G4VLV1_SCHMA Loading...

Heterochromatin-stabilizing protein CFDP1

AlphaFold DB , UniProt , Accession G4VLV1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 237 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	57.4	Low	66	Low	247 Å²	247	148 Å²	148	100%	1.217	84%	0.843	S	S	*	*				0	103.9	0	-77.7	173.6	158.9	0	0	105.8
2	S	55.3	Low	66.9	Low	118 Å²	118	149.6 Å²	149.6	83%	0.825	84%	0.838	S	S	*	*			trans	-119	113.7	-173	-55.4	0	0	0	0	107.7
3	L	68.5	Low	67.7	Low	164 Å²	164	152.2 Å²	152.2	86%	0.859	84%	0.839	S	S	*	*			trans	-138.3	110.4	166.8	-78.1	169.4	0	0	0	106.9
4	S	60.5	Low	68.6	Low	118 Å²	118	155.1 Å²	155.1	83%	0.825	83%	0.834	S	S	*	*			trans	-115.4	113.1	168	48.8	0	0	0	0	105.8
5	E	70.7	Confident	69.2	Low	177 Å²	177	154.5 Å²	154.5	83%	0.827	83%	0.828	S	S	*	*			trans	-118.8	99.8	173.4	-69.8	175.6	165.5	0	0	106.8
6	D	66.5	Low	69.4	Low	167 Å²	167	149.9 Å²	149.9	89%	0.893	81%	0.809	S	S	*	*			trans	-92.5	118.4	159.8	-109.4	-40.4	0	0	0	105.9
7	D	67.9	Low	69.7	Low	157 Å²	157	147.6 Å²	147.6	84%	0.84	80%	0.804	S	S	*	*			trans	-132.7	94.1	162.5	-166.1	35	0	0	0	108.1
8	S	72	Confident	69	Low	113 Å²	113	146.9 Å²	146.9	79%	0.79	81%	0.805	S	S	*	*			trans	-92.3	102.3	176.4	-170.2	0	0	0	0	108.1	S10	S8-S10 PolarHBondContact O-N 3.44Å
9	T	65.1	Low	68.4	Low	123 Å²	123	149.6 Å²	149.6	76%	0.755	81%	0.808	S	S	*	*			trans	-71.6	106.3	175.4	-178.1	0	0	0	0	110.1	D11	T9-D11 PolarHBondContact O-N 3.02Å
10	S	71	Confident	67.3	Low	86 Å²	86	147.3 Å²	147.3	60%	0.601	81%	0.81	S	S	*	*			trans	-72.8	111.1	173.8	-174	0	0	0	0	109.8	S8 E12	S8-S10 PolarHBondContact O-N 3.44Å; S10-E12 PolarHBondContact O-N 3.29Å
11	D	70.9	Confident	66.6	Low	158 Å²	158	144.9 Å²	144.9	85%	0.845	80%	0.804	S	S	*	*			trans	-88.9	83.9	177.7	-133.8	0.9	0	0	0	108.6	T9	T9-D11 PolarHBondContact O-N 3.02Å
12	E	77.5	Confident	66.3	Low	167 Å²	167	141.2 Å²	141.2	78%	0.78	78%	0.781	S	S	*	*			trans	-87	107.6	173.6	-81.2	159.3	147.1	0	0	109.7	S10 Y14	S10-E12 PolarHBondContact O-N 3.29Å; E12-Y14 PolarHBondContact O-N 2.87Å
13	E	77.3	Confident	65.7	Low	183 Å²	183	143.4 Å²	143.4	86%	0.855	78%	0.782	S	S	*	*			trans	-58.8	124.8	178.8	-77.3	-177	165.9	0	0	112.1	I15	E13-I15 PolarHBondContact O-N 2.99Å
14	Y	80.6	Confident	65.2	Low	194 Å²	194	143.3 Å²	143.3	76%	0.761	78%	0.777	S	S	*	*			trans	-62.8	121.4	174.4	176.4	-96.1	0	0	0	112.1	E12 P16	E12-Y14 PolarHBondContact O-N 2.87Å; Y14-P16 HydrophobicContact CE1-CB 4Å
15	I	77.7	Confident	64.8	Low	145 Å²	145	146 Å²	146	74%	0.744	78%	0.777	S	S	*	*			trans	-103.5	114.9	172.4	-54.6	173	0	0	0	108.8	E13	E13-I15 PolarHBondContact O-N 2.99Å
16	P	72.1	Confident	64	Low	82 Å²	82	145 Å²	145	53%	0.532	78%	0.778	S	S	.	*	P	Polyproline II helix	trans	-67.8	144.2	179.7	27.6	-33.1	0	0	0	110.9	Y14 V18	Y14-P16 HydrophobicContact CE1-CB 4Å; P16-V18 PolarHBondContact O-N 3.31Å
17	P	73.6	Confident	63.6	Low	111 Å²	111	141.6 Å²	141.6	72%	0.721	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-62.6	122.1	-175.3	24.5	-33.3	0	0	0	111	K19	P17-K19 PolarHBondContact O-N 2.72Å
18	V	57.2	Low	62.8	Low	134 Å²	134	143.1 Å²	143.1	81%	0.812	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-61.2	117.7	166.4	-159.8	0	0	0	0	106.2	P16 A20	P16-V18 PolarHBondContact O-N 3.31Å; V18-A20 VanDerWaalsContact C-N 3.26Å; V18-A20 PolarHBondContact O-N 3.16Å
19	K	58.9	Low	62.3	Low	199 Å²	199	143.4 Å²	143.4	87%	0.865	77%	0.771	S	S	*	*			trans	-63.6	88.4	178.9	-70.7	-171.6	178.8	-179.4	0	109.7	P17 S21	P17-K19 PolarHBondContact O-N 2.72Å; K19-S21 PolarHBondContact O-N 3.16Å
20	A	46.3	Very low	61.7	Low	102 Å²	102	146.7 Å²	146.7	84%	0.843	78%	0.777	S	S	*	*			trans	-86	82.9	160.5	0	0	0	0	0	107.9	V18	V18-A20 VanDerWaalsContact C-N 3.26Å; V18-A20 PolarHBondContact O-N 3.16Å
21	S	52.3	Low	61.5	Low	98 Å²	98	153.8 Å²	153.8	69%	0.685	79%	0.793	S	S	*	*			trans	-128.4	80.9	157.2	56.2	0	0	0	0	105	K19	K19-S21 PolarHBondContact O-N 3.16Å
22	K	49.9	Very low	60.9	Low	170 Å²	170	151.1 Å²	151.1	74%	0.739	79%	0.786	S	S	*	*				69.2	87.6	99.6	-166.1	161.1	-177.9	-176.7	0	109.9	E24	K22-E24 WeakPolarHBondContact CE-OE1 3.08Å; K22-E24 IonicContact NZ-OE1 2.69Å; K22-E24 PolarHBondContact O-N 3.43Å
23	L	42.9	Very low	60.2	Low	163 Å²	163	150.3 Å²	150.3	85%	0.853	79%	0.787	S	S	*	*			trans	-37.8	116.1	147.7	-69.2	158.3	0	0	0	108.9
24	E	59	Low	59.4	Low	162 Å²	162	149.3 Å²	149.3	76%	0.757	78%	0.783	S	S	*	*			trans	-136.1	124	138.9	-69.4	-154.8	-164.7	0	0	107.2	K22	K22-E24 WeakPolarHBondContact CE-OE1 3.08Å; K22-E24 IonicContact NZ-OE1 2.69Å; K22-E24 PolarHBondContact O-N 3.43Å
25	E	52.3	Low	58.4	Low	176 Å²	176	144.9 Å²	144.9	82%	0.822	78%	0.78	S	S	*	*			trans	-66.6	138.3	178.3	-65.6	155.6	148.4	0	0	109.3
26	D	53.6	Low	57.2	Low	156 Å²	156	146.8 Å²	146.8	83%	0.834	79%	0.786	S	S	*	*				178.4	136.4	125.3	-95.2	-22.5	0	0	0	113.2
27	S	57	Low	56.1	Low	95 Å²	95	148.3 Å²	148.3	66%	0.664	80%	0.799	S	S	*	*			trans	73.5	93.9	151.5	-66.2	0	0	0	0	121.3
