarHBondContact O-N 3.29Å; S108-S112 PolarHBondContact O-OG 2.88Å; A109-S112 WeakPolarHBondContact O-CB 3.5Å; A109-S112 PolarHBondContact O-N 3.49Å; A109-S112 VanDerWaalsContact O-N 3.15Å; Q110-S112 VanDerWaalsContact C-N 3.32Å; S112-S114 VanDerWaalsContact C-N 3.3Å; S112-S114 PolarHBondContact O-N 2.89Å; S112-Q115 PolarHBondContact O-N 2.81Å
113	C	98.4	Very high	98.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-38.1	173.6	-59.8	0	0	0	0	112.5	A109 Q110 Q115 E116 G117 A118 T119 C194	A109-C113 PolarHBondContact O-N 2.86Å; A109-C113 PolarHBondContact O-SG 3.03Å; A109-C113 VanDerWaalsContact O-SG 3.37Å; Q110-C113 PolarHBondContact O-N 3.48Å; C113-Q115 VanDerWaalsContact C-N 3.31Å; C113-Q115 PolarHBondContact O-N 3.5Å; C113-E116 PolarHBondContact O-N 2.87Å; C113-E116 VanDerWaalsContact O-N 3.1Å; C113-G117 PolarHBondContact O-N 3.12Å; C113-A118 CarbonylContact C-O 3.25Å; C113-A118 VanDerWaalsContact C-O 3.25Å; C113-A118 HydrophobicContact CB-CB 4.3Å; C113-A118 CarbonylContact O-C 3.51Å; C113-A118 WeakPolarHBondContact O-CA 3.45Å; C113-A118 WeakPolarHBondContact O-CB 3.15Å; C113-A118 PolarHBondContact O-N 2.68Å; C113-A118 VanDerWaalsContact O-O 3.11Å; C113-T119 VanDerWaalsContact CB-C 3.41Å; C113-C194 WeakPolarHBondContact CA-SG 3.39Å; C113-C194 HydrophobicContact CB-CB 3.7Å; C113-C194 WeakPolarHBondContact CB-SG 3.31Å; C113-C194 WeakPolarHBondContact SG-CA 3.39Å; C113-C194 WeakPolarHBondContact SG-CB 3.28Å; C113-C194 CovalentContact SG-SG 2.04Å; C113-C194 PolarHBondContact SG-SG 2.87Å
114	S	98.4	Very high	98.1	Very high	60 Å²	60	41 Å²	41	42%	0.42	25%	0.245	S	C	.	.	H	α-helix	trans	-65.5	-34	-178.3	-56.8	0	0	0	0	112.5	Q110 N111 S112 E116 G117 A118	Q110-S114 WeakPolarHBondContact O-CB 3.18Å; Q110-S114 PolarHBondContact O-N 2.88Å; Q110-S114 PolarHBondContact O-OG 3.45Å; N111-S114 WeakPolarHBondContact O-CB 3.38Å; N111-S114 PolarHBondContact O-N 3.18Å; S112-S114 VanDerWaalsContact C-N 3.3Å; S112-S114 PolarHBondContact O-N 2.89Å; S114-E116 PolarHBondContact O-N 3.34Å; S114-G117 PolarHBondContact O-N 2.97Å; S114-G117 VanDerWaalsContact O-N 3.08Å; S114-A118 VanDerWaalsContact CA-O 3.3Å; S114-A118 WeakPolarHBondContact CA-O 3.36Å; S114-A118 PolarHBondContact N-O 3.32Å
115	Q	97.8	Very high	98.1	Very high	138 Å²	138	39.3 Å²	39.3	65%	0.645	24%	0.239	S	C	*	.	H	α-helix	trans	-62.1	-27.8	174.3	-70.6	170.8	44	0	0	112.5	N111 S112 C113 G117	N111-Q115 PolarHBondContact ND2-NE2 3.33Å; N111-Q115 VanDerWaalsContact ND2-NE2 3.15Å; N111-Q115 WeakPolarHBondContact O-CG 3.3Å; N111-Q115 PolarHBondContact O-N 3.01Å; N111-Q115 VanDerWaalsContact O-N 3.1Å; S112-Q115 PolarHBondContact O-N 2.81Å; C113-Q115 VanDerWaalsContact C-N 3.31Å; C113-Q115 PolarHBondContact O-N 3.5Å; Q115-G117 VanDerWaalsContact C-N 3.34Å
116	E	95.8	Very high	98	Very high	105 Å²	105	48 Å²	48	49%	0.491	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	11.8	177.1	-62.1	-60.2	151.7	0	0	113.5	W89 C113 S114 A118 K196	W89-E116 HydrophobicContact CH2-CB 4.23Å; W89-E116 HydrophobicContact CZ2-CB 3.72Å; W89-E116 HydrophobicContact CZ2-CG 4.12Å; C113-E116 PolarHBondContact O-N 2.87Å; C113-E116 VanDerWaalsContact O-N 3.1Å; S114-E116 PolarHBondContact O-N 3.34Å; E116-A118 PolarHBondContact O-N 3.35Å; E116-K196 PolarHBondContact O-NZ 3.04Å
117	G	96.2	Very high	98	Very high	64 Å²	64	52.8 Å²	52.8	66%	0.66	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.1	26.1	-175.6	0	0	0	0	0	113.4	C113 S114 Q115	C113-G117 PolarHBondContact O-N 3.12Å; S114-G117 PolarHBondContact O-N 2.97Å; S114-G117 VanDerWaalsContact O-N 3.08Å; Q115-G117 VanDerWaalsContact C-N 3.34Å
118	A	97.6	Very high	98	Very high	8 Å²	8	50.4 Å²	50.4	7%	0.066	27%	0.271	C	S	.	.			trans	-120.3	178.1	-179.8	0	0	0	0	0	111.6	W89 C113 S114 E116 C194 K196	W89-A118 HydrophobicContact CH2-CB 3.67Å; W89-A118 HydrophobicContact CZ3-CB 4.19Å; C113-A118 CarbonylContact C-O 3.25Å; C113-A118 VanDerWaalsContact C-O 3.25Å; C113-A118 HydrophobicContact CB-CB 4.3Å; C113-A118 CarbonylContact O-C 3.51Å; C113-A118 WeakPolarHBondContact O-CA 3.45Å; C113-A118 WeakPolarHBondContact O-CB 3.15Å; C113-A118 PolarHBondContact O-N 2.68Å; C113-A118 VanDerWaalsContact O-O 3.11Å; S114-A118 VanDerWaalsContact CA-O 3.3Å; S114-A118 WeakPolarHBondContact CA-O 3.36Å; S114-A118 PolarHBondContact N-O 3.32Å; E116-A118 PolarHBondContact O-N 3.35Å; A118-C194 HydrophobicContact CB-CB 4.14Å; A118-K196 HydrophobicContact CB-CB 3.89Å; A118-K196 HydrophobicContact CB-CD 4.11Å; A118-K196 HydrophobicContact CB-CG 4.12Å
119	T	98.7	Very high	97.9	Very high	31 Å²	31	49.1 Å²	49.1	19%	0.19	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	169.7	165.8	64.2	0	0	0	0	109.1	C113 A156 C194 S195	C113-T119 VanDerWaalsContact CB-C 3.41Å; T119-A156 HydrophobicContact CG2-CB 4.42Å; T119-C194 CarbonylContact O-C 3.27Å; T119-C194 WeakPolarHBondContact O-CA 3.49Å; T119-S195 PolarHBondContact N-O 2.96Å; T119-S195 VanDerWaalsContact N-O 3.17Å; T119-S195 PolarHBondContact O-N 2.89Å
120	L	98.8	Very high	97.9	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53	149.2	157.9	-76.9	171.2	0	0	0	109.9	W106 A109 Q110 V122 W142 A156 W192 V193	W106-L120 HydrophobicContact CD2-CD1 3.79Å; W106-L120 VanDerWaalsContact CE2-CD1 3.4Å; W106-L120 HydrophobicContact CE3-CD1 4.44Å; W106-L120 HydrophobicContact CG-CD1 4.08Å; W106-L120 HydrophobicContact CH2-CD1 4.4Å; W106-L120 HydrophobicContact CZ2-CD1 3.76Å; A109-L120 HydrophobicContact CB-CD1 4.49Å; A109-L120 HydrophobicContact CB-CD2 4Å; Q110-L120 HydrophobicContact CB-CD1 3.84Å; Q110-L120 HydrophobicContact CB-CG 4.13Å; Q110-L120 VanDerWaalsContact OE1-CB 3.24Å; L120-V122 PolarHBondContact O-N 2.99Å; L120-W142 HydrophobicContact CD1-CB 4.42Å; L120-W142 HydrophobicContact CD2-CB 4.1Å; L120-A156 HydrophobicContact CB-CB 4.47Å; L120-W192 HydrophobicContact CD2-CB 3.64Å; L120-W192 HydrophobicContact CD2-CG 4.09Å; L120-V193 CarbonylContact C-O 3.45Å; L120-V193 WeakPolarHBondContact CA-O 3.47Å
121	A	98.7	Very high	97.9	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-61	128	-163.1	0	0	0	0	0	112.6	L132 G144 V193 S195	A121-L132 HydrophobicContact CB-CD1 4.25Å; A121-L132 HydrophobicContact CB-CD2 4.49Å; A121-G144 PolarHBondContact O-N 3.16Å; A121-V193 HydrophobicContact CB-CB 3.88Å; A121-V193 HydrophobicContact CB-CG1 3.99Å; A121-V193 WeakPolarHBondContact CB-O 3.32Å; A121-V193 PolarHBondContact N-O 3.23Å; A121-S195 WeakPolarHBondContact CA-OG 3.31Å
122	V	98.3	Very high	97.9	Very high	6 Å²	6	49.1 Å²	49.1	4%	0.036	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-99.5	128.4	173.5	-178.8	0	0	0	0	109.7	K95 L120 D124 W155 N157 S195	K95-V122 PolarHBondContact NZ-O 3.12Å; L120-V122 PolarHBondContact O-N 2.99Å; V122-D124 WeakPolarHBondContact CG1-OD1 3.34Å; V122-W155 HydrophobicContact CB-CE3 4.28Å; V122-W155 HydrophobicContact CG1-CB 4.18Å; V122-W155 HydrophobicContact CG1-CD2 3.85Å; V122-W155 HydrophobicContact CG1-CE3 3.98Å; V122-W155 HydrophobicContact CG1-CG 3.93Å; V122-W155 HydrophobicContact CG2-CB 4.24Å; V122-W155 HydrophobicContact CG2-CE3 4.31Å; V122-N157 HydrophobicContact CG2-CB 4.18Å; V122-S195 PolarHBondContact N-OG 3.07Å
123	I	98	Very high	97.9	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.005	26%	0.257	C	S	.	.			trans	-104.3	97	-175.1	-42.8	-174.7	0	0	0	110	D128 M129 L132 I143 W155 W164 L176	I123-D128 HydrophobicContact CG2-CB 3.91Å; I123-M129 HydrophobicContact CD1-CE 3.85Å; I123-M129 HydrophobicContact CD1-SD 3.64Å; I123-M129 HydrophobicContact CG2-CB 3.88Å; I123-M129 HydrophobicContact CG2-CE 3.93Å; I123-M129 HydrophobicContact CG2-SD 4.23Å; I123-L132 HydrophobicContact CD1-CD1 3.69Å; I123-L132 HydrophobicContact CG1-CD1 3.6Å; I123-I143 HydrophobicContact CD1-CD1 3.97Å; I123-W155 HydrophobicContact CB-CH2 3.72Å; I123-W155 HydrophobicContact CB-CZ2 4.35Å; I123-W155 HydrophobicContact CB-CZ3 4.32Å; I123-W155 HydrophobicContact CD1-CH2 4.34Å; I123-W155 HydrophobicContact CG1-CH2 3.8Å; I123-W155 HydrophobicContact CG1-CZ3 4.03Å; I123-W164 HydrophobicContact CB-CZ2 4.45Å; I123-W164 HydrophobicContact CG2-CH2 4.3Å; I123-W164 HydrophobicContact CG2-CZ2 3.88Å; I123-L176 HydrophobicContact CD1-CD2 3.93Å