28	E	51.8	Low	55	Low	188 Å²	188	146.6 Å²	146.6	88%	0.879	80%	0.801	S	S	*	*				45.5	110.5	113.7	-62.5	178.4	134.4	0	0	119.5
29	S	61.8	Low	54.8	Low	120 Å²	120	147.9 Å²	147.9	84%	0.839	80%	0.803	S	S	*	*				-164	123.3	124.3	62.5	0	0	0	0	110.8
30	E	53.1	Low	54.7	Low	191 Å²	191	144 Å²	144	89%	0.893	80%	0.801	S	S	*	*			trans	-66.5	137.9	176	-62	177.3	145.4	0	0	111.9
31	Y	66.4	Low	54.9	Low	235 Å²	235	146.5 Å²	146.5	92%	0.922	80%	0.8	S	S	*	*			trans	-142.4	108.2	154.8	-144.4	-93.4	0	0	0	108.5
32	S	58.5	Low	55.2	Low	102 Å²	102	147.7 Å²	147.7	71%	0.713	81%	0.807	S	S	*	*			trans	-70	130.6	177.3	-65.9	0	0	0	0	111
33	D	61.8	Low	55.4	Low	150 Å²	150	146.6 Å²	146.6	80%	0.802	81%	0.808	S	S	*	*			trans	-90.7	122.7	171.8	-177	30.6	0	0	0	108.6
34	E	61.6	Low	55.9	Low	163 Å²	163	144.2 Å²	144.2	76%	0.762	81%	0.805	S	S	*	*			trans	-136	133.6	175.3	-74.2	-76.5	138.1	0	0	108.9
35	S	59.2	Low	55.6	Low	100 Å²	100	143.9 Å²	143.9	70%	0.699	81%	0.808	S	S	*	*			trans	74.9	137.8	165.5	73.4	0	0	0	0	117.2
36	E	51.3	Low	55.2	Low	185 Å²	185	138.8 Å²	138.8	86%	0.864	80%	0.803	S	S	*	*			cis	-166.8	143.2	2.2	-119.7	170.6	166.7	0	0	107.3	G38	E36-G38 PolarHBondContact O-N 2.82Å
37	S	49.3	Very low	55.1	Low	115 Å²	115	140.6 Å²	140.6	80%	0.804	80%	0.804	S	S	*	*			trans	-64.7	116.5	174.9	51.7	0	0	0	0	111.9
38	G	51.6	Low	55	Low	74 Å²	74	142.5 Å²	142.5	76%	0.763	81%	0.812	S	S	*	*			trans	-109.1	101.5	168.3	0	0	0	0	0	111	E36 S40	E36-G38 PolarHBondContact O-N 2.82Å; G38-S40 PolarHBondContact O-N 3.24Å
39	N	52	Low	54.9	Low	162 Å²	162	138.4 Å²	138.4	87%	0.866	80%	0.803	S	S	*	*			trans	-61.5	129.1	168.1	-70.5	-25.6	0	0	0	109.6
40	S	57	Low	54.3	Low	117 Å²	117	141.8 Å²	141.8	82%	0.818	81%	0.806	S	S	*	*			trans	-126.3	115.5	164	67.9	0	0	0	0	110.2	G38	G38-S40 PolarHBondContact O-N 3.24Å
41	D	50.8	Low	54.1	Low	155 Å²	155	136.5 Å²	136.5	83%	0.829	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-52.6	130.9	177.9	-67.1	-54.5	0	0	0	113.1
42	C	58.4	Low	53.7	Low	123 Å²	123	132.7 Å²	132.7	83%	0.831	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-82.2	116.9	167.3	56	0	0	0	0	110
43	I	54.9	Low	53.5	Low	146 Å²	146	134.2 Å²	134.2	75%	0.749	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-77.7	118	168.7	-66.1	-169.6	0	0	0	108.8
44	S	51.5	Low	53.1	Low	113 Å²	113	134.9 Å²	134.9	79%	0.79	78%	0.782	S	S	*	*			trans	-99.7	102.6	169.6	63.9	0	0	0	0	110.2
45	D	53.5	Low	52.8	Low	156 Å²	156	138.3 Å²	138.3	83%	0.834	79%	0.788	S	S	*	*			trans	-88.1	131	158.3	-67.9	-33.8	0	0	0	106.9
46	G	44.7	Very low	52.5	Low	68 Å²	68	139.1 Å²	139.1	70%	0.701	79%	0.791	S	S	*	*			cis	129.1	59.9	27.8	0	0	0	0	0	108.2	T48	G46-T48 PolarHBondContact O-N 2.99Å
47	F	49.8	Very low	52.4	Low	195 Å²	195	134.7 Å²	134.7	86%	0.855	79%	0.786	S	S	*	*			trans	-85.8	94.2	178.5	-167	-96.4	0	0	0	110.5	S49	F47-S49 PolarHBondContact O-N 3.49Å
48	T	55.6	Low	52.5	Low	135 Å²	135	138.2 Å²	138.2	83%	0.828	79%	0.787	S	S	*	*			trans	-71.4	120.1	171	30.6	0	0	0	0	111.5	G46	G46-T48 PolarHBondContact O-N 2.99Å
49	S	49.4	Very low	52.3	Low	101 Å²	101	144.3 Å²	144.3	71%	0.706	79%	0.787	S	S	*	*			trans	-89.9	129.3	167	-62.4	0	0	0	0	110.5	F47	F47-S49 PolarHBondContact O-N 3.49Å
50	Q	49.6	Very low	52.2	Low	191 Å²	191	142.4 Å²	142.4	89%	0.893	78%	0.777	S	S	*	*			trans	-135.3	107.7	156.2	-80.2	-172.6	17.4	0	0	106.4
51	A	50.2	Low	51.6	Low	81 Å²	81	141.3 Å²	141.3	67%	0.669	77%	0.769	S	S	*	*				91	120.4	75.3	0	0	0	0	0	111.6
52	N	56.9	Low	51.7	Low	155 Å²	155	143 Å²	143	83%	0.829	77%	0.769	S	S	*	*			trans	140.2	141.3	148.3	-70.1	-16.5	0	0	0	110.7
53	E	54.4	Low	50.9	Low	133 Å²	133	146.4 Å²	146.4	62%	0.621	77%	0.773	S	S	*	*			cis	-167.7	137.5	-28.7	-109.7	-154.2	154.6	0	0	103
54	K	52.5	Low	50.5	Low	164 Å²	164	144.6 Å²	144.6	71%	0.713	77%	0.773	S	S	*	*			trans	49.5	134.8	145.3	-58.3	166.1	-177.8	154.6	0	118.9
55	R	56.3	Low	50.2	Low	236 Å²	236	149 Å²	149	89%	0.891	78%	0.778	S	S	*	*			cis	-176.8	172.6	6.2	-112.7	-171.8	155.5	-172.1	-5.3	106.8
56	P	52.3	Low	49.9	Very low	117 Å²	117	149.4 Å²	149.4	76%	0.76	78%	0.778	S	S	*	*			trans	-110.2	165.4	-149.5	41.3	-36	0	0	0	116
57	A	50.6	Low	50	Low	92 Å²	92	151 Å²	151	76%	0.76	78%	0.778	S	S	*	*			trans	179.2	128.1	135.1	0	0	0	0	0	114.9
58	K	50.8	Low	49.6	Very low	189 Å²	189	149.2 Å²	149.2	82%	0.822	78%	0.778	S	S	*	*			trans	67.2	117.2	138.9	-73.9	178.8	177.1	173.7	0	122.2
59	R	47.5	Very low	48.5	Very low	202 Å²	202	148.8 Å²	148.8	76%	0.762	78%	0.779	S	S	*	*				71.5	110.4	127.6	-73.4	173	61	104.6	-4.5	118.8
60	N	49.7	Very low	48.5	Very low	122 Å²	122	147.2 Å²	147.2	65%	0.652	77%	0.768	S	S	*	*				139.5	119.2	106.3	-99.5	7.8	0	0	0	112.6
61	S	43.2	Very low	48.5	Very low	93 Å²	93	143.7 Å²	143.7	65%	0.65	76%	0.762	S	S	*	*			trans	33.4	111.5	140.7	65.2	0	0	0	0	118.1
62	K	52.9	Low	48.3	Very low	192 Å²	192	144.7 Å²	144.7	84%	0.835	76%	0.755	S	S	*	*				179.4	144.9	117.9	-94.4	154.9	-173.4	176.3	0	110.2	S64	K62-S64 PolarHBondContact O-N 3.1Å
63	Q	42.7	Very low	48.1	Very low	194 Å²	194	141.4 Å²	141.4	91%	0.907	74%	0.744	S	S	*	*			trans	-36.2	126.2	176.5	-73.6	145.2	-52.5	0	0	114