124	D	96.2	Very high	97.9	Very high	93 Å²	93	59.5 Å²	59.5	50%	0.497	29%	0.294	S	S	.	.			trans	-84.9	-13.7	-175.8	-63.9	-26.9	0	0	0	112.7	K95 V122 D128	K95-D124 WeakPolarHBondContact CE-OD2 3.34Å; K95-D124 IonicContact NZ-OD1 2.97Å; K95-D124 IonicContact NZ-OD2 3.96Å; K95-D124 PolarHBondContact NZ-OD2 3.35Å; V122-D124 WeakPolarHBondContact CG1-OD1 3.34Å; D124-D128 PolarHBondContact N-OD2 3.37Å
125	S	97.3	Very high	97.8	Very high	27 Å²	27	60.7 Å²	60.7	19%	0.189	29%	0.293	C	S	.	.	S	Bend	trans	-158.3	164.5	-174.6	78.3	0	0	0	0	113.9	R93 K127 D128 M129	R93-S125 PolarHBondContact NH1-OG 2.95Å; S125-K127 PolarHBondContact O-N 3.05Å; S125-K127 PolarHBondContact OG-N 3.48Å; S125-D128 WeakPolarHBondContact O-CB 3.32Å; S125-D128 PolarHBondContact O-N 3.18Å; S125-D128 VanDerWaalsContact O-N 3.16Å; S125-D128 PolarHBondContact OG-N 3.5Å; S125-D128 PolarHBondContact OG-OD1 3.01Å; S125-M129 PolarHBondContact O-N 3.41Å
126	R	97.8	Very high	97.8	Very high	194 Å²	194	54.5 Å²	54.5	73%	0.732	27%	0.265	S	S	*	.	H	α-helix	trans	-58.3	-30.7	173.6	-169.7	170.8	-174.7	164.2	2.5	113.7	M129 I130 W164	R126-M129 WeakPolarHBondContact O-CB 3.44Å; R126-M129 PolarHBondContact O-N 3.29Å; R126-I130 HydrophobicContact CG-CD1 4.17Å; R126-I130 WeakPolarHBondContact O-CD1 3.38Å; R126-I130 VanDerWaalsContact O-CG1 3.28Å; R126-I130 WeakPolarHBondContact O-CG1 3.35Å; R126-I130 PolarHBondContact O-N 3.23Å; R126-W164 HydrophobicContact CB-CH2 4.47Å; R126-W164 HydrophobicContact CB-CZ3 4.18Å
127	K	98.2	Very high	97.9	Very high	125 Å²	125	50.6 Å²	50.6	54%	0.543	25%	0.254	S	S	.	.	H	α-helix	trans	-70.3	-42.6	177.7	-71.2	-175.6	-179	-179.5	0	111.1	Y92 S125 M129 I130 F131	Y92-K127 HydrophobicContact CE1-CB 4.41Å; S125-K127 PolarHBondContact O-N 3.05Å; S125-K127 PolarHBondContact OG-N 3.48Å; K127-M129 VanDerWaalsContact C-N 3.3Å; K127-M129 PolarHBondContact O-N 3.28Å; K127-I130 PolarHBondContact O-N 2.91Å; K127-F131 WeakPolarHBondContact O-CB 3.15Å; K127-F131 PolarHBondContact O-N 2.77Å
128	D	97.8	Very high	97.9	Very high	4 Å²	4	55.3 Å²	55.3	2%	0.021	26%	0.258	C	S	.	.	H	α-helix	trans	-61.8	-43.1	175	-58	16.4	0	0	0	109.7	R93 K95 I123 D124 S125 I130 F131 L132	R93-D128 IonicContact CZ-OD1 2.76Å; R93-D128 IonicContact NH1-OD1 2.62Å; R93-D128 PolarHBondContact NH1-OD1 2.79Å; K95-D128 IonicContact NZ-OD2 2.76Å; K95-D128 PolarHBondContact NZ-OD2 2.85Å; I123-D128 HydrophobicContact CG2-CB 3.91Å; D124-D128 PolarHBondContact N-OD2 3.37Å; S125-D128 WeakPolarHBondContact O-CB 3.32Å; S125-D128 PolarHBondContact O-N 3.18Å; S125-D128 VanDerWaalsContact O-N 3.16Å; S125-D128 PolarHBondContact OG-N 3.5Å; S125-D128 PolarHBondContact OG-OD1 3.01Å; D128-I130 PolarHBondContact O-N 2.99Å; D128-F131 WeakPolarHBondContact O-CB 3.38Å; D128-F131 PolarHBondContact O-N 3.31Å; D128-L132 VanDerWaalsContact O-CG 3.32Å; D128-L132 WeakPolarHBondContact O-CG 3.48Å; D128-L132 PolarHBondContact O-N 3.35Å
129	M	98.2	Very high	97.9	Very high	17 Å²	17	60.2 Å²	60.2	8%	0.084	28%	0.28	C	S	.	.	H	α-helix	trans	-56	-52.2	175.1	-172.8	70	77.8	0	0	112.2	I123 S125 R126 K127 F131 L132 K133 W164 F165 I181	I123-M129 HydrophobicContact CD1-CE 3.85Å; I123-M129 HydrophobicContact CD1-SD 3.64Å; I123-M129 HydrophobicContact CG2-CB 3.88Å; I123-M129 HydrophobicContact CG2-CE 3.93Å; I123-M129 HydrophobicContact CG2-SD 4.23Å; S125-M129 PolarHBondContact O-N 3.41Å; R126-M129 WeakPolarHBondContact O-CB 3.44Å; R126-M129 PolarHBondContact O-N 3.29Å; K127-M129 VanDerWaalsContact C-N 3.3Å; K127-M129 PolarHBondContact O-N 3.28Å; M129-F131 VanDerWaalsContact C-N 3.3Å; M129-F131 PolarHBondContact O-N 3.14Å; M129-L132 PolarHBondContact O-N 3.17Å; M129-K133 HydrophobicContact CG-CD 4.07Å; M129-K133 VanDerWaalsContact O-CG 3.31Å; M129-K133 WeakPolarHBondContact O-CG 3.09Å; M129-K133 PolarHBondContact O-N 2.84Å; M129-K133 HydrophobicContact SD-CD 4.3Å; M129-W164 HydrophobicContact CB-CH2 4.12Å; M129-W164 HydrophobicContact CE-CH2 3.77Å; M129-W164 HydrophobicContact CE-CZ2 4.01Å; M129-F165 HydrophobicContact CE-CB 4.42Å; M129-F165 HydrophobicContact CE-CD1 3.36Å; M129-F165 HydrophobicContact CE-CD2 4.16Å; M129-F165 HydrophobicContact CE-CE1 3.46Å; M129-F165 VanDerWaalsContact CE-CE1 3.46Å; M129-F165 HydrophobicContact CE-CE2 4.24Å; M129-F165 HydrophobicContact CE-CG 3.74Å; M129-F165 HydrophobicContact CE-CZ 3.93Å; M129-I181 HydrophobicContact CE-CD1 3.21Å; M129-I181 HydrophobicContact SD-CD1 3.32Å; M129-I181 WeakPolarHBondContact SD-CD1 3.38Å; M129-I181 HydrophobicContact SD-CG1 4.13Å
130	I	98.2	Very high	97.9	Very high	104 Å²	104	61.8 Å²	61.8	53%	0.533	29%	0.285	S	S	.	.	H	α-helix	trans	-61	-42.5	-179.8	-69.3	163.6	0	0	0	110.7	R126 K127 D128 R134	R126-I130 HydrophobicContact CG-CD1 4.17Å; R126-I130 WeakPolarHBondContact O-CD1 3.38Å; R126-I130 VanDerWaalsContact O-CG1 3.28Å; R126-I130 WeakPolarHBondContact O-CG1 3.35Å; R126-I130 PolarHBondContact O-N 3.23Å; K127-I130 PolarHBondContact O-N 2.91Å; D128-I130 PolarHBondContact O-N 2.99Å; I130-R134 VanDerWaalsContact O-CB 3.32Å; I130-R134 WeakPolarHBondContact O-CB 3.26Å; I130-R134 PolarHBondContact O-N 3.48Å
131	F	98.3	Very high	97.9	Very high	19 Å²	19	62.4 Å²	62.4	8%	0.083	29%	0.288	C	S	.	.	H	α-helix	trans	-58.6	-51	176.4	171.4	-93.7	0	0	0	111.1	L90 Y92 Y97 F99 K127 D128 M129 R134 H135	L90-F131 HydrophobicContact CB-CZ 3.99Å; L90-F131 HydrophobicContact CD1-CZ 4.22Å; Y92-F131 HydrophobicContact CD1-CB 3.74Å; Y92-F131 HydrophobicContact CD1-CD1 4.02Å; Y92-F131 AromaticContact CD1-CD2 3.93Å; Y92-F131 HydrophobicContact CD1-CD2 3.93Å; Y92-F131 AromaticContact CD1-CG 3.62Å; Y92-F131 HydrophobicContact CD1-CG 3.62Å; Y92-F131 AromaticContact CD2-CD2 3.62Å; Y92-F131 HydrophobicContact CD2-CD2 3.62Å; Y92-F131 HydrophobicContact CD2-CE2 4.04Å; Y92-F131 HydrophobicContact CD2-CG 4.19Å; Y92-F131 HydrophobicContact CE1-CB 3.58Å; Y92-F131 HydrophobicContact CE1-CD2 4.35Å; Y92-F131 AromaticContact CE1-CG 3.99Å; Y92-F131 HydrophobicContact CE1-CG 3.99Å; Y92-F131 HydrophobicContact CE2-CB 4.45Å; Y92-F131 HydrophobicContact CE2-CD2 4.08Å; Y92-F131 HydrophobicContact CG-CB 4.25Å; Y92-F131 HydrophobicContact CG-CD1 4.2Å; Y92-F131 AromaticContact CG-CD2 3.54Å; Y92-F131 HydrophobicContact CG-CD2 3.54Å; Y92-F131 AromaticContact CG-CE2 3.88Å; Y92-F131 HydrophobicContact CG-CE2 3.88Å; Y92-F131 AromaticContact CG-CG 3.73Å; Y92-F131 HydrophobicContact CG-CG 3.73Å; Y92-F131 HydrophobicContact CG-CZ 4.36Å; Y97-F131 HydrophobicContact CD1-CE1 4.41Å; Y97-F131 HydrophobicContact CD2-CD1 4.19Å; Y97-F131 AromaticContact CD2-CE1 3.51Å; Y97-F131 HydrophobicContact CD2-CE1 3.51Å; Y97-F131 HydrophobicContact CD2-CZ 4.19Å; Y97-F131 HydrophobicContact CE2-CD1 4.19Å; Y97-F131 AromaticContact CE2-CE1 3.97Å; Y97-F131 HydrophobicContact CE2-CE1 3.97Å; Y97-F131 HydrophobicContact CG-CD1 4.5Å; Y97-F131 AromaticContact CG-CE1 3.74Å; Y97-F131 HydrophobicContact CG-CE1 3.74Å; F99-F131 HydrophobicContact CE2-CE1 4.38Å; K127-F131 WeakPolarHBondContact O-CB 3.15Å; K127-F131 PolarHBondContact O-N 2.77Å; D128-F131 WeakPolarHBondContact O-CB 3.38Å; D128-F131 PolarHBondContact O-N 3.31Å; M129-F131 VanDerWaalsContact C-N 3.3Å; M129-F131 PolarHBondContact O-N 3.14Å; F131-R134 PolarHBondContact O-N 2.87Å; F131-H135 AromaticContact CD2-CE1 3.33Å; F131-H135 WeakPolarHBondContact CD2-CE1 3.45Å; F131-H135 AromaticContact CD2-ND1 3.6Å; F131-H135 AromaticContact CE2-CE1 3.09Å; F131-H135 WeakPolarHBondContact CE2-CE1 3.43Å; F131-H135 AromaticContact CE2-ND1 3.54Å; F131-H135 AromaticContact CE2-NE2 3.7Å; F131-H135 AromaticContact CG-ND1 4Å; F131-H135 AromaticContact CZ-CE1 3.78Å; F131-H135 AromaticContact CZ-ND1 3.87Å; F131-H135 PolarHBondContact O-N 3.48Å; F131-H135 PolarHBondContact O-ND1 3.2Å