64	S	46.8	Very low	48.1	Very low	107 Å²	107	138.1 Å²	138.1	75%	0.748	74%	0.74	S	S	*	*			trans	-143.4	104.4	152.9	53.3	0	0	0	0	110.1	K62 I66	K62-S64 PolarHBondContact O-N 3.1Å; S64-I66 PolarHBondContact O-N 3.13Å
65	K	45.5	Very low	48.4	Very low	205 Å²	205	133.7 Å²	133.7	89%	0.891	73%	0.734	S	S	*	*			trans	2.2	104.5	145.5	-157.3	164.9	-174.9	173.9	0	114.1	S67	K65-S67 PolarHBondContact O-N 2.98Å
66	I	46.6	Very low	48.6	Very low	166 Å²	166	129.2 Å²	129.2	85%	0.851	72%	0.723	S	S	*	*			trans	-68.8	103.4	170.2	-54.7	161.4	0	0	0	105.8	S64	S64-I66 PolarHBondContact O-N 3.13Å
67	S	47	Very low	49.1	Very low	100 Å²	100	129.1 Å²	129.1	70%	0.699	72%	0.716	S	S	*	*			trans	-67.8	126.6	170.1	49.3	0	0	0	0	109.1	K65 C69	K65-S67 PolarHBondContact O-N 2.98Å; S67-C69 PolarHBondContact O-N 2.66Å; S67-C69 VanDerWaalsContact O-N 3.12Å
68	D	40.6	Very low	50	Low	159 Å²	159	129.3 Å²	129.3	85%	0.85	71%	0.708	S	S	*	*			trans	-50.4	111.5	169.9	-68.3	-55.4	0	0	0	110.9
69	C	33.1	Very low	51.4	Low	126 Å²	126	124.6 Å²	124.6	85%	0.851	69%	0.687	S	S	*	*			trans	-101.9	94	162.4	-159.2	0	0	0	0	106.8	S67	S67-C69 PolarHBondContact O-N 2.66Å; S67-C69 VanDerWaalsContact O-N 3.12Å
70	S	49.3	Very low	52.9	Low	67 Å²	67	117.8 Å²	117.8	47%	0.469	67%	0.674	S	S	.	*			trans	-80.2	123.5	173.1	-71.2	0	0	0	0	109.5	L72	S70-L72 PolarHBondContact O-N 3.38Å; S70-L72 VanDerWaalsContact O-N 3.08Å
71	P	49.1	Very low	54.4	Low	118 Å²	118	119.8 Å²	119.8	77%	0.766	67%	0.674	S	S	*	*			trans	-83.5	70.2	165.8	34.7	-29.3	0	0	0	107.8
72	L	47.3	Very low	56.3	Low	101 Å²	101	119.5 Å²	119.5	53%	0.529	66%	0.662	S	S	.	*			trans	-107.4	-12.6	179.3	-77.1	169.9	0	0	0	113.5	S70	S70-L72 PolarHBondContact O-N 3.38Å; S70-L72 VanDerWaalsContact O-N 3.08Å
73	S	51.8	Low	57.8	Low	86 Å²	86	114.7 Å²	114.7	60%	0.601	65%	0.645	S	S	*	*	H	α-helix	trans	-79.8	-25.9	179.6	60.6	0	0	0	0	113.9
74	A	54.9	Low	59.8	Low	65 Å²	65	112.2 Å²	112.2	54%	0.537	63%	0.632	S	S	.	*	H	α-helix	trans	-77.5	-25.2	-175	0	0	0	0	0	114.1	V78	A74-V78 WeakPolarHBondContact O-CG2 3.49Å
75	A	58	Low	61.6	Low	70 Å²	70	110.1 Å²	110.1	58%	0.579	61%	0.614	S	S	*	*	H	α-helix	trans	-81.2	-31.9	-179.6	0	0	0	0	0	112.5	K79	A75-K79 PolarHBondContact O-N 2.91Å
76	E	60.6	Low	63.1	Low	142 Å²	142	105.8 Å²	105.8	66%	0.664	59%	0.592	S	S	*	*	H	α-helix	trans	-68.6	-36.8	176.8	-67.2	178.7	169.9	0	0	111.1	A80	E76-A80 WeakPolarHBondContact O-CB 3.31Å; E76-A80 PolarHBondContact O-N 3.38Å
77	D	62.2	Low	64.8	Low	115 Å²	115	101.9 Å²	101.9	62%	0.615	57%	0.574	S	S	*	*	H	α-helix	trans	-67.6	-36.7	177.9	-69.3	-25.7	0	0	0	112.8	Y81	D77-Y81 WeakPolarHBondContact O-CB 3.49Å; D77-Y81 PolarHBondContact O-N 3.02Å
78	V	71.3	Confident	66.4	Low	96 Å²	96	103.6 Å²	103.6	58%	0.582	57%	0.57	S	S	*	*	H	α-helix	trans	-69.1	-43.9	178.5	175.2	0	0	0	0	110.9	A74 Y81 E82	A74-V78 WeakPolarHBondContact O-CG2 3.49Å; V78-Y81 PolarHBondContact O-N 3.31Å; V78-E82 WeakPolarHBondContact O-CB 3.39Å; V78-E82 PolarHBondContact O-N 3.42Å
79	K	79.3	Confident	68.5	Low	91 Å²	91	102.4 Å²	102.4	40%	0.396	56%	0.558	S	S	.	*	H	α-helix	trans	-65.6	-42	178	-169.7	175	-175.7	174.3	0	111.7	A75 Y81 E82 D83 E219	A75-K79 PolarHBondContact O-N 2.91Å; K79-Y81 VanDerWaalsContact C-N 3.34Å; K79-Y81 PolarHBondContact O-N 3.01Å; K79-E82 PolarHBondContact O-N 2.95Å; K79-D83 WeakPolarHBondContact O-CB 3.5Å; K79-D83 PolarHBondContact O-N 3.19Å; K79-E219 IonicContact NZ-OE1 2.76Å; K79-E219 PolarHBondContact NZ-OE1 3.4Å; K79-E219 IonicContact NZ-OE2 3.92Å
80	A	78.2	Confident	70.4	Confident	59 Å²	59	100.6 Å²	100.6	49%	0.488	54%	0.539	S	S	.	.	H	α-helix	trans	-66.2	-34.9	176.6	0	0	0	0	0	112.8	E76 K84	E76-A80 WeakPolarHBondContact O-CB 3.31Å; E76-A80 PolarHBondContact O-N 3.38Å; A80-K84 VanDerWaalsContact O-CB 3.28Å; A80-K84 WeakPolarHBondContact O-CB 3.47Å; A80-K84 PolarHBondContact O-N 3.48Å; A80-K84 VanDerWaalsContact O-N 3.09Å
81	Y	83	Confident	71.4	Confident	164 Å²	164	103.5 Å²	103.5	64%	0.643	54%	0.544	S	S	*	.	H	α-helix	trans	-67.5	-45.7	173.4	-179.3	-101.5	0	0	0	111.5	D77 V78 K79 K84 V85	D77-Y81 WeakPolarHBondContact O-CB 3.49Å; D77-Y81 PolarHBondContact O-N 3.02Å; V78-Y81 PolarHBondContact O-N 3.31Å; K79-Y81 VanDerWaalsContact C-N 3.34Å; K79-Y81 PolarHBondContact O-N 3.01Å; Y81-K84 PolarHBondContact O-N 3.48Å; Y81-V85 HydrophobicContact CD1-CG2 4.22Å; Y81-V85 HydrophobicContact CE1-CG2 3.82Å; Y81-V85 HydrophobicContact CE2-CG2 4.25Å; Y81-V85 WeakPolarHBondContact O-CG2 3.1Å; Y81-V85 PolarHBondContact O-N 3.16Å
82	E	82.9	Confident	72.1	Confident	87 Å²	87	102 Å²	102	41%	0.407	54%	0.536	S	S	.	.	H	α-helix	trans	-60.4	-50	177.1	-176.4	171.4	-173.3	0	0	111.4	V78 K79 K84 V85 W86	V78-E82 WeakPolarHBondContact O-CB 3.39Å; V78-E82 PolarHBondContact O-N 3.42Å; K79-E82 PolarHBondContact O-N 2.95Å; E82-K84 VanDerWaalsContact C-N 3.26Å; E82-K84 PolarHBondContact O-N 3.26Å; E82-V85 PolarHBondContact O-N 3.4Å; E82-V85 VanDerWaalsContact O-N 3.11Å; E82-W86 PolarHBondContact O-N 2.86Å; E82-W86 PolarHBondContact OE1-NE1 2.85Å