132	L	98.5	Very high	97.9	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.3	-48.5	-178.5	-70.8	175.6	0	0	0	112.4	Y97 F99 A121 I123 D128 M129 R134 H135 A136 L176 V193	Y97-L132 HydrophobicContact CD1-CD2 3.63Å; Y97-L132 HydrophobicContact CE1-CD1 4.38Å; Y97-L132 HydrophobicContact CE1-CD2 3.76Å; Y97-L132 HydrophobicContact CE1-CG 4.3Å; Y97-L132 HydrophobicContact CG-CD2 4.41Å; F99-L132 HydrophobicContact CE2-CD2 4.49Å; F99-L132 HydrophobicContact CZ-CD2 3.83Å; A121-L132 HydrophobicContact CB-CD1 4.25Å; A121-L132 HydrophobicContact CB-CD2 4.49Å; I123-L132 HydrophobicContact CD1-CD1 3.69Å; I123-L132 HydrophobicContact CG1-CD1 3.6Å; D128-L132 VanDerWaalsContact O-CG 3.32Å; D128-L132 WeakPolarHBondContact O-CG 3.48Å; D128-L132 PolarHBondContact O-N 3.35Å; M129-L132 PolarHBondContact O-N 3.17Å; L132-R134 VanDerWaalsContact C-N 3.3Å; L132-R134 PolarHBondContact O-N 3.23Å; L132-H135 PolarHBondContact O-N 3.07Å; L132-A136 WeakPolarHBondContact O-CB 3.32Å; L132-A136 PolarHBondContact O-N 2.78Å; L132-L176 HydrophobicContact CB-CD1 4.41Å; L132-L176 HydrophobicContact CB-CD2 3.83Å; L132-L176 HydrophobicContact CD1-CD2 4.21Å; L132-V193 HydrophobicContact CD2-CB 4.45Å; L132-V193 HydrophobicContact CD2-CG1 3.76Å
133	K	98.4	Very high	97.9	Very high	45 Å²	45	62.1 Å²	62.1	20%	0.196	29%	0.286	C	S	.	.	H	α-helix	trans	-60.5	-39.9	179.5	-65.3	-174.9	81.6	169.8	0	112	M129 H135 G137 L176 N177 N178 T179	M129-K133 HydrophobicContact CG-CD 4.07Å; M129-K133 VanDerWaalsContact O-CG 3.31Å; M129-K133 WeakPolarHBondContact O-CG 3.09Å; M129-K133 PolarHBondContact O-N 2.84Å; M129-K133 HydrophobicContact SD-CD 4.3Å; K133-H135 PolarHBondContact O-N 2.66Å; K133-G137 PolarHBondContact O-N 3.42Å; K133-L176 HydrophobicContact CG-CD1 4.4Å; K133-N177 WeakPolarHBondContact CB-O 3.28Å; K133-N177 WeakPolarHBondContact CE-O 3.48Å; K133-N177 VanDerWaalsContact CG-O 3.28Å; K133-N177 WeakPolarHBondContact CG-O 3.33Å; K133-N178 WeakPolarHBondContact CE-O 3.31Å; K133-N178 VanDerWaalsContact O-CA 3.31Å; K133-N178 WeakPolarHBondContact O-CA 3.33Å; K133-T179 WeakPolarHBondContact CE-O 3.28Å; K133-T179 PolarHBondContact NZ-O 3.19Å
134	R	98.1	Very high	97.9	Very high	209 Å²	209	62.1 Å²	62.1	79%	0.789	29%	0.286	S	S	*	.	H	α-helix	trans	-63.4	-39.9	177.6	-179.4	175.2	178	140.7	0	112.6	I130 F131 L132	I130-R134 VanDerWaalsContact O-CB 3.32Å; I130-R134 WeakPolarHBondContact O-CB 3.26Å; I130-R134 PolarHBondContact O-N 3.48Å; F131-R134 PolarHBondContact O-N 2.87Å; L132-R134 VanDerWaalsContact C-N 3.3Å; L132-R134 PolarHBondContact O-N 3.23Å
135	H	97.8	Very high	98.1	Very high	85 Å²	85	57.7 Å²	57.7	39%	0.394	26%	0.262	S	S	.	.	H	α-helix	trans	-84.5	-30.2	-177.2	-69.5	81.5	0	0	0	112.8	F99 F131 L132 K133 G137	F99-H135 HydrophobicContact CD1-CB 4.43Å; F99-H135 HydrophobicContact CE1-CB 3.69Å; F99-H135 HydrophobicContact CE2-CB 3.83Å; F99-H135 HydrophobicContact CZ-CB 3.36Å; F131-H135 AromaticContact CD2-CE1 3.33Å; F131-H135 WeakPolarHBondContact CD2-CE1 3.45Å; F131-H135 AromaticContact CD2-ND1 3.6Å; F131-H135 AromaticContact CE2-CE1 3.09Å; F131-H135 WeakPolarHBondContact CE2-CE1 3.43Å; F131-H135 AromaticContact CE2-ND1 3.54Å; F131-H135 AromaticContact CE2-NE2 3.7Å; F131-H135 AromaticContact CG-ND1 4Å; F131-H135 AromaticContact CZ-CE1 3.78Å; F131-H135 AromaticContact CZ-ND1 3.87Å; F131-H135 PolarHBondContact O-N 3.48Å; F131-H135 PolarHBondContact O-ND1 3.2Å; L132-H135 PolarHBondContact O-N 3.07Å; K133-H135 PolarHBondContact O-N 2.66Å; H135-G137 VanDerWaalsContact C-N 3.27Å; H135-G137 PolarHBondContact O-N 3.31Å
136	A	97.6	Very high	98.1	Very high	7 Å²	7	59.8 Å²	59.8	6%	0.058	27%	0.268	C	S	.	.	H	α-helix	trans	-62.4	-35.4	174.3	0	0	0	0	0	112.2	F99 L132 H141 L176	F99-A136 HydrophobicContact CE1-CB 4.33Å; L132-A136 WeakPolarHBondContact O-CB 3.32Å; L132-A136 PolarHBondContact O-N 2.78Å; A136-H141 PolarHBondContact O-CE1 2.81Å; A136-L176 HydrophobicContact CB-CD1 3.49Å; A136-L176 VanDerWaalsContact CB-CD1 3.49Å
137	G	97.1	Very high	98	Very high	24 Å²	24	51.9 Å²	51.9	25%	0.247	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.5	-142.7	-177.9	0	0	0	0	0	111.5	K133 H135 Q139 N178	K133-G137 PolarHBondContact O-N 3.42Å; H135-G137 VanDerWaalsContact C-N 3.27Å; H135-G137 PolarHBondContact O-N 3.31Å; G137-Q139 VanDerWaalsContact C-N 3.33Å; G137-N178 WeakPolarHBondContact O-CB 3.35Å; G137-N178 PolarHBondContact O-N 2.88Å
138	E	97.2	Very high	97.5	Very high	162 Å²	162	49.8 Å²	49.8	76%	0.757	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-22.1	-178.1	-63.2	-179.7	174	0	0	113.1
139	Q	97.4	Very high	96.6	Very high	112 Å²	112	54.7 Å²	54.7	52%	0.523	27%	0.273	S	S	.	.	S	Bend	trans	-76.1	138.6	-177	-60.1	-59.2	-26.4	0	0	111	G137 H141	G137-Q139 VanDerWaalsContact C-N 3.33Å; Q139-H141 PolarHBondContact O-CE1 2.8Å; Q139-H141 PolarHBondContact O-ND1 2.86Å
140	E	98.1	Very high	95.8	Very high	64 Å²	64	58.5 Å²	58.5	30%	0.299	29%	0.294	S	S	.	.			trans	-75.7	133.9	174.7	-63.3	-169.5	134	0	0	110.7	L176 L190 H191	E140-L176 WeakPolarHBondContact CA-O 3.5Å; E140-L190 HydrophobicContact CB-CD1 4.05Å; E140-L190 HydrophobicContact CB-CD2 4.18Å; E140-H191 PolarHBondContact O-N 3.37Å
141	H	98.8	Very high	95	Very high	13 Å²	13	61.5 Å²	61.5	6%	0.06	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	131.6	178.3	-66.9	68.7	0	0	0	110.8	F99 A136 Q139 I143 S175 L176 H191 V193	F99-H141 AromaticContact CD1-CD2 3.93Å; F99-H141 AromaticContact CD1-NE2 3.88Å; A136-H141 PolarHBondContact O-CE1 2.81Å; Q139-H141 PolarHBondContact O-CE1 2.8Å; Q139-H141 PolarHBondContact O-ND1 2.86Å; H141-I143 PolarHBondContact O-N 3.18Å; H141-S175 CarbonylContact O-C 3.59Å; H141-S175 WeakPolarHBondContact O-CA 3.22Å; H141-S175 WeakPolarHBondContact O-CB 3.32Å; H141-L176 PolarHBondContact N-O 3.27Å; H141-L176 PolarHBondContact O-N 2.9Å; H141-H191 CarbonylContact C-O 3.6Å; H141-H191 VanDerWaalsContact CA-O 3.22Å; H141-H191 WeakPolarHBondContact CA-O 3.42Å; H141-H191 WeakPolarHBondContact CD2-CB 3.19Å; H141-V193 HydrophobicContact CB-CG2 3.8Å
142	W	98.9	Very high	94.6	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	136.2	166.2	-65.7	128.9	0	0	0	111.2	N104 W106 L120 C173 V184 D185 A188 L190 H191 W192 V193	N104-W142 PolarHBondContact O-NE1 3.26Å; W106-W142 HydrophobicContact CB-CD2 4.11Å; W106-W142 HydrophobicContact CB-CE3 4.49Å; W106-W142 HydrophobicContact CB-CG 4.43Å; W106-W142 HydrophobicContact CB-CZ2 4.37Å; W106-W142 AromaticContact CD1-CD2 3.79Å; W106-W142 AromaticContact CD1-CE3 3.67Å; W106-W142 AromaticContact CD1-CG 3.99Å; W106-W142 HydrophobicContact CG-CD2 4.38Å; L120-W142 HydrophobicContact CD1-CB 4.42Å; L120-W142 HydrophobicContact CD2-CB 4.1Å; W142-C173 HydrophobicContact CE3-CB 4.16Å; W142-C173 HydrophobicContact CH2-CB 3.99Å; W142-C173 HydrophobicContact CZ3-CB 3.57Å; W142-V184 HydrophobicContact CH2-CB 3.56Å; W142-V184 HydrophobicContact CH2-CG1 3.78Å; W142-V184 HydrophobicContact CZ3-CB 3.77Å; W142-V184 HydrophobicContact CZ3-CG1 4.45Å; W142-D185 VanDerWaalsContact CH2-O 3.28Å; W142-D185 WeakPolarHBondContact CH2-O 3.47Å; W142-A188 HydrophobicContact CH2-CB 4.47Å; W142-A188 HydrophobicContact CZ2-CB 4.1Å; W142-A188 WeakPolarHBondContact CZ2-O 3.32Å; W142-L190 HydrophobicContact CD2-CB 4.17Å; W142-L190 HydrophobicContact CD2-CD1 3.82Å; W142-L190 HydrophobicContact CD2-CG 4.29Å; W142-L190 HydrophobicContact CE3-CD1 3.85Å; W142-L190 HydrophobicContact CG-CB 4.26Å; W142-L190 HydrophobicContact CH2-CD1 3.68Å; W142-L190 HydrophobicContact CH2-CG 4.27Å; W142-L190 HydrophobicContact CZ2-CB 4.31Å; W142-L190 HydrophobicContact CZ2-CD1 3.63Å; W142-L190 HydrophobicContact CZ2-CG 3.74Å; W142-L190 HydrophobicContact CZ3-CD1 3.78Å; W142-H191 PolarHBondContact N-O 3.27Å; W142-W192 HydrophobicContact CB-CB 3.82Å; W142-V193 PolarHBondContact O-N 2.92Å; W142-V193 VanDerWaalsContact O-N 3.07Å
143	I	98.8	Very high	94.5	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	165.5	166.5	56.8	170.4	0	0	0	110	W106 I123 H141 L145 A174 L176 I181	W106-I143 PolarHBondContact NE1-O 2.82Å; I123-I143 HydrophobicContact CD1-CD1 3.97Å; H141-I143 PolarHBondContact O-N 3.18Å; I143-L145 HydrophobicContact CD1-CB 4.27Å; I143-L145 HydrophobicContact CG1-CB 4.32Å; I143-L145 PolarHBondContact O-N 3.4Å; I143-A174 HydrophobicContact CD1-CB 4.07Å; I143-A174 HydrophobicContact CG1-CB 3.91Å; I143-A174 WeakPolarHBondContact CG1-O 3.48Å; I143-A174 PolarHBondContact N-O 2.96Å; I143-A174 VanDerWaalsContact N-O 3.14Å; I143-L176 HydrophobicContact CD1-CD2 4.48Å; I143-L176 HydrophobicContact CG2-CD2 3.41Å; I143-L176 VanDerWaalsContact CG2-CD2 3.41Å; I143-L176 HydrophobicContact CG2-CG 3.69Å; I143-I181 HydrophobicContact CD1-CG2 4.12Å
144	G	98.4	Very high	94.5	Very high	0 Å²	0	65 Å²	65	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	36	-173.3	0	0	0	0	0	113.3	A121 W155 A156	A121-G144 PolarHBondContact O-N 3.16Å; G144-W155 CarbonylContact O-C 3.55Å; G144-W155 VanDerWaalsContact O-C 3.27Å; G144-W155 WeakPolarHBondContact O-CA 3.31Å; G144-A156 PolarHBondContact O-N 3.46Å
145	L	98.4	Very high	94.5	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122.3	-178.6	-175.7	61.2	0	0	0	109.7	I143 W153 W155 F161 F165 I167 A174	I143-L145 HydrophobicContact CD1-CB 4.27Å; I143-L145 HydrophobicContact CG1-CB 4.32Å; I143-L145 PolarHBondContact O-N 3.4Å; L145-W153 HydrophobicContact CD1-CB 4.22Å; L145-W153 HydrophobicContact CD1-CE3 4.09Å; L145-W153 HydrophobicContact CD2-CE3 4.4Å; L145-W153 HydrophobicContact CG-CE3 3.71Å; L145-W153 HydrophobicContact CG-CZ3 4.18Å; L145-W155 HydrophobicContact CB-CE3 3.83Å; L145-W155 HydrophobicContact CB-CH2 4.16Å; L145-W155 HydrophobicContact CB-CZ3 3.63Å; L145-W155 HydrophobicContact CD1-CD2 4Å; L145-W155 HydrophobicContact CD1-CE3 4.16Å; L145-W155 HydrophobicContact CD1-CG 4.48Å; L145-W155 HydrophobicContact CD1-CZ2 4.37Å; L145-W155 HydrophobicContact CD1-CZ3 4.42Å; L145-W155 HydrophobicContact CD2-CH2 3.98Å; L145-W155 HydrophobicContact CD2-CZ2 4.23Å; L145-W155 HydrophobicContact CD2-CZ3 4.32Å; L145-W155 HydrophobicContact CG-CE3 4.49Å; L145-W155 HydrophobicContact CG-CH2 4.46Å; L145-W155 HydrophobicContact CG-CZ3 4.35Å; L145-F161 HydrophobicContact CD1-CB 3.72Å; L145-F161 HydrophobicContact CD1-CD1 4.38Å; L145-F161 HydrophobicContact CD1-CD2 4.41Å; L145-F161 HydrophobicContact CD1-CG 3.94Å; L145-F161 HydrophobicContact CD2-CD1 4.32Å; L145-F161 HydrophobicContact CD2-CD2 4.43Å; L145-F161 HydrophobicContact CD2-CE1 4.39Å; L145-F161 HydrophobicContact CD2-CG 4.33Å; L145-F165 HydrophobicContact CD2-CE2 3.93Å; L145-F165 HydrophobicContact CD2-CZ 3.77Å; L145-I167 HydrophobicContact CD2-CD1 3.49Å; L145-I167 VanDerWaalsContact CD2-CD1 3.49Å; L145-I167 HydrophobicContact CD2-CG1 4.46Å; L145-I167 HydrophobicContact CG-CD1 4.42Å; L145-A174 HydrophobicContact CB-CB 3.89Å; L145-A174 HydrophobicContact CD2-CB 4.33Å; L145-A174 HydrophobicContact CG-CB 4.22Å; L145-A174 VanDerWaalsContact O-CB 3.32Å; L145-A174 WeakPolarHBondContact O-CB 3.49Å; L145-A174 PolarHBondContact O-N 3.37Å
146	K	97.8	Very high	94.5	Very high	72 Å²	72	53 Å²	53	31%	0.313	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	142.7	-175.6	-176.1	176	-179.3	177.8	0	111.1	W106 W153 K154 R172	W106-K146 HydrophobicContact CD2-CD 4.31Å; W106-K146 HydrophobicContact CE3-CD 3.98Å; W106-K146 HydrophobicContact CH2-CB 4.16Å; W106-K146 HydrophobicContact CH2-CD 3.95Å; W106-K146 HydrophobicContact CZ2-CB 3.82Å; W106-K146 HydrophobicContact CZ2-CD 4.25Å; W106-K146 HydrophobicContact CZ3-CD 3.8Å; K146-W153 WeakPolarHBondContact O-CA 3.18Å; K146-K154 PolarHBondContact N-O 2.89Å; K146-K154 PolarHBondContact O-N 3.37Å; K146-R172 CarbonylContact C-O 3.51Å; K146-R172 WeakPolarHBondContact CA-O 3.25Å; K146-R172 WeakPolarHBondContact CG-O 3.23Å
147	N	96.1	Very high	94.3	Very high	27 Å²	27	56 Å²	56	14%	0.144	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	114.9	171.8	-163.9	-19.6	0	0	0	109.9	Q151 T152 W153 R172	N147-Q151 WeakPolarHBondContact OD1-CA 3.36Å; N147-T152 PolarHBondContact OD1-N 3.41Å; N147-W153 HydrophobicContact CB-CD2 3.86Å; N147-W153 HydrophobicContact CB-CE3 3.96Å; N147-W153 HydrophobicContact CB-CH2 3.92Å; N147-W153 HydrophobicContact CB-CZ2 3.82Å; N147-W153 HydrophobicContact CB-CZ3 3.99Å; N147-R172 HydrophobicContact CB-CB 4.25Å; N147-R172 HydrophobicContact CB-CG 4.43Å; N147-R172 PolarHBondContact N-O 2.75Å
148	E	87.9	Confident	94.2	Very high	81 Å²	81	57.5 Å²	57.5	38%	0.379	31%	0.312	S	S	.	.			trans	-73.9	166	175.6	-68.3	-171.4	159.3	0	0	111.7	N150 Q151 T152 K154	E148-N150 WeakPolarHBondContact CB-OD1 3.49Å; E148-N150 PolarHBondContact O-N 2.94Å; E148-Q151 PolarHBondContact O-N 2.79Å; E148-T152 PolarHBondContact N-O 2.89Å; E148-K154 IonicContact OE1-NZ 3.69Å; E148-K154 WeakPolarHBondContact OE2-CD 3.32Å; E148-K154 VanDerWaalsContact OE2-CE 3.28Å; E148-K154 WeakPolarHBondContact OE2-CE 3.47Å; E148-K154 IonicContact OE2-NZ 2.75Å; E148-K154 PolarHBondContact OE2-NZ 3.32Å
149	A	79.2	Confident	94.1	Very high	107 Å²	107	55.3 Å²	55.3	88%	0.884	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-20.3	-175.4	0	0	0	0	0	114.3	Q151	A149-Q151 VanDerWaalsContact C-N 3.32Å
150	N	80.8	Confident	94	Very high	98 Å²	98	55 Å²	55	52%	0.524	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	19.3	176.6	68.6	-15.5	0	0	0	113.7	E148 T152	E148-N150 WeakPolarHBondContact CB-OD1 3.49Å; E148-N150 PolarHBondContact O-N 2.94Å; N150-T152 PolarHBondContact ND2-OG1 2.83Å; N150-T152 PolarHBondContact O-N 2.81Å; N150-T152 VanDerWaalsContact OD1-CB 3.32Å; N150-T152 WeakPolarHBondContact OD1-CB 3.2Å; N150-T152 PolarHBondContact OD1-N 2.85Å; N150-T152 PolarHBondContact OD1-OG1 3.49Å
151	Q	80.6	Confident	94	Very high	167 Å²	167	52.2 Å²	52.2	78%	0.78	29%	0.29	S	S	*	.	S	Bend	trans	62.4	19.7	-178.8	-55.9	-171.6	-68.1	0	0	114.8	N147 E148 A149	N147-Q151 WeakPolarHBondContact OD1-CA 3.36Å; E148-Q151 PolarHBondContact O-N 2.79Å; A149-Q151 VanDerWaalsContact C-N 3.32Å
152	T	91.4	Very high	93.9	Very high	48 Å²	48	57.3 Å²	57.3	29%	0.294	32%	0.318	S	S	.	.			trans	-98.7	126.1	177.6	-53.6	0	0	0	0	110.1	N147 E148 N150 K154	N147-T152 PolarHBondContact OD1-N 3.41Å; E148-T152 PolarHBondContact N-O 2.89Å; N150-T152 PolarHBondContact ND2-OG1 2.83Å; N150-T152 PolarHBondContact O-N 2.81Å; N150-T152 VanDerWaalsContact OD1-CB 3.32Å; N150-T152 WeakPolarHBondContact OD1-CB 3.2Å; N150-T152 PolarHBondContact OD1-N 2.85Å; N150-T152 PolarHBondContact OD1-OG1 3.49Å; T152-K154 HydrophobicContact CG2-CG 4.27Å
153	W	96.6	Very high	93.7	Very high	35 Å²	35	63.4 Å²	63.4	13%	0.133	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	125	174.4	-75.2	94.9	0	0	0	110.5	L145 K146 N147 F161 I167 A174 T183	L145-W153 HydrophobicContact CD1-CB 4.22Å; L145-W153 HydrophobicContact CD1-CE3 4.09Å; L145-W153 HydrophobicContact CD2-CE3 4.4Å; L145-W153 HydrophobicContact CG-CE3 3.71Å; L145-W153 HydrophobicContact CG-CZ3 4.18Å; K146-W153 WeakPolarHBondContact O-CA 3.18Å; N147-W153 HydrophobicContact CB-CD2 3.86Å; N147-W153 HydrophobicContact CB-CE3 3.96Å; N147-W153 HydrophobicContact CB-CH2 3.92Å; N147-W153 HydrophobicContact CB-CZ2 3.82Å; N147-W153 HydrophobicContact CB-CZ3 3.99Å; W153-F161 HydrophobicContact CB-CB 3.79Å; W153-F161 HydrophobicContact CB-CD1 3.93Å; W153-F161 HydrophobicContact CB-CG 4.33Å; W153-F161 HydrophobicContact CG-CD1 4.4Å; W153-F161 WeakPolarHBondContact O-CB 3.28Å; W153-F161 PolarHBondContact O-N 2.82Å; W153-I167 HydrophobicContact CD2-CD1 4.2Å; W153-I167 HydrophobicContact CE3-CD1 4.29Å; W153-I167 HydrophobicContact CZ2-CD1 4.47Å; W153-I167 HydrophobicContact CZ3-CD1 4.46Å; W153-A174 HydrophobicContact CZ3-CB 4.17Å; W153-T183 HydrophobicContact CH2-CG2 3.52Å; W153-T183 HydrophobicContact CZ2-CG2 3.83Å