83	D	82.7	Confident	72.4	Confident	90 Å²	90	100.5 Å²	100.5	48%	0.481	54%	0.544	S	S	.	.	H	α-helix	trans	-57.8	-39	176.7	-74.1	-15.3	0	0	0	111.6	K79 W86 D87	K79-D83 WeakPolarHBondContact O-CB 3.5Å; K79-D83 PolarHBondContact O-N 3.19Å; D83-W86 PolarHBondContact O-N 2.83Å; D83-D87 VanDerWaalsContact O-CB 3.32Å; D83-D87 WeakPolarHBondContact O-CB 3.45Å; D83-D87 PolarHBondContact O-N 2.88Å
84	K	86.4	Confident	72.5	Confident	142 Å²	142	100 Å²	100	62%	0.617	54%	0.541	S	S	*	.	H	α-helix	trans	-67.6	-40.2	176.9	-176	177.7	176	-173.5	0	112.7	A80 Y81 E82 W86 D87 E88	A80-K84 VanDerWaalsContact O-CB 3.28Å; A80-K84 WeakPolarHBondContact O-CB 3.47Å; A80-K84 PolarHBondContact O-N 3.48Å; A80-K84 VanDerWaalsContact O-N 3.09Å; Y81-K84 PolarHBondContact O-N 3.48Å; E82-K84 VanDerWaalsContact C-N 3.26Å; E82-K84 PolarHBondContact O-N 3.26Å; K84-W86 VanDerWaalsContact C-N 3.33Å; K84-D87 PolarHBondContact O-N 3.48Å; K84-E88 WeakPolarHBondContact O-CB 3.38Å; K84-E88 PolarHBondContact O-N 2.95Å
85	V	83.9	Confident	72	Confident	64 Å²	64	102.3 Å²	102.3	39%	0.388	55%	0.549	S	S	.	.	H	α-helix	trans	-64.3	-41.3	175.9	171	0	0	0	0	110.2	Y81 E82 E88 F89	Y81-V85 HydrophobicContact CD1-CG2 4.22Å; Y81-V85 HydrophobicContact CE1-CG2 3.82Å; Y81-V85 HydrophobicContact CE2-CG2 4.25Å; Y81-V85 WeakPolarHBondContact O-CG2 3.1Å; Y81-V85 PolarHBondContact O-N 3.16Å; E82-V85 PolarHBondContact O-N 3.4Å; E82-V85 VanDerWaalsContact O-N 3.11Å; V85-E88 PolarHBondContact O-N 2.78Å; V85-F89 WeakPolarHBondContact O-CB 3.42Å; V85-F89 PolarHBondContact O-N 2.75Å
86	W	77.3	Confident	71.5	Confident	113 Å²	113	105.1 Å²	105.1	43%	0.428	55%	0.55	S	S	.	.	H	α-helix	trans	-68.4	-41.5	175.8	-71.4	117.2	0	0	0	112.8	E82 D83 K84 E88 F89 L90	E82-W86 PolarHBondContact O-N 2.86Å; E82-W86 PolarHBondContact OE1-NE1 2.85Å; D83-W86 PolarHBondContact O-N 2.83Å; K84-W86 VanDerWaalsContact C-N 3.33Å; W86-E88 VanDerWaalsContact C-N 3.31Å; W86-E88 PolarHBondContact O-N 2.93Å; W86-F89 HydrophobicContact CE3-CD1 4.37Å; W86-F89 HydrophobicContact CZ3-CD1 4.48Å; W86-F89 WeakPolarHBondContact O-CB 3.34Å; W86-F89 PolarHBondContact O-N 3.36Å; W86-L90 WeakPolarHBondContact O-CG 3.4Å; W86-L90 PolarHBondContact O-N 3.15Å
87	D	81.7	Confident	70.6	Confident	85 Å²	85	108.6 Å²	108.6	46%	0.455	56%	0.563	S	S	.	*	H	α-helix	trans	-61.5	-40.1	174.7	-95	-3.1	0	0	0	111.9	D83 K84 L90 K91	D83-D87 VanDerWaalsContact O-CB 3.32Å; D83-D87 WeakPolarHBondContact O-CB 3.45Å; D83-D87 PolarHBondContact O-N 2.88Å; K84-D87 PolarHBondContact O-N 3.48Å; D87-L90 PolarHBondContact O-N 2.86Å; D87-K91 VanDerWaalsContact O-CB 3.22Å; D87-K91 WeakPolarHBondContact O-CB 3.25Å; D87-K91 WeakPolarHBondContact O-CD 3.24Å; D87-K91 WeakPolarHBondContact O-CG 3.49Å; D87-K91 PolarHBondContact O-N 3.5Å
88	E	81.6	Confident	69.9	Low	135 Å²	135	106.8 Å²	106.8	63%	0.631	56%	0.559	S	S	*	*	H	α-helix	trans	-64.6	-43.5	174.7	-174.2	172.1	171.2	0	0	111	K84 V85 W86 L90 K91 S92	K84-E88 WeakPolarHBondContact O-CB 3.38Å; K84-E88 PolarHBondContact O-N 2.95Å; V85-E88 PolarHBondContact O-N 2.78Å; W86-E88 VanDerWaalsContact C-N 3.31Å; W86-E88 PolarHBondContact O-N 2.93Å; E88-L90 PolarHBondContact O-N 2.97Å; E88-K91 PolarHBondContact O-N 3.29Å; E88-S92 WeakPolarHBondContact O-CB 3.46Å; E88-S92 PolarHBondContact O-N 3.47Å
89	F	84	Confident	68.6	Low	134 Å²	134	109.4 Å²	109.4	59%	0.588	57%	0.57	S	S	*	*	H	α-helix	trans	-59.4	-46.4	175	-178.2	-101.7	0	0	0	111.9	V85 W86 S92	V85-F89 WeakPolarHBondContact O-CB 3.42Å; V85-F89 PolarHBondContact O-N 2.75Å; W86-F89 HydrophobicContact CE3-CD1 4.37Å; W86-F89 HydrophobicContact CZ3-CD1 4.48Å; W86-F89 WeakPolarHBondContact O-CB 3.34Å; W86-F89 PolarHBondContact O-N 3.36Å; F89-S92 PolarHBondContact O-N 2.93Å; F89-S92 PolarHBondContact O-OG 2.85Å
90	L	73	Confident	67.2	Low	89 Å²	89	111.2 Å²	111.2	47%	0.466	59%	0.594	S	S	.	*	H	α-helix	trans	-69.8	-38.7	179	-67.5	175.6	0	0	0	112.6	W86 D87 E88 S92 G93 S94 L208	W86-L90 WeakPolarHBondContact O-CG 3.4Å; W86-L90 PolarHBondContact O-N 3.15Å; D87-L90 PolarHBondContact O-N 2.86Å; E88-L90 PolarHBondContact O-N 2.97Å; L90-S92 VanDerWaalsContact C-N 3.3Å; L90-S92 PolarHBondContact O-N 3.18Å; L90-G93 PolarHBondContact O-N 3.34Å; L90-S94 PolarHBondContact O-N 3.31Å; L90-L208 HydrophobicContact CD1-CD1 4.07Å
91	K	70.3	Confident	66.1	Low	128 Å²	128	111.4 Å²	111.4	56%	0.557	59%	0.586	S	S	*	*	H	α-helix	trans	-67	-32.7	175.5	-76.5	169.1	-174.9	172.5	0	112.1	D87 E88 G93 S94	D87-K91 VanDerWaalsContact O-CB 3.22Å; D87-K91 WeakPolarHBondContact O-CB 3.25Å; D87-K91 WeakPolarHBondContact O-CD 3.24Å; D87-K91 WeakPolarHBondContact O-CG 3.49Å; D87-K91 PolarHBondContact O-N 3.5Å; E88-K91 PolarHBondContact O-N 3.29Å; K91-G93 PolarHBondContact O-N 3.42Å; K91-S94 PolarHBondContact O-N 2.83Å; K91-S94 VanDerWaalsContact O-N 3.11Å
92	S	63	Low	64.9	Low	86 Å²	86	110.7 Å²	110.7	60%	0.601	59%	0.589	S	S	*	*	H	α-helix	trans	-61.5	-24.2	175.1	82.8	0	0	0	0	112.9	E88 F89 L90	E88-S92 WeakPolarHBondContact O-CB 3.46Å; E88-S92 PolarHBondContact O-N 3.47Å; F89-S92 PolarHBondContact O-N 2.93Å; F89-S92 PolarHBondContact O-OG 2.85Å; L90-S92 VanDerWaalsContact C-N 3.3Å; L90-S92 PolarHBondContact O-N 3.18Å
93	G	55.5	Low	63.9	Low	69 Å²	69	112.8 Å²	112.8	71%	0.711	60%	0.596	S	S	*	*	H	α-helix	trans	-92.5	-16.2	174.6	0	0	0	0	0	115.1	L90 K91	L90-G93 PolarHBondContact O-N 3.34Å; K91-G93 PolarHBondContact O-N 3.42Å
94	S	52.6	Low	63.1	Low	77 Å²	77	111.1 Å²	111.1	54%	0.538	59%	0.59	S	S	.	*			trans	-108.7	18.8	-170.2	78.1	0	0	0	0	114.9	L90 K91 E96	L90-S94 PolarHBondContact O-N 3.31Å; K91-S94 PolarHBondContact O-N 2.83Å; K91-S94 VanDerWaalsContact O-N 3.11Å; S94-E96 PolarHBondContact O-N 3.31Å
95	T	44.4	Very low	62.3	Low	113 Å²	113	109.4 Å²	109.4	69%	0.693	59%	0.587	S	S	*	*			trans	-76.6	61.2	178.2	59	0	0	0	0	112.6
96	E	48.6	Very low	61.8	Low	128 Å²	128	109 Å²	109	60%	0.598	58%	0.584	S	S	*	*			trans	-150.6	89.6	158.1	-75	-152.2	173.6	0	0	111.6	S94 K103	S94-E96 PolarHBondContact O-N 3.31Å; E96-K103 IonicContact OE2-NZ 3.71Å; E96-K103 PolarHBondContact OE2-NZ 2.92Å
97	K	40.8	Very low	61.7	Low	215 Å²	215	107.3 Å²	107.3	94%	0.935	59%	0.587	S	S	*	*			trans	-134.7	75.7	149	-73.3	-165.5	179.7	-175.7	0	108.9
98	S	47.7	Very low	61.4	Low	77 Å²	77	107.3 Å²	107.3	54%	0.538	58%	0.583	S	S	.	*			trans	-141.4	92.5	161.2	61.5	0	0	0	0	109.2
99	N	44.5	Very low	61.1	Low	152 Å²	152	105.2 Å²	105.2	81%	0.813	57%	0.572	S	S	*	*	S	Bend	trans	24.1	113.1	141.6	-56	-39.3	0	0	0	117.5	I101	N99-I101 PolarHBondContact O-N 2.89Å
100	S	49.5	Very low	60.9	Low	128 Å²	128	100.9 Å²	100.9	90%	0.895	55%	0.552	S	S	*	*			trans	50.2	43	154.3	76.9	0	0	0	0	118.6
101	I	55.4	Low	61.3	Low	64 Å²	64	99.3 Å²	99.3	33%	0.328	54%	0.542	S	S	.	.			trans	-85	119.2	168.4	-57.3	164.8	0	0	0	108.4	N99 K103 S124	N99-I101 PolarHBondContact O-N 2.89Å; I101-K103 PolarHBondContact O-N 3.38Å; I101-S124 WeakPolarHBondContact CG2-OG 3.42Å
102	E	56.4	Low	61.7	Low	149 Å²	149	95.2 Å²	95.2	70%	0.696	52%	0.524	S	S	*	.			trans	-50.8	108.4	174.8	-168.3	175.7	-161.6	0	0	110.1	N125	E102-N125 WeakPolarHBondContact O-CB 3.45Å; E102-N125 PolarHBondContact O-N 3.18Å; E102-N125 PolarHBondContact O-ND2 2.89Å
103	K	62.1	Low	62.4	Low	130 Å²	130	95.8 Å²	95.8	57%	0.565	53%	0.534	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	119.5	-178.6	-77	-175.4	-179	-161.8	0	108.1	E96 I101 T122	E96-K103 IonicContact OE2-NZ 3.71Å; E96-K103 PolarHBondContact OE2-NZ 2.92Å; I101-K103 PolarHBondContact O-N 3.38Å; K103-T122 HydrophobicContact CB-CG2 3.53Å; K103-T122 HydrophobicContact CD-CG2 3.78Å; K103-T122 HydrophobicContact CG-CG2 3.83Å
104	V	65.8	Low	63.4	Low	56 Å²	56	96 Å²	96	34%	0.339	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	126.1	174.6	178.3	0	0	0	0	108.6	V106 V123 N125	V104-V106 HydrophobicContact CG1-CG2 4.47Å; V104-V106 PolarHBondContact O-N 3.06Å; V104-V123 PolarHBondContact N-O 3.39Å; V104-V123 PolarHBondContact O-N 3.31Å; V104-N125 VanDerWaalsContact CG2-ND2 3.34Å; V104-N125 WeakPolarHBondContact CG2-ND2 3.31Å; V104-N125 VanDerWaalsContact CG2-OD1 3.29Å; V104-N125 WeakPolarHBondContact CG2-OD1 3.38Å
105	N	70.5	Confident	64.3	Low	105 Å²	105	98.8 Å²	98.8	56%	0.561	54%	0.541	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	109.9	173	-68.3	-24.3	0	0	0	108.6	I120 T122	N105-I120 HydrophobicContact CB-CG2 4.02Å; N105-T122 PolarHBondContact OD1-OG1 3.41Å; N105-T122 VanDerWaalsContact OD1-OG1 3.09Å
106	V	72.7	Confident	65.8	Low	55 Å²	55	98.2 Å²	98.2	33%	0.333	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	115.4	174.2	-177.3	0	0	0	0	107.9	V104 K108 Q121 V123	V104-V106 HydrophobicContact CG1-CG2 4.47Å; V104-V106 PolarHBondContact O-N 3.06Å; V106-K108 HydrophobicContact CG1-CG 4.17Å; V106-K108 PolarHBondContact O-N 3.02Å; V106-Q121 PolarHBondContact N-O 3.43Å; V106-Q121 PolarHBondContact O-N 3.31Å; V106-V123 HydrophobicContact CB-CG2 4.39Å; V106-V123 HydrophobicContact CG2-CB 4.29Å; V106-V123 HydrophobicContact CG2-CG2 4Å
107	V	75.5	Confident	67.1	Low	79 Å²	79	93.1 Å²	93.1	48%	0.479	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	113	173.2	-176.3	0	0	0	0	108.3	E118	V107-E118 HydrophobicContact CG1-CB 4.03Å; V107-E118 HydrophobicContact CG1-CG 4.28Å
108	K	76	Confident	68.9	Low	84 Å²	84	88.1 Å²	88.1	37%	0.365	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	129.2	172.8	-73.8	-179.1	-176.4	164.3	0	109.7	V106 Y110 V119	V106-K108 HydrophobicContact CG1-CG 4.17Å; V106-K108 PolarHBondContact O-N 3.02Å; K108-Y110 HydrophobicContact CB-CD2 4.19Å; K108-Y110 HydrophobicContact CB-CE2 3.46Å; K108-Y110 VanDerWaalsContact CB-CE2 3.46Å; K108-Y110 HydrophobicContact CD-CE2 4.31Å; K108-Y110 WeakPolarHBondContact CD-OH 3.34Å; K108-V119 PolarHBondContact N-O 3.32Å; K108-V119 PolarHBondContact O-N 3.31Å