154	K	97.4	Very high	93.6	Very high	54 Å²	54	68 Å²	68	24%	0.235	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	145.2	178.5	-67.6	-165.2	-175.3	154.9	0	112.5	K146 E148 T152 Q159 D160	K146-K154 PolarHBondContact N-O 2.89Å; K146-K154 PolarHBondContact O-N 3.37Å; E148-K154 IonicContact OE1-NZ 3.69Å; E148-K154 WeakPolarHBondContact OE2-CD 3.32Å; E148-K154 VanDerWaalsContact OE2-CE 3.28Å; E148-K154 WeakPolarHBondContact OE2-CE 3.47Å; E148-K154 IonicContact OE2-NZ 2.75Å; E148-K154 PolarHBondContact OE2-NZ 3.32Å; T152-K154 HydrophobicContact CG2-CG 4.27Å; K154-Q159 WeakPolarHBondContact CA-O 3.41Å; K154-D160 WeakPolarHBondContact CE-OD1 3.15Å
155	W	98	Very high	93.5	Very high	14 Å²	14	69.4 Å²	69.4	5%	0.053	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	153.6	169.3	-68.5	112	0	0	0	110.9	V122 I123 G144 L145 N157 G158 Q159 F161 F165	V122-W155 HydrophobicContact CB-CE3 4.28Å; V122-W155 HydrophobicContact CG1-CB 4.18Å; V122-W155 HydrophobicContact CG1-CD2 3.85Å; V122-W155 HydrophobicContact CG1-CE3 3.98Å; V122-W155 HydrophobicContact CG1-CG 3.93Å; V122-W155 HydrophobicContact CG2-CB 4.24Å; V122-W155 HydrophobicContact CG2-CE3 4.31Å; I123-W155 HydrophobicContact CB-CH2 3.72Å; I123-W155 HydrophobicContact CB-CZ2 4.35Å; I123-W155 HydrophobicContact CB-CZ3 4.32Å; I123-W155 HydrophobicContact CD1-CH2 4.34Å; I123-W155 HydrophobicContact CG1-CH2 3.8Å; I123-W155 HydrophobicContact CG1-CZ3 4.03Å; G144-W155 CarbonylContact O-C 3.55Å; G144-W155 VanDerWaalsContact O-C 3.27Å; G144-W155 WeakPolarHBondContact O-CA 3.31Å; L145-W155 HydrophobicContact CB-CE3 3.83Å; L145-W155 HydrophobicContact CB-CH2 4.16Å; L145-W155 HydrophobicContact CB-CZ3 3.63Å; L145-W155 HydrophobicContact CD1-CD2 4Å; L145-W155 HydrophobicContact CD1-CE3 4.16Å; L145-W155 HydrophobicContact CD1-CG 4.48Å; L145-W155 HydrophobicContact CD1-CZ2 4.37Å; L145-W155 HydrophobicContact CD1-CZ3 4.42Å; L145-W155 HydrophobicContact CD2-CH2 3.98Å; L145-W155 HydrophobicContact CD2-CZ2 4.23Å; L145-W155 HydrophobicContact CD2-CZ3 4.32Å; L145-W155 HydrophobicContact CG-CE3 4.49Å; L145-W155 HydrophobicContact CG-CH2 4.46Å; L145-W155 HydrophobicContact CG-CZ3 4.35Å; W155-N157 WeakPolarHBondContact CB-OD1 3.45Å; W155-N157 PolarHBondContact O-N 3.27Å; W155-N157 VanDerWaalsContact O-N 3.12Å; W155-G158 WeakPolarHBondContact O-CA 3.48Å; W155-G158 PolarHBondContact O-N 3.32Å; W155-Q159 PolarHBondContact N-O 2.91Å; W155-F161 AromaticContact CE2-CD2 3.88Å; W155-F161 AromaticContact CZ2-CD2 3.73Å; W155-F161 HydrophobicContact CZ2-CD2 3.73Å; W155-F161 HydrophobicContact CZ2-CE2 4.03Å; W155-F161 AromaticContact NE1-CD2 3.69Å; W155-F165 HydrophobicContact CH2-CE1 4.06Å; W155-F165 AromaticContact CH2-CZ 3.72Å; W155-F165 HydrophobicContact CH2-CZ 3.72Å; W155-F165 AromaticContact CZ2-CE1 3.91Å; W155-F165 HydrophobicContact CZ2-CE1 3.91Å; W155-F165 AromaticContact CZ2-CZ 3.84Å; W155-F165 HydrophobicContact CZ2-CZ 3.84Å
156	A	97.5	Very high	93.3	Very high	27 Å²	27	75.9 Å²	75.9	22%	0.223	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-14.5	-180	0	0	0	0	0	113.2	T119 L120 G144 G158	T119-A156 HydrophobicContact CG2-CB 4.42Å; L120-A156 HydrophobicContact CB-CB 4.47Å; G144-A156 PolarHBondContact O-N 3.46Å; A156-G158 VanDerWaalsContact C-N 3.27Å
157	N	94.7	Very high	93.2	Very high	72 Å²	72	73.7 Å²	73.7	39%	0.385	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	3.1	169.4	69.7	-3	0	0	0	113.3	V122 W155 Q159	V122-N157 HydrophobicContact CG2-CB 4.18Å; W155-N157 WeakPolarHBondContact CB-OD1 3.45Å; W155-N157 PolarHBondContact O-N 3.27Å; W155-N157 VanDerWaalsContact O-N 3.12Å; N157-Q159 WeakPolarHBondContact OD1-CB 3.42Å; N157-Q159 PolarHBondContact OD1-N 3.45Å
158	G	94.3	Very high	93.1	Very high	54 Å²	54	75.5 Å²	75.5	56%	0.557	41%	0.408	S	S	*	.	S	Bend	trans	87.5	-3.1	179	0	0	0	0	0	115.3	W155 A156	W155-G158 WeakPolarHBondContact O-CA 3.48Å; W155-G158 PolarHBondContact O-N 3.32Å; A156-G158 VanDerWaalsContact C-N 3.27Å
159	Q	95.4	Very high	93.5	Very high	116 Å²	116	74.8 Å²	74.8	54%	0.542	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-77.9	142.7	178.5	-65.9	-174.2	-15.6	0	0	111.9	K154 W155 N157	K154-Q159 WeakPolarHBondContact CA-O 3.41Å; W155-Q159 PolarHBondContact N-O 2.91Å; N157-Q159 WeakPolarHBondContact OD1-CB 3.42Å; N157-Q159 PolarHBondContact OD1-N 3.45Å
160	D	96	Very high	94.1	Very high	105 Å²	105	74.9 Å²	74.9	56%	0.561	42%	0.417	S	S	*	.	B	Isolated β-bridge	trans	-68	139.3	172.9	-65.3	-26.6	0	0	0	110.9	K154 N162	K154-D160 WeakPolarHBondContact CE-OD1 3.15Å; D160-N162 PolarHBondContact O-N 2.9Å
161	F	97	Very high	94.9	Very high	7 Å²	7	74.2 Å²	74.2	3%	0.031	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-76.5	120.8	173.8	176.9	-127.2	0	0	0	110.2	L145 W153 W155 H163 W164 F165 I167	L145-F161 HydrophobicContact CD1-CB 3.72Å; L145-F161 HydrophobicContact CD1-CD1 4.38Å; L145-F161 HydrophobicContact CD1-CD2 4.41Å; L145-F161 HydrophobicContact CD1-CG 3.94Å; L145-F161 HydrophobicContact CD2-CD1 4.32Å; L145-F161 HydrophobicContact CD2-CD2 4.43Å; L145-F161 HydrophobicContact CD2-CE1 4.39Å; L145-F161 HydrophobicContact CD2-CG 4.33Å; W153-F161 HydrophobicContact CB-CB 3.79Å; W153-F161 HydrophobicContact CB-CD1 3.93Å; W153-F161 HydrophobicContact CB-CG 4.33Å; W153-F161 HydrophobicContact CG-CD1 4.4Å; W153-F161 WeakPolarHBondContact O-CB 3.28Å; W153-F161 PolarHBondContact O-N 2.82Å; W155-F161 AromaticContact CE2-CD2 3.88Å; W155-F161 AromaticContact CZ2-CD2 3.73Å; W155-F161 HydrophobicContact CZ2-CD2 3.73Å; W155-F161 HydrophobicContact CZ2-CE2 4.03Å; W155-F161 AromaticContact NE1-CD2 3.69Å; F161-H163 AromaticContact CD1-ND1 3.85Å; F161-H163 VanDerWaalsContact CE1-CA 3.49Å; F161-H163 HydrophobicContact CE1-CB 4.36Å; F161-H163 AromaticContact CE1-ND1 3.91Å; F161-H163 PolarHBondContact O-CD2 2.92Å; F161-H163 VanDerWaalsContact O-CD2 3.28Å; F161-H163 PolarHBondContact O-N 3.47Å; F161-W164 AromaticContact CE2-CD1 3.59Å; F161-W164 HydrophobicContact CE2-CG 4.47Å; F161-W164 AromaticContact CE2-NE1 3.98Å; F161-F165 HydrophobicContact CD2-CE1 4.38Å; F161-F165 HydrophobicContact CD2-CZ 4.33Å; F161-F165 HydrophobicContact CE1-CE2 4.33Å; F161-F165 AromaticContact CE2-CD1 3.78Å; F161-F165 HydrophobicContact CE2-CD1 3.78Å; F161-F165 HydrophobicContact CE2-CD2 4.36Å; F161-F165 AromaticContact CE2-CE1 3.33Å; F161-F165 HydrophobicContact CE2-CE1 3.33Å; F161-F165 AromaticContact CE2-CE2 3.96Å; F161-F165 HydrophobicContact CE2-CE2 3.96Å; F161-F165 HydrophobicContact CE2-CG 4.28Å; F161-F165 AromaticContact CE2-CZ 3.41Å; F161-F165 HydrophobicContact CE2-CZ 3.41Å; F161-F165 VanDerWaalsContact CE2-CZ 3.41Å; F161-F165 AromaticContact CZ-CD1 3.87Å; F161-F165 HydrophobicContact CZ-CD1 3.87Å; F161-F165 AromaticContact CZ-CD2 3.72Å; F161-F165 HydrophobicContact CZ-CD2 3.72Å; F161-F165 AromaticContact CZ-CE1 3.7Å; F161-F165 HydrophobicContact CZ-CE1 3.7Å; F161-F165 AromaticContact CZ-CE2 3.53Å; F161-F165 HydrophobicContact CZ-CE2 3.53Å; F161-F165 AromaticContact CZ-CG 3.88Å; F161-F165 HydrophobicContact CZ-CG 3.88Å; F161-F165 AromaticContact CZ-CZ 3.52Å; F161-F165 HydrophobicContact CZ-CZ 3.52Å; F161-F165 WeakPolarHBondContact CZ-O 3.4Å; F161-I167 HydrophobicContact CD1-CD1 4.22Å; F161-I167 HydrophobicContact CE1-CD1 3.66Å; F161-I167 HydrophobicContact CE1-CG1 4.33Å; F161-I167 HydrophobicContact CZ-CD1 4.32Å
162	N	95.9	Very high	95.6	Very high	120 Å²	120	73.8 Å²	73.8	64%	0.642	40%	0.402	S	S	*	.			trans	-83.2	14.6	-178.2	70.7	1.5	0	0	0	114.3	D160 W164	D160-N162 PolarHBondContact O-N 2.9Å; N162-W164 VanDerWaalsContact C-N 3.28Å; N162-W164 PolarHBondContact O-N 2.97Å; N162-W164 WeakPolarHBondContact OD1-CB 3.18Å; N162-W164 PolarHBondContact OD1-N 2.75Å
163	H	95.3	Very high	95.9	Very high	128 Å²	128	71.5 Å²	71.5	59%	0.593	39%	0.388	S	S	*	.			trans	59.8	28.8	176.6	-57	-84.3	0	0	0	115.7	F161 F165	F161-H163 AromaticContact CD1-ND1 3.85Å; F161-H163 VanDerWaalsContact CE1-CA 3.49Å; F161-H163 HydrophobicContact CE1-CB 4.36Å; F161-H163 AromaticContact CE1-ND1 3.91Å; F161-H163 PolarHBondContact O-CD2 2.92Å; F161-H163 VanDerWaalsContact O-CD2 3.28Å; F161-H163 PolarHBondContact O-N 3.47Å; H163-F165 PolarHBondContact O-N 3.42Å
164	W	96.6	Very high	96	Very high	95 Å²	95	69.8 Å²	69.8	36%	0.36	38%	0.381	S	S	.	.			trans	-70.8	-10.4	-179.2	74.3	-85	0	0	0	115.1	I123 R126 M129 F161 N162	I123-W164 HydrophobicContact CB-CZ2 4.45Å; I123-W164 HydrophobicContact CG2-CH2 4.3Å; I123-W164 HydrophobicContact CG2-CZ2 3.88Å; R126-W164 HydrophobicContact CB-CH2 4.47Å; R126-W164 HydrophobicContact CB-CZ3 4.18Å; M129-W164 HydrophobicContact CB-CH2 4.12Å; M129-W164 HydrophobicContact CE-CH2 3.77Å; M129-W164 HydrophobicContact CE-CZ2 4.01Å; F161-W164 AromaticContact CE2-CD1 3.59Å; F161-W164 HydrophobicContact CE2-CG 4.47Å; F161-W164 AromaticContact CE2-NE1 3.98Å; N162-W164 VanDerWaalsContact C-N 3.28Å; N162-W164 PolarHBondContact O-N 2.97Å; N162-W164 WeakPolarHBondContact OD1-CB 3.18Å; N162-W164 PolarHBondContact OD1-N 2.75Å
165	F	96.3	Very high	96.1	Very high	31 Å²	31	67.2 Å²	67.2	14%	0.136	37%	0.37	C	S	.	.	S	Bend	trans	-137	157.7	169.3	57.3	-99.8	0	0	0	111.1	M129 L145 W155 F161 H163 I167 I181	M129-F165 HydrophobicContact CE-CB 4.42Å; M129-F165 HydrophobicContact CE-CD1 3.36Å; M129-F165 HydrophobicContact CE-CD2 4.16Å; M129-F165 HydrophobicContact CE-CE1 3.46Å; M129-F165 VanDerWaalsContact CE-CE1 3.46Å; M129-F165 HydrophobicContact CE-CE2 4.24Å; M129-F165 HydrophobicContact CE-CG 3.74Å; M129-F165 HydrophobicContact CE-CZ 3.93Å; L145-F165 HydrophobicContact CD2-CE2 3.93Å; L145-F165 HydrophobicContact CD2-CZ 3.77Å; W155-F165 HydrophobicContact CH2-CE1 4.06Å; W155-F165 AromaticContact CH2-CZ 3.72Å; W155-F165 HydrophobicContact CH2-CZ 3.72Å; W155-F165 AromaticContact CZ2-CE1 3.91Å; W155-F165 HydrophobicContact CZ2-CE1 3.91Å; W155-F165 AromaticContact CZ2-CZ 3.84Å; W155-F165 HydrophobicContact CZ2-CZ 3.84Å; F161-F165 HydrophobicContact CD2-CE1 4.38Å; F161-F165 HydrophobicContact CD2-CZ 4.33Å; F161-F165 HydrophobicContact CE1-CE2 4.33Å; F161-F165 AromaticContact CE2-CD1 3.78Å; F161-F165 HydrophobicContact CE2-CD1 3.78Å; F161-F165 HydrophobicContact CE2-CD2 4.36Å; F161-F165 AromaticContact CE2-CE1 3.33Å; F161-F165 HydrophobicContact CE2-CE1 3.33Å; F161-F165 AromaticContact CE2-CE2 3.96Å; F161-F165 HydrophobicContact CE2-CE2 3.96Å; F161-F165 HydrophobicContact CE2-CG 4.28Å; F161-F165 AromaticContact CE2-CZ 3.41Å; F161-F165 HydrophobicContact CE2-CZ 3.41Å; F161-F165 VanDerWaalsContact CE2-CZ 3.41Å; F161-F165 AromaticContact CZ-CD1 3.87Å; F161-F165 HydrophobicContact CZ-CD1 3.87Å; F161-F165 AromaticContact CZ-CD2 3.72Å; F161-F165 HydrophobicContact CZ-CD2 3.72Å; F161-F165 AromaticContact CZ-CE1 3.7Å; F161-F165 HydrophobicContact CZ-CE1 3.7Å; F161-F165 AromaticContact CZ-CE2 3.53Å; F161-F165 HydrophobicContact CZ-CE2 3.53Å; F161-F165 AromaticContact CZ-CG 3.88Å; F161-F165 HydrophobicContact CZ-CG 3.88Å; F161-F165 AromaticContact CZ-CZ 3.52Å; F161-F165 HydrophobicContact CZ-CZ 3.52Å; F161-F165 WeakPolarHBondContact CZ-O 3.4Å; H163-F165 PolarHBondContact O-N 3.42Å; F165-I167 HydrophobicContact CD2-CG1 3.91Å; F165-I167 HydrophobicContact CE2-CD1 4.09Å; F165-I167 HydrophobicContact CE2-CG1 3.69Å; F165-I181 HydrophobicContact CD2-CD1 3.6Å; F165-I181 HydrophobicContact CE2-CD1 3.71Å; F165-I181 HydrophobicContact CE2-CG2 4.27Å; F165-I181 HydrophobicContact CG-CD1 4.17Å; F165-I181 HydrophobicContact CZ-CD1 4.36Å
166	N	94.9	Very high	96.1	Very high	135 Å²	135	66.6 Å²	66.6	72%	0.722	37%	0.368	S	S	*	.			trans	-81.6	144.9	175.9	-167.8	26.9	0	0	0	111.1
167	I	95.1	Very high	96.1	Very high	26 Å²	26	66.7 Å²	66.7	13%	0.133	37%	0.365	C	S	.	.			trans	-123.5	127.3	175.2	-51	167.2	0	0	0	106.4	L145 W153 F161 F165 I181 T183	L145-I167 HydrophobicContact CD2-CD1 3.49Å; L145-I167 VanDerWaalsContact CD2-CD1 3.49Å; L145-I167 HydrophobicContact CD2-CG1 4.46Å; L145-I167 HydrophobicContact CG-CD1 4.42Å; W153-I167 HydrophobicContact CD2-CD1 4.2Å; W153-I167 HydrophobicContact CE3-CD1 4.29Å; W153-I167 HydrophobicContact CZ2-CD1 4.47Å; W153-I167 HydrophobicContact CZ3-CD1 4.46Å; F161-I167 HydrophobicContact CD1-CD1 4.22Å; F161-I167 HydrophobicContact CE1-CD1 3.66Å; F161-I167 HydrophobicContact CE1-CG1 4.33Å; F161-I167 HydrophobicContact CZ-CD1 4.32Å; F165-I167 HydrophobicContact CD2-CG1 3.91Å; F165-I167 HydrophobicContact CE2-CD1 4.09Å; F165-I167 HydrophobicContact CE2-CG1 3.69Å; I167-I181 HydrophobicContact CG2-CG2 4.32Å; I167-T183 HydrophobicContact CG2-CG2 3.51Å
168	T	95.4	Very high	96.3	Very high	65 Å²	65	66.6 Å²	66.6	40%	0.399	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-97.3	142	-177.7	58.3	0	0	0	0	111.4	I181 T182 T183	T168-I181 PolarHBondContact N-O 3.33Å; T168-I181 VanDerWaalsContact N-O 3.14Å; T168-I181 PolarHBondContact OG1-O 3.06Å; T168-T182 CarbonylContact O-C 3.42Å; T168-T182 VanDerWaalsContact O-CA 3.23Å; T168-T182 WeakPolarHBondContact O-CA 3.16Å; T168-T182 VanDerWaalsContact OG1-CG2 3.25Å; T168-T182 WeakPolarHBondContact OG1-CG2 3.33Å; T168-T183 PolarHBondContact O-N 2.95Å; T168-T183 PolarHBondContact O-OG1 3.3Å
169	G	94.4	Very high	96.4	Very high	66 Å²	66	68 Å²	68	68%	0.68	36%	0.362	S	S	*	.	S	Bend	trans	111.7	-175.2	177.5	0	0	0	0	0	113.9	T183	G169-T183 VanDerWaalsContact CA-OG1 3.26Å; G169-T183 WeakPolarHBondContact CA-OG1 3.24Å
170	S	93.3	Very high	96.3	Very high	110 Å²	110	66.5 Å²	66.5	77%	0.769	36%	0.358	S	S	*	.	S	Bend	trans	-126.4	1.8	-171.9	54.1	0	0	0	0	114.4	T183	S170-T183 PolarHBondContact N-OG1 3.37Å
171	E	96.2	Very high	96.4	Very high	84 Å²	84	62.2 Å²	62.2	39%	0.393	33%	0.334	S	S	.	.	S	Bend	trans	-86.2	177.9	-179.4	-60.9	-57.9	146	0	0	111.6	T183 V184	E171-T183 PolarHBondContact N-OG1 3.47Å; E171-T183 WeakPolarHBondContact O-CB 3.39Å; E171-T183 WeakPolarHBondContact O-CG2 3.29Å; E171-V184 WeakPolarHBondContact CB-O 2.82Å
172	R	96.1	Very high	96.5	Very high	157 Å²	157	63.3 Å²	63.3	59%	0.592	34%	0.342	S	S	*	.	S	Bend	trans	-100.1	-19.8	-171.3	-63.5	-168.2	-178.3	118.6	-1.3	115.2	K146 N147	K146-R172 CarbonylContact C-O 3.51Å; K146-R172 WeakPolarHBondContact CA-O 3.25Å; K146-R172 WeakPolarHBondContact CG-O 3.23Å; N147-R172 HydrophobicContact CB-CB 4.25Å; N147-R172 HydrophobicContact CB-CG 4.43Å; N147-R172 PolarHBondContact N-O 2.75Å
173	C	98.3	Very high	96.6	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	129.9	-177.1	-74.3	0	0	0	0	110.2	W106 W142 T183 V184 C186	W106-C173 HydrophobicContact CB-CB 4.12Å; W106-C173 HydrophobicContact CG-CB 3.91Å; W142-C173 HydrophobicContact CE3-CB 4.16Å; W142-C173 HydrophobicContact CH2-CB 3.99Å; W142-C173 HydrophobicContact CZ3-CB 3.57Å; C173-T183 CarbonylContact O-C 3.5Å; C173-T183 VanDerWaalsContact O-CA 3.29Å; C173-T183 WeakPolarHBondContact O-CA 3.13Å; C173-V184 PolarHBondContact N-O 3.48Å; C173-V184 PolarHBondContact O-N 2.93Å; C173-C186 HydrophobicContact CB-CB 3.97Å; C173-C186 WeakPolarHBondContact CB-SG 3.43Å; C173-C186 VanDerWaalsContact SG-CA 3.59Å; C173-C186 WeakPolarHBondContact SG-CB 3.19Å; C173-C186 CovalentContact SG-SG 2.03Å; C173-C186 PolarHBondContact SG-SG 3.47Å
174	A	98.3	Very high	96.7	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	137.1	-178.7	0	0	0	0	0	111.5	I143 L145 W153 T182	I143-A174 HydrophobicContact CD1-CB 4.07Å; I143-A174 HydrophobicContact CG1-CB 3.91Å; I143-A174 WeakPolarHBondContact CG1-O 3.48Å; I143-A174 PolarHBondContact N-O 2.96Å; I143-A174 VanDerWaalsContact N-O 3.14Å; L145-A174 HydrophobicContact CB-CB 3.89Å; L145-A174 HydrophobicContact CD2-CB 4.33Å; L145-A174 HydrophobicContact CG-CB 4.22Å; L145-A174 VanDerWaalsContact O-CB 3.32Å; L145-A174 WeakPolarHBondContact O-CB 3.49Å; L145-A174 PolarHBondContact O-N 3.37Å; W153-A174 HydrophobicContact CZ3-CB 4.17Å; A174-T182 CarbonylContact C-O 3.53Å; A174-T182 VanDerWaalsContact CA-O 3.32Å; A174-T182 WeakPolarHBondContact CA-O 3.38Å
175	S	98.6	Very high	96.7	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	163.1	169.2	65.9	0	0	0	0	110.2	H141 I181 T182 V184	H141-S175 CarbonylContact O-C 3.59Å; H141-S175 WeakPolarHBondContact O-CA 3.22Å; H141-S175 WeakPolarHBondContact O-CB 3.32Å; S175-I181 WeakPolarHBondContact O-CA 3.34Å; S175-I181 WeakPolarHBondContact O-CG2 3.34Å; S175-T182 PolarHBondContact N-O 2.95Å; S175-T182 PolarHBondContact O-N 2.94Å; S175-T182 PolarHBondContact OG-OG1 2.82Å; S175-V184 WeakPolarHBondContact OG-CG2 3.28Å