109	K	75.8	Confident	70.2	Confident	92 Å²	92	84.6 Å²	84.6	40%	0.4	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	129.3	176.5	-68.5	163	169	-69.5	0	109.4	E116 E118 L171	K109-E116 HydrophobicContact CB-CG 4.45Å; K109-E116 WeakPolarHBondContact CD-OE1 3.18Å; K109-E116 WeakPolarHBondContact CE-OE1 3.26Å; K109-E116 VanDerWaalsContact CG-OE1 3.25Å; K109-E116 WeakPolarHBondContact CG-OE1 3.27Å; K109-E116 IonicContact NZ-OE1 2.75Å; K109-E116 PolarHBondContact NZ-OE1 2.96Å; K109-E118 HydrophobicContact CG-CG 4.19Å; K109-E118 IonicContact NZ-OE1 2.78Å; K109-E118 PolarHBondContact NZ-OE1 3.43Å; K109-L171 HydrophobicContact CB-CD1 4.12Å; K109-L171 HydrophobicContact CB-CD2 3.85Å
110	Y	79.7	Confident	71.7	Confident	43 Å²	43	81.8 Å²	81.8	17%	0.169	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	160.3	176.1	-67.5	-93.7	0	0	0	110.3	K108 E116 V117 V119 P172 L174	K108-Y110 HydrophobicContact CB-CD2 4.19Å; K108-Y110 HydrophobicContact CB-CE2 3.46Å; K108-Y110 VanDerWaalsContact CB-CE2 3.46Å; K108-Y110 HydrophobicContact CD-CE2 4.31Å; K108-Y110 WeakPolarHBondContact CD-OH 3.34Å; Y110-E116 WeakPolarHBondContact O-CA 3.27Å; Y110-V117 PolarHBondContact N-O 2.9Å; Y110-V117 PolarHBondContact O-N 3.49Å; Y110-V119 HydrophobicContact CD2-CB 4Å; Y110-V119 HydrophobicContact CD2-CG2 3.63Å; Y110-V119 HydrophobicContact CE2-CB 3.93Å; Y110-V119 HydrophobicContact CE2-CG2 3.96Å; Y110-P172 HydrophobicContact CD1-CB 4.04Å; Y110-P172 HydrophobicContact CD1-CG 3.64Å; Y110-P172 WeakPolarHBondContact CD1-O 3.26Å; Y110-P172 HydrophobicContact CE1-CB 4.14Å; Y110-P172 HydrophobicContact CE1-CG 3.64Å; Y110-L174 HydrophobicContact CD1-CB 4.39Å; Y110-L174 HydrophobicContact CD1-CD1 4.07Å; Y110-L174 HydrophobicContact CE1-CD1 4.38Å; Y110-L174 HydrophobicContact CG-CB 4.41Å; Y110-L174 HydrophobicContact CG-CD1 4.33Å
111	Q	79.7	Confident	72.6	Confident	55 Å²	55	79.4 Å²	79.4	26%	0.257	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	127	168.7	-83	174	25.9	0	0	110.5	L171 P172 R173 L174	Q111-L171 HydrophobicContact CG-CB 3.95Å; Q111-L171 HydrophobicContact CG-CD1 4.14Å; Q111-P172 PolarHBondContact N-O 3.24Å; Q111-P172 VanDerWaalsContact N-O 3.15Å; Q111-R173 WeakPolarHBondContact O-CA 3.37Å; Q111-R173 VanDerWaalsContact OE1-NE 3.08Å; Q111-L174 PolarHBondContact O-N 3.34Å
112	F	78.7	Confident	73	Confident	43 Å²	43	79 Å²	79	19%	0.189	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	121.2	172.8	178.1	-101.6	0	0	0	109.6	G114 E115 V117 T176 K179	F112-G114 PolarHBondContact O-N 3.05Å; F112-E115 PolarHBondContact N-O 2.86Å; F112-E115 PolarHBondContact O-N 3.26Å; F112-V117 HydrophobicContact CB-CG2 3.73Å; F112-T176 HydrophobicContact CE2-CG2 4.42Å; F112-T176 HydrophobicContact CZ-CG2 4.43Å; F112-K179 HydrophobicContact CB-CD 4.22Å; F112-K179 HydrophobicContact CD1-CD 3.61Å; F112-K179 HydrophobicContact CD2-CB 4.32Å; F112-K179 HydrophobicContact CD2-CD 3.8Å; F112-K179 HydrophobicContact CE1-CD 3.84Å; F112-K179 HydrophobicContact CE2-CB 4.45Å; F112-K179 HydrophobicContact CE2-CD 4.04Å; F112-K179 HydrophobicContact CG-CD 3.58Å; F112-K179 HydrophobicContact CZ-CD 4.05Å
113	A	78.7	Confident	73.3	Confident	98 Å²	98	74.5 Å²	74.5	81%	0.81	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	25.6	178.1	0	0	0	0	0	115.8
114	G	75.4	Confident	72.9	Confident	73 Å²	73	69.4 Å²	69.4	75%	0.753	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	91	-6.5	-177	0	0	0	0	0	114.6	F112	F112-G114 PolarHBondContact O-N 3.05Å
115	E	73.4	Confident	72.6	Confident	136 Å²	136	68.7 Å²	68.7	64%	0.636	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	146.2	173	-167.9	176.3	-178.1	0	0	110.9	F112	F112-E115 PolarHBondContact N-O 2.86Å; F112-E115 PolarHBondContact O-N 3.26Å
116	E	75.6	Confident	72.1	Confident	100 Å²	100	67.7 Å²	67.7	47%	0.467	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	123.9	174.1	-172.1	177.9	165.5	0	0	109.5	K109 Y110 L171	K109-E116 HydrophobicContact CB-CG 4.45Å; K109-E116 WeakPolarHBondContact CD-OE1 3.18Å; K109-E116 WeakPolarHBondContact CE-OE1 3.26Å; K109-E116 VanDerWaalsContact CG-OE1 3.25Å; K109-E116 WeakPolarHBondContact CG-OE1 3.27Å; K109-E116 IonicContact NZ-OE1 2.75Å; K109-E116 PolarHBondContact NZ-OE1 2.96Å; Y110-E116 WeakPolarHBondContact O-CA 3.27Å; E116-L171 HydrophobicContact CG-CD1 4.01Å
117	V	75.4	Confident	71.4	Confident	21 Å²	21	70.4 Å²	70.4	13%	0.127	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	123	179.4	-179.9	0	0	0	0	109.3	Y110 F112 V119	Y110-V117 PolarHBondContact N-O 2.9Å; Y110-V117 PolarHBondContact O-N 3.49Å; F112-V117 HydrophobicContact CB-CG2 3.73Å; V117-V119 HydrophobicContact CG1-CG2 4.35Å
118	E	78	Confident	70.6	Confident	110 Å²	110	76.1 Å²	76.1	51%	0.514	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	114.5	174.2	-64.4	-166.1	163.7	0	0	110.3	V107 K109	V107-E118 HydrophobicContact CG1-CB 4.03Å; V107-E118 HydrophobicContact CG1-CG 4.28Å; K109-E118 HydrophobicContact CG-CG 4.19Å; K109-E118 IonicContact NZ-OE1 2.78Å; K109-E118 PolarHBondContact NZ-OE1 3.43Å