176	L	98.4	Very high	96.8	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	155.4	169.7	68.5	76.7	0	0	0	111.3	I123 L132 K133 A136 E140 H141 I143 D180 I181	I123-L176 HydrophobicContact CD1-CD2 3.93Å; L132-L176 HydrophobicContact CB-CD1 4.41Å; L132-L176 HydrophobicContact CB-CD2 3.83Å; L132-L176 HydrophobicContact CD1-CD2 4.21Å; K133-L176 HydrophobicContact CG-CD1 4.4Å; A136-L176 HydrophobicContact CB-CD1 3.49Å; A136-L176 VanDerWaalsContact CB-CD1 3.49Å; E140-L176 WeakPolarHBondContact CA-O 3.5Å; H141-L176 PolarHBondContact N-O 3.27Å; H141-L176 PolarHBondContact O-N 2.9Å; I143-L176 HydrophobicContact CD1-CD2 4.48Å; I143-L176 HydrophobicContact CG2-CD2 3.41Å; I143-L176 VanDerWaalsContact CG2-CD2 3.41Å; I143-L176 HydrophobicContact CG2-CG 3.69Å; L176-D180 WeakPolarHBondContact CA-O 3.33Å; L176-I181 HydrophobicContact CB-CG1 4.18Å
177	N	98.1	Very high	97	Very high	30 Å²	30	52.7 Å²	52.7	16%	0.16	30%	0.296	C	S	.	.			trans	-132.4	-166.1	162.2	66.1	17.7	0	0	0	108.8	K133 T179 D180	K133-N177 WeakPolarHBondContact CB-O 3.28Å; K133-N177 WeakPolarHBondContact CE-O 3.48Å; K133-N177 VanDerWaalsContact CG-O 3.28Å; K133-N177 WeakPolarHBondContact CG-O 3.33Å; N177-T179 PolarHBondContact O-N 3.32Å; N177-T179 WeakPolarHBondContact OD1-CA 3.2Å; N177-T179 PolarHBondContact OD1-N 3.1Å; N177-D180 PolarHBondContact N-O 2.91Å; N177-D180 PolarHBondContact OD1-N 3.45Å
178	N	97.8	Very high	97.1	Very high	70 Å²	70	53 Å²	53	37%	0.374	30%	0.302	S	S	.	.	S	Bend	trans	-61.9	-23.3	177.7	62.1	2.1	0	0	0	114.5	K133 G137	K133-N178 WeakPolarHBondContact CE-O 3.31Å; K133-N178 VanDerWaalsContact O-CA 3.31Å; K133-N178 WeakPolarHBondContact O-CA 3.33Å; G137-N178 WeakPolarHBondContact O-CB 3.35Å; G137-N178 PolarHBondContact O-N 2.88Å
179	T	96.3	Very high	97.3	Very high	84 Å²	84	53.6 Å²	53.6	52%	0.515	31%	0.309	S	S	.	.	S	Bend	trans	-106	-46.1	-168.8	-54.8	0	0	0	0	112.1	K133 N177	K133-T179 WeakPolarHBondContact CE-O 3.28Å; K133-T179 PolarHBondContact NZ-O 3.19Å; N177-T179 PolarHBondContact O-N 3.32Å; N177-T179 WeakPolarHBondContact OD1-CA 3.2Å; N177-T179 PolarHBondContact OD1-N 3.1Å
180	D	94.9	Very high	97.5	Very high	84 Å²	84	51.5 Å²	51.5	45%	0.449	28%	0.282	S	S	.	.			trans	-139.7	170.9	-168.2	-68.1	-48.5	0	0	0	113.1	L176 N177 T182	L176-D180 WeakPolarHBondContact CA-O 3.33Å; N177-D180 PolarHBondContact N-O 2.91Å; N177-D180 PolarHBondContact OD1-N 3.45Å; D180-T182 HydrophobicContact CB-CG2 4.18Å
181	I	97.9	Very high	97.8	Very high	14 Å²	14	48.1 Å²	48.1	7%	0.072	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	117.3	167.2	-53.3	169.2	0	0	0	105.9	M129 I143 F165 I167 T168 S175 L176	M129-I181 HydrophobicContact CE-CD1 3.21Å; M129-I181 HydrophobicContact SD-CD1 3.32Å; M129-I181 WeakPolarHBondContact SD-CD1 3.38Å; M129-I181 HydrophobicContact SD-CG1 4.13Å; I143-I181 HydrophobicContact CD1-CG2 4.12Å; F165-I181 HydrophobicContact CD2-CD1 3.6Å; F165-I181 HydrophobicContact CE2-CD1 3.71Å; F165-I181 HydrophobicContact CE2-CG2 4.27Å; F165-I181 HydrophobicContact CG-CD1 4.17Å; F165-I181 HydrophobicContact CZ-CD1 4.36Å; I167-I181 HydrophobicContact CG2-CG2 4.32Å; T168-I181 PolarHBondContact N-O 3.33Å; T168-I181 VanDerWaalsContact N-O 3.14Å; T168-I181 PolarHBondContact OG1-O 3.06Å; S175-I181 WeakPolarHBondContact O-CA 3.34Å; S175-I181 WeakPolarHBondContact O-CG2 3.34Å; L176-I181 HydrophobicContact CB-CG1 4.18Å
182	T	97.6	Very high	97.9	Very high	30 Å²	30	44.9 Å²	44.9	18%	0.184	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	165.5	-173.3	58.1	0	0	0	0	109.8	T168 A174 S175 D180	T168-T182 CarbonylContact O-C 3.42Å; T168-T182 VanDerWaalsContact O-CA 3.23Å; T168-T182 WeakPolarHBondContact O-CA 3.16Å; T168-T182 VanDerWaalsContact OG1-CG2 3.25Å; T168-T182 WeakPolarHBondContact OG1-CG2 3.33Å; A174-T182 CarbonylContact C-O 3.53Å; A174-T182 VanDerWaalsContact CA-O 3.32Å; A174-T182 WeakPolarHBondContact CA-O 3.38Å; S175-T182 PolarHBondContact N-O 2.95Å; S175-T182 PolarHBondContact O-N 2.94Å; S175-T182 PolarHBondContact OG-OG1 2.82Å; D180-T182 HydrophobicContact CB-CG2 4.18Å
183	T	97.9	Very high	98	Very high	15 Å²	15	37.4 Å²	37.4	9%	0.092	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	136.3	167.8	66.2	0	0	0	0	109.8	W153 I167 T168 G169 S170 E171 C173	W153-T183 HydrophobicContact CH2-CG2 3.52Å; W153-T183 HydrophobicContact CZ2-CG2 3.83Å; I167-T183 HydrophobicContact CG2-CG2 3.51Å; T168-T183 PolarHBondContact O-N 2.95Å; T168-T183 PolarHBondContact O-OG1 3.3Å; G169-T183 VanDerWaalsContact CA-OG1 3.26Å; G169-T183 WeakPolarHBondContact CA-OG1 3.24Å; S170-T183 PolarHBondContact N-OG1 3.37Å; E171-T183 PolarHBondContact N-OG1 3.47Å; E171-T183 WeakPolarHBondContact O-CB 3.39Å; E171-T183 WeakPolarHBondContact O-CG2 3.29Å; C173-T183 CarbonylContact O-C 3.5Å; C173-T183 VanDerWaalsContact O-CA 3.29Å; C173-T183 WeakPolarHBondContact O-CA 3.13Å
184	V	97.8	Very high	98	Very high	28 Å²	28	37.5 Å²	37.5	17%	0.17	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	154.8	177.4	-177.4	0	0	0	0	109.7	W142 E171 C173 S175 C186 A188 L190	W142-V184 HydrophobicContact CH2-CB 3.56Å; W142-V184 HydrophobicContact CH2-CG1 3.78Å; W142-V184 HydrophobicContact CZ3-CB 3.77Å; W142-V184 HydrophobicContact CZ3-CG1 4.45Å; E171-V184 WeakPolarHBondContact CB-O 2.82Å; C173-V184 PolarHBondContact N-O 3.48Å; C173-V184 PolarHBondContact O-N 2.93Å; S175-V184 WeakPolarHBondContact OG-CG2 3.28Å; V184-C186 PolarHBondContact O-N 3.4Å; V184-A188 HydrophobicContact CG1-CB 3.72Å; V184-L190 HydrophobicContact CB-CD1 4.32Å; V184-L190 HydrophobicContact CG1-CD1 4.25Å; V184-L190 HydrophobicContact CG2-CD1 4.29Å
185	D	97.6	Very high	98	Very high	89 Å²	89	37.8 Å²	37.8	48%	0.476	21%	0.213	S	C	.	.			trans	-54.6	126	172.8	-175.4	-17.4	0	0	0	109.2	W142 E187 A188	W142-D185 VanDerWaalsContact CH2-O 3.28Å; W142-D185 WeakPolarHBondContact CH2-O 3.47Å; D185-E187 PolarHBondContact O-N 2.98Å; D185-E187 VanDerWaalsContact O-N 3.08Å; D185-E187 PolarHBondContact OD1-N 3.03Å; D185-E187 VanDerWaalsContact OD1-N 3.12Å; D185-A188 WeakPolarHBondContact O-CB 3.42Å; D185-A188 PolarHBondContact O-N 2.88Å
186	C	98.1	Very high	97.9	Very high	18 Å²	18	38.8 Å²	38.8	12%	0.122	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-22.5	-174.3	-64.1	0	0	0	0	114	S105 W106 C173 V184	S105-C186 WeakPolarHBondContact CB-O 3.32Å; W106-C186 HydrophobicContact CB-CB 4.4Å; W106-C186 PolarHBondContact N-O 3.22Å; C173-C186 HydrophobicContact CB-CB 3.97Å; C173-C186 WeakPolarHBondContact CB-SG 3.43Å; C173-C186 VanDerWaalsContact SG-CA 3.59Å; C173-C186 WeakPolarHBondContact SG-CB 3.19Å; C173-C186 CovalentContact SG-SG 2.03Å; C173-C186 PolarHBondContact SG-SG 3.47Å; V184-C186 PolarHBondContact O-N 3.4Å
187	E	98.4	Very high	97.8	Very high	137 Å²	137	43.6 Å²	43.6	64%	0.64	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-7.2	177.4	-60.2	-52.9	134	0	0	113.3	D185	D185-E187 PolarHBondContact O-N 2.98Å; D185-E187 VanDerWaalsContact O-N 3.08Å; D185-E187 PolarHBondContact OD1-N 3.03Å; D185-E187 VanDerWaalsContact OD1-N 3.12Å
188	A	98.6	Very high	97.4	Very high	31 Å²	31	44.8 Å²	44.8	26%	0.256	25%	0.252	S	S	.	.	S	Bend	trans	-62	147.1	174.2	0	0	0	0	0	111.3	S105 W142 V184 D185 L190	S105-A188 WeakPolarHBondContact CA-O 3.29Å; W142-A188 HydrophobicContact CH2-CB 4.47Å; W142-A188 HydrophobicContact CZ2-CB 4.1Å; W142-A188 WeakPolarHBondContact CZ2-O 3.32Å; V184-A188 HydrophobicContact CG1-CB 3.72Å; D185-A188 WeakPolarHBondContact O-CB 3.42Å; D185-A188 PolarHBondContact O-N 2.88Å; A188-L190 PolarHBondContact O-N 3.4Å
189	S	98.6	Very high	96.4	Very high	78 Å²	78	52.2 Å²	52.2	55%	0.545	28%	0.275	S	S	.	.			trans	-94	99.9	178.1	-64.6	0	0	0	0	110.4
190	L	98.8	Very high	96.4	Very high	23 Å²	23	50.7 Å²	50.7	12%	0.12	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-116.3	163.2	175.5	-54	-176.5	0	0	0	110.6	T103 N104 E140 W142 V184 A188	T103-L190 CarbonylContact C-O 3.47Å; T103-L190 WeakPolarHBondContact CA-O 3.44Å; T103-L190 WeakPolarHBondContact CB-O 3.24Å; N104-L190 PolarHBondContact N-O 3.03Å; N104-L190 PolarHBondContact O-N 2.73Å; N104-L190 VanDerWaalsContact O-N 3.14Å; E140-L190 HydrophobicContact CB-CD1 4.05Å; E140-L190 HydrophobicContact CB-CD2 4.18Å; W142-L190 HydrophobicContact CD2-CB 4.17Å; W142-L190 HydrophobicContact CD2-CD1 3.82Å; W142-L190 HydrophobicContact CD2-CG 4.29Å; W142-L190 HydrophobicContact CE3-CD1 3.85Å; W142-L190 HydrophobicContact CG-CB 4.26Å; W142-L190 HydrophobicContact CH2-CD1 3.68Å; W142-L190 HydrophobicContact CH2-CG 4.27Å; W142-L190 HydrophobicContact CZ2-CB 4.31Å; W142-L190 HydrophobicContact CZ2-CD1 3.63Å; W142-L190 HydrophobicContact CZ2-CG 3.74Å; W142-L190 HydrophobicContact CZ3-CD1 3.78Å; V184-L190 HydrophobicContact CB-CD1 4.32Å; V184-L190 HydrophobicContact CG1-CD1 4.25Å; V184-L190 HydrophobicContact CG2-CD1 4.29Å; A188-L190 PolarHBondContact O-N 3.4Å
191	H	98.9	Very high	96.5	Very high	39 Å²	39	48.9 Å²	48.9	18%	0.181	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	171.2	162.2	-66.9	-78.5	0	0	0	109.1	S100 T102 E140 H141 W142	S100-H191 PolarHBondContact O-ND1 2.79Å; S100-H191 VanDerWaalsContact O-ND1 3.12Å; S100-H191 WeakPolarHBondContact OG-CA 3.32Å; S100-H191 WeakPolarHBondContact OG-CB 3.43Å; T102-H191 PolarHBondContact O-ND1 2.96Å; E140-H191 PolarHBondContact O-N 3.37Å; H141-H191 CarbonylContact C-O 3.6Å; H141-H191 VanDerWaalsContact CA-O 3.22Å; H141-H191 WeakPolarHBondContact CA-O 3.42Å; H141-H191 WeakPolarHBondContact CD2-CB 3.19Å; W142-H191 PolarHBondContact N-O 3.27Å
192	W	98.9	Very high	96.4	Very high	15 Å²	15	50.8 Å²	50.8	6%	0.057	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	158.6	178	70.4	91.6	0	0	0	111.9	S100 T102 N104 A109 L120 W142 C194	S100-W192 VanDerWaalsContact CB-CE3 3.43Å; S100-W192 PolarHBondContact N-O 3.47Å; S100-W192 PolarHBondContact OG-N 2.78Å; S100-W192 PolarHBondContact OG-O 2.94Å; T102-W192 VanDerWaalsContact O-CZ3 3.3Å; T102-W192 WeakPolarHBondContact O-CZ3 3.17Å; T102-W192 VanDerWaalsContact OG1-CH2 3.28Å; T102-W192 WeakPolarHBondContact OG1-CH2 3.29Å; N104-W192 HydrophobicContact CB-CE3 4.38Å; N104-W192 HydrophobicContact CB-CZ3 3.95Å; A109-W192 HydrophobicContact CB-CB 3.66Å; A109-W192 HydrophobicContact CB-CD2 3.69Å; A109-W192 HydrophobicContact CB-CE3 4.03Å; A109-W192 HydrophobicContact CB-CG 3.56Å; L120-W192 HydrophobicContact CD2-CB 3.64Å; L120-W192 HydrophobicContact CD2-CG 4.09Å; W142-W192 HydrophobicContact CB-CB 3.82Å; W192-C194 VanDerWaalsContact CD1-SG 3.57Å
193	V	98.8	Very high	96.3	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	129	172	-165	0	0	0	0	109.5	Y97 F98 F99 L120 A121 L132 H141 W142	Y97-V193 HydrophobicContact CD1-CG1 4.21Å; F98-V193 CarbonylContact O-C 3.43Å; F98-V193 VanDerWaalsContact O-CA 3.24Å; F98-V193 WeakPolarHBondContact O-CA 3.41Å; F98-V193 WeakPolarHBondContact O-CG1 3.36Å; F99-V193 HydrophobicContact CD1-CG1 4.29Å; F99-V193 HydrophobicContact CD1-CG2 3.55Å; F99-V193 HydrophobicContact CD2-CG1 4.09Å; F99-V193 HydrophobicContact CE1-CB 4.4Å; F99-V193 HydrophobicContact CE1-CG1 4.06Å; F99-V193 HydrophobicContact CE1-CG2 3.4Å; F99-V193 VanDerWaalsContact CE1-CG2 3.4Å; F99-V193 HydrophobicContact CE2-CG1 3.84Å; F99-V193 HydrophobicContact CG-CG1 4.29Å; F99-V193 HydrophobicContact CG-CG2 4.26Å; F99-V193 HydrophobicContact CZ-CG1 3.81Å; F99-V193 HydrophobicContact CZ-CG2 4Å; L120-V193 CarbonylContact C-O 3.45Å; L120-V193 WeakPolarHBondContact CA-O 3.47Å; A121-V193 HydrophobicContact CB-CB 3.88Å; A121-V193 HydrophobicContact CB-CG1 3.99Å; A121-V193 WeakPolarHBondContact CB-O 3.32Å; A121-V193 PolarHBondContact N-O 3.23Å; L132-V193 HydrophobicContact CD2-CB 4.45Å; L132-V193 HydrophobicContact CD2-CG1 3.76Å; H141-V193 HydrophobicContact CB-CG2 3.8Å; W142-V193 PolarHBondContact O-N 2.92Å; W142-V193 VanDerWaalsContact O-N 3.07Å
194	C	98.6	Very high	96.2	Very high	2 Å²	2	54.4 Å²	54.4	1%	0.014	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	152.9	168.8	-53.4	0	0	0	0	110.9	W89 Y97 F98 C113 A118 T119 W192	W89-C194 HydrophobicContact CH2-CB 3.66Å; W89-C194 HydrophobicContact CZ3-CB 3.95Å; Y97-C194 VanDerWaalsContact CA-O 3.27Å; Y97-C194 WeakPolarHBondContact CA-O 3.27Å; F98-C194 HydrophobicContact CB-CB 4.19Å; F98-C194 PolarHBondContact N-O 2.99Å; F98-C194 VanDerWaalsContact N-O 3.12Å; F98-C194 PolarHBondContact O-N 3.23Å; C113-C194 WeakPolarHBondContact CA-SG 3.39Å; C113-C194 HydrophobicContact CB-CB 3.7Å; C113-C194 WeakPolarHBondContact CB-SG 3.31Å; C113-C194 WeakPolarHBondContact SG-CA 3.39Å; C113-C194 WeakPolarHBondContact SG-CB 3.28Å; C113-C194 CovalentContact SG-SG 2.04Å; C113-C194 PolarHBondContact SG-SG 2.87Å; A118-C194 HydrophobicContact CB-CB 4.14Å; T119-C194 CarbonylContact O-C 3.27Å; T119-C194 WeakPolarHBondContact O-CA 3.49Å; W192-C194 VanDerWaalsContact CD1-SG 3.57Å
195	S	98.2	Very high	96.1	Very high	7 Å²	7	56.1 Å²	56.1	5%	0.049	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	142.7	167.8	73.4	0	0	0	0	112.8	C96 T119 A121 V122	C96-S195 VanDerWaalsContact O-CA 3.23Å; C96-S195 WeakPolarHBondContact O-CA 3.35Å; T119-S195 PolarHBondContact N-O 2.96Å; T119-S195 VanDerWaalsContact N-O 3.17Å; T119-S195 PolarHBondContact O-N 2.89Å; A121-S195 WeakPolarHBondContact CA-OG 3.31Å; V122-S195 PolarHBondContact N-OG 3.07Å
196	K	96.5	Very high	96	Very high	20 Å²	20	53.8 Å²	53.8	9%	0.087	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	157	167.7	56.3	-178.3	164.7	-172.7	0	110.9	E86 W89 K95 C96 E116 A118	E86-K196 IonicContact OE1-NZ 2.92Å; E86-K196 PolarHBondContact OE1-NZ 3.07Å; E86-K196 WeakPolarHBondContact OE2-CE 3.26Å; E86-K196 IonicContact OE2-NZ 3.85Å; E86-K196 PolarHBondContact OE2-NZ 3.33Å; W89-K196 HydrophobicContact CH2-CD 4.49Å; W89-K196 HydrophobicContact CZ3-CD 4.45Å; W89-K196 HydrophobicContact CZ3-CG 4.1Å; K95-K196 CarbonylContact C-O 3.43Å; K95-K196 VanDerWaalsContact CA-O 3.23Å; K95-K196 WeakPolarHBondContact CA-O 3.18Å; C96-K196 HydrophobicContact CB-CG 4.04Å; C96-K196 PolarHBondContact N-O 3.04Å; C96-K196 PolarHBondContact O-N 3.07Å; E116-K196 PolarHBondContact O-NZ 3.04Å; A118-K196 HydrophobicContact CB-CB 3.89Å; A118-K196 HydrophobicContact CB-CD 4.11Å; A118-K196 HydrophobicContact CB-CG 4.12Å
197	P	94.8	Very high	95.8	Very high	101 Å²	101	56.5 Å²	56.5	66%	0.656	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.8	159.4	170	-19.7	32.7	0	0	0	111.6
198	F	91.5	Very high	95.6	Very high	55 Å²	55	49.8 Å²	49.8	24%	0.241	26%	0.255	C	S	.	.			trans	-58.1	148.4	166.8	-68.9	-2.8	0	0	0	111	A83 C85 A91 R94 K95 C96	A83-F198 HydrophobicContact CB-CB 3.77Å; A83-F198 HydrophobicContact CB-CD2 3.87Å; A83-F198 HydrophobicContact CB-CG 4.32Å; A83-F198 VanDerWaalsContact O-CD2 3.23Å; A83-F198 WeakPolarHBondContact O-CD2 3.41Å; C85-F198 WeakPolarHBondContact SG-CE1 3.26Å; A91-F198 HydrophobicContact CB-CE1 4.01Å; A91-F198 HydrophobicContact CB-CZ 3.94Å; R94-F198 VanDerWaalsContact C-CE1 3.5Å; R94-F198 HydrophobicContact CB-CD2 4.37Å; R94-F198 PolarHBondContact O-N 3.13Å; K95-F198 VanDerWaalsContact C-CE1 3.46Å; K95-F198 VanDerWaalsContact N-CE1 3.32Å; K95-F198 VanDerWaalsContact O-CE1 3.24Å; K95-F198 WeakPolarHBondContact O-CE1 3.35Å; C96-F198 VanDerWaalsContact SG-CD1 3.57Å
199	R	75.6	Confident	95.4	Very high	227 Å²	227	51.5 Å²	51.5	86%	0.857	26%	0.255	S	S	*	.			trans	-69.9	0	171.9	-96.2	-170.7	177.2	124	6.7	112.9	A83 E86	A83-R199 WeakPolarHBondContact CA-O 3.36Å; A83-R199 VanDerWaalsContact CB-O 3.24Å; A83-R199 WeakPolarHBondContact CB-O 3.17Å; E86-R199 IonicContact OE1-CZ 3.3Å; E86-R199 VanDerWaalsContact OE1-CZ 3.3Å; E86-R199 IonicContact OE1-NH1 2.7Å; E86-R199 PolarHBondContact OE1-NH1 3.25Å; E86-R199 IonicContact OE1-NH2 3.57Å

Retrieved 199 of 199 residues in 37.6 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).