119	V	75.7	Confident	69.5	Low	3 Å²	3	78.5 Å²	78.5	2%	0.018	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	114.4	176.2	177.6	0	0	0	0	107.9	K108 Y110 V117 Q121 L174 L182	K108-V119 PolarHBondContact N-O 3.32Å; K108-V119 PolarHBondContact O-N 3.31Å; Y110-V119 HydrophobicContact CD2-CB 4Å; Y110-V119 HydrophobicContact CD2-CG2 3.63Å; Y110-V119 HydrophobicContact CE2-CB 3.93Å; Y110-V119 HydrophobicContact CE2-CG2 3.96Å; V117-V119 HydrophobicContact CG1-CG2 4.35Å; V119-Q121 PolarHBondContact O-N 2.85Å; V119-L174 HydrophobicContact CG2-CD2 4.25Å; V119-L182 HydrophobicContact CB-CD1 4.48Å; V119-L182 HydrophobicContact CG1-CB 4.42Å; V119-L182 HydrophobicContact CG1-CD1 3.74Å; V119-L182 HydrophobicContact CG1-CD2 4.06Å; V119-L182 HydrophobicContact CG1-CG 4.3Å; V119-L182 HydrophobicContact CG2-CD1 3.95Å
120	I	74.8	Confident	68.5	Low	93 Å²	93	83.5 Å²	83.5	48%	0.477	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	113.3	169.2	-56.1	173.2	0	0	0	107.1	N105 Q186	N105-I120 HydrophobicContact CB-CG2 4.02Å; I120-Q186 PolarHBondContact O-NE2 2.98Å
121	Q	69.8	Low	67	Low	78 Å²	78	84.7 Å²	84.7	36%	0.364	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	116.1	174.1	-172.4	177.2	16	0	0	108.8	V106 V119 V123	V106-Q121 PolarHBondContact N-O 3.43Å; V106-Q121 PolarHBondContact O-N 3.31Å; V119-Q121 PolarHBondContact O-N 2.85Å; Q121-V123 HydrophobicContact CG-CG2 4.02Å; Q121-V123 PolarHBondContact O-N 3.13Å
122	T	62.8	Low	65.4	Low	57 Å²	57	90.4 Å²	90.4	35%	0.35	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	109.4	174.2	-54.1	0	0	0	0	109.2	K103 N105	K103-T122 HydrophobicContact CB-CG2 3.53Å; K103-T122 HydrophobicContact CD-CG2 3.78Å; K103-T122 HydrophobicContact CG-CG2 3.83Å; N105-T122 PolarHBondContact OD1-OG1 3.41Å; N105-T122 VanDerWaalsContact OD1-OG1 3.09Å
123	V	62.4	Low	63.7	Low	53 Å²	53	93 Å²	93	32%	0.321	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	129.8	-179.9	-174.2	0	0	0	0	109.1	V104 V106 Q121 N125	V104-V123 PolarHBondContact N-O 3.39Å; V104-V123 PolarHBondContact O-N 3.31Å; V106-V123 HydrophobicContact CB-CG2 4.39Å; V106-V123 HydrophobicContact CG2-CB 4.29Å; V106-V123 HydrophobicContact CG2-CG2 4Å; Q121-V123 HydrophobicContact CG-CG2 4.02Å; Q121-V123 PolarHBondContact O-N 3.13Å; V123-N125 PolarHBondContact O-N 2.98Å
124	S	54.9	Low	62.2	Low	23 Å²	23	94.3 Å²	94.3	16%	0.161	53%	0.528	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	125.6	171.8	171	0	0	0	0	110.6	I101 S126	I101-S124 WeakPolarHBondContact CG2-OG 3.42Å; S124-S126 PolarHBondContact O-N 3.09Å
125	N	59.3	Low	61	Low	42 Å²	42	97.4 Å²	97.4	23%	0.225	53%	0.526	C	S	.	.	G	3₁₀ helix	trans	-60.9	-12.3	-178.7	-88.4	-24.7	0	0	0	114.5	E102 V104 V123 N127 R128	E102-N125 WeakPolarHBondContact O-CB 3.45Å; E102-N125 PolarHBondContact O-N 3.18Å; E102-N125 PolarHBondContact O-ND2 2.89Å; V104-N125 VanDerWaalsContact CG2-ND2 3.34Å; V104-N125 WeakPolarHBondContact CG2-ND2 3.31Å; V104-N125 VanDerWaalsContact CG2-OD1 3.29Å; V104-N125 WeakPolarHBondContact CG2-OD1 3.38Å; V123-N125 PolarHBondContact O-N 2.98Å; N125-N127 PolarHBondContact O-N 3.29Å; N125-R128 PolarHBondContact OD1-NH2 3Å
126	S	60.3	Low	59.8	Low	83 Å²	83	99.3 Å²	99.3	58%	0.58	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-68.5	-12.1	-175.4	-174.7	0	0	0	0	114.9	S124	S124-S126 PolarHBondContact O-N 3.09Å
127	N	56.9	Low	58.3	Low	113 Å²	113	101.5 Å²	101.5	60%	0.604	55%	0.55	S	S	*	*	G	3₁₀ helix	trans	-104.2	12.5	-170	-62.6	-24.7	0	0	0	114.5	N125 T129	N125-N127 PolarHBondContact O-N 3.29Å; N127-T129 PolarHBondContact O-N 3.31Å
128	R	58.4	Low	57.1	Low	199 Å²	199	110.3 Å²	110.3	75%	0.751	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	2	-168.1	-141.5	-174.8	-90.2	-156.9	-0.8	115.9	N125	N125-R128 PolarHBondContact OD1-NH2 3Å
129	T	54.8	Low	55.1	Low	134 Å²	134	112 Å²	112	82%	0.822	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.1	8	-175.1	58	0	0	0	0	116.8	N127	N127-T129 PolarHBondContact O-N 3.31Å
130	K	54.7	Low	53.8	Low	197 Å²	197	117.1 Å²	117.1	86%	0.857	64%	0.64	S	S	*	*			trans	-104.3	88.3	172.6	-66.1	-175.8	-175.2	176.4	0	110.1
131	G	47.1	Very low	52.3	Low	67 Å²	67	118.2 Å²	118.2	69%	0.691	66%	0.657	S	S	*	*			trans	-60	145.1	-178.7	0	0	0	0	0	114.1	S133	G131-S133 PolarHBondContact O-N 3.21Å
132	L	46.4	Very low	51.3	Low	175 Å²	175	123.7 Å²	123.7	92%	0.916	68%	0.682	S	S	*	*				57.9	49.4	126.5	-127.7	81	0	0	0	117
133	S	44.1	Very low	50.7	Low	99 Å²	99	126.5 Å²	126.5	69%	0.692	70%	0.699	S	S	*	*			trans	-94.5	92.3	158.7	74.1	0	0	0	0	110.4	G131 L135	G131-S133 PolarHBondContact O-N 3.21Å; S133-L135 VanDerWaalsContact C-N 3.33Å; S133-L135 PolarHBondContact O-N 3.3Å
134	V	45.7	Very low	50.2	Low	124 Å²	124	131.3 Å²	131.3	75%	0.752	72%	0.723	S	S	*	*			trans	-66.6	94.9	161.3	169.4	0	0	0	0	106.8	Q136	V134-Q136 HydrophobicContact CG1-CG 4.24Å; V134-Q136 PolarHBondContact O-N 3.12Å
135	L	51.6	Low	49.8	Very low	139 Å²	139	135.4 Å²	135.4	73%	0.728	75%	0.749	S	S	*	*			trans	-89.7	99.4	169.8	-89.1	147.4	0	0	0	108.6	S133 N137	S133-L135 VanDerWaalsContact C-N 3.33Å; S133-L135 PolarHBondContact O-N 3.3Å; L135-N137 PolarHBondContact O-N 3.45Å
136	Q	48	Very low	49.2	Very low	175 Å²	175	142 Å²	142	82%	0.818	78%	0.784	S	S	*	*			trans	-68.2	102.9	166.9	-66.7	175.7	-37	0	0	109.2	V134	V134-Q136 HydrophobicContact CG1-CG 4.24Å; V134-Q136 PolarHBondContact O-N 3.12Å
137	N	43.9	Very low	48.9	Very low	147 Å²	147	149.2 Å²	149.2	79%	0.786	80%	0.798	S	S	*	*			trans	-128.7	87.3	162.1	-79.2	-7	0	0	0	108.5	L135	L135-N137 PolarHBondContact O-N 3.45Å
138	K	50.6	Low	48.6	Very low	206 Å²	206	147.7 Å²	147.7	90%	0.896	79%	0.794	S	S	*	*			trans	-127.9	108.8	156.7	-79.6	-168.1	175.8	-176.8	0	108.5
139	T	35.7	Very low	48.2	Very low	145 Å²	145	147.8 Å²	147.8	89%	0.89	80%	0.8	S	S	*	*			trans	-64.2	118.8	167.3	47.6	0	0	0	0	109.9
140	S	47.1	Very low	48.2	Very low	110 Å²	110	145.5 Å²	145.5	77%	0.769	80%	0.795	S	S	*	*			trans	-157.1	97.8	158.4	40.6	0	0	0	0	107.6	E142	S140-E142 PolarHBondContact O-N 3.25Å
141	S	43.5	Very low	48.1	Very low	117 Å²	117	141.7 Å²	141.7	82%	0.818	79%	0.791	S	S	*	*			trans	-65.5	116.2	163.7	49.1	0	0	0	0	108.7
142	E	50.3	Low	48.5	Very low	192 Å²	192	146.4 Å²	146.4	90%	0.897	79%	0.794	S	S	*	*			trans	-157.1	152.7	150.4	-114.5	175	-148.6	0	0	110.3	S140	S140-E142 PolarHBondContact O-N 3.25Å
143	T	49.1	Very low	48.8	Very low	116 Å²	116	146.5 Å²	146.5	71%	0.712	80%	0.795	S	S	*	*			trans	-93.7	151.9	-148.5	50.5	0	0	0	0	113.9
144	N	52.6	Low	49	Very low	154 Å²	154	143.6 Å²	143.6	82%	0.824	78%	0.78	S	S	*	*			trans	91.8	127.6	151.3	-66.5	-46.2	0	0	0	120.5
145	P	46.2	Very low	49.4	Very low	109 Å²	109	145.1 Å²	145.1	71%	0.708	78%	0.783	S	S	*	*			trans	-110.8	135.6	-166	36.5	-20.5	0	0	0	112.7
146	L	46.2	Very low	49.7	Very low	182 Å²	182	141.6 Å²	141.6	95%	0.953	78%	0.781	S	S	*	*			trans	-135.8	106.4	165	-68	174.9	0	0	0	111.2
147	R	53.7	Low	50.5	Low	233 Å²	233	140.1 Å²	140.1	88%	0.879	78%	0.778	S	S	*	*			trans	-32.3	175.2	161.8	-100	-162.5	-168.1	-110.6	-9	116.6
148	P	52.2	Low	51.5	Low	81 Å²	81	135.8 Å²	135.8	53%	0.526	76%	0.759	S	S	.	*			cis	-141	174.3	-42.3	36.6	-18.6	0	0	0	111.7
149	K	48.9	Very low	52.3	Low	202 Å²	202	131 Å²	131	88%	0.878	74%	0.743	S	S	*	*			trans	177	124.1	133	-92.7	140.3	-163.7	163.7	0	111.7
150	A	55.8	Low	54.1	Low	86 Å²	86	126.9 Å²	126.9	71%	0.711	72%	0.724	S	S	*	*			trans	4.2	136.9	171.1	0	0	0	0	0	121.4	H152	A150-H152 PolarHBondContact O-N 2.92Å
151	P	52.1	Low	55.4	Low	117 Å²	117	126.6 Å²	126.6	76%	0.76	71%	0.713	S	S	*	*			trans	-76.1	113	166.7	32.6	-27.9	0	0	0	108.4	L153	P151-L153 PolarHBondContact O-N 3.18Å; P151-L153 VanDerWaalsContact O-N 3.16Å
152	H	54.9	Low	56.7	Low	165 Å²	165	127.5 Å²	127.5	76%	0.764	71%	0.705	S	S	*	*			trans	-69.8	109.7	162.2	54.8	-79.7	0	0	0	107	A150 G154	A150-H152 PolarHBondContact O-N 2.92Å; H152-G154 VanDerWaalsContact C-N 3.31Å; H152-G154 PolarHBondContact O-N 2.93Å
153	L	52.6	Low	57.6	Low	178 Å²	178	123.3 Å²	123.3	93%	0.932	69%	0.688	S	S	*	*			trans	-68.6	92.4	165.8	-71.3	163.2	0	0	0	107.2	P151	P151-L153 PolarHBondContact O-N 3.18Å; P151-L153 VanDerWaalsContact O-N 3.16Å
154	G	48.1	Very low	58.7	Low	38 Å²	38	122.1 Å²	122.1	39%	0.392	68%	0.677	S	S	.	*	S	Bend	trans	175.1	120	175.2	0	0	0	0	0	110.7	H152	H152-G154 VanDerWaalsContact C-N 3.31Å; H152-G154 PolarHBondContact O-N 2.93Å
155	L	55.2	Low	59.4	Low	155 Å²	155	121.6 Å²	121.6	81%	0.812	67%	0.667	S	S	*	*			trans	73.4	46	172.2	-67.9	73.1	0	0	0	117.1	L157 S158	L155-L157 PolarHBondContact O-N 3.42Å; L155-S158 PolarHBondContact O-OG 3.28Å
156	G	56.9	Low	60.4	Low	66 Å²	66	119.7 Å²	119.7	68%	0.68	66%	0.657	S	S	*	*	H	α-helix	trans	-80.3	-4.1	178	0	0	0	0	0	117.4
157	L	64.5	Low	61.3	Low	144 Å²	144	115.5 Å²	115.5	75%	0.754	64%	0.639	S	S	*	*	H	α-helix	trans	-93.7	-25.1	-176.5	-62.9	178	0	0	0	113.9	L155 L161	L155-L157 PolarHBondContact O-N 3.42Å; L157-L161 PolarHBondContact O-N 3.3Å
158	S	65.9	Low	61.9	Low	56 Å²	56	109.9 Å²	109.9	39%	0.392	63%	0.625	S	S	.	*	H	α-helix	trans	-68.6	-39.4	-179.5	50.9	0	0	0	0	112	L155 L161 Q162	L155-S158 PolarHBondContact O-OG 3.28Å; S158-L161 PolarHBondContact O-N 3.18Å; S158-Q162 WeakPolarHBondContact O-CB 3.47Å; S158-Q162 WeakPolarHBondContact O-CG 3.44Å; S158-Q162 PolarHBondContact O-N 2.99Å
159	N	68.1	Low	62.4	Low	105 Å²	105	112.7 Å²	112.7	56%	0.561	64%	0.636	S	S	*	*	H	α-helix	trans	-72.6	-33.5	-179.5	-66.3	27.8	0	0	0	111.4	Q162 N163	N159-Q162 PolarHBondContact O-N 3.47Å; N159-N163 WeakPolarHBondContact O-CB 3.34Å; N159-N163 VanDerWaalsContact O-CG 3.23Å; N159-N163 PolarHBondContact O-N 3.49Å; N159-N163 PolarHBondContact O-ND2 3.02Å
160	A	71.9	Confident	63.2	Low	58 Å²	58	106.1 Å²	106.1	48%	0.479	62%	0.615	S	S	.	*	H	α-helix	trans	-63.9	-42.9	173.1	0	0	0	0	0	111.8	L164	A160-L164 WeakPolarHBondContact O-CB 3.29Å; A160-L164 PolarHBondContact O-N 2.94Å
161	L	74.7	Confident	63.9	Low	105 Å²	105	104.3 Å²	104.3	55%	0.55	59%	0.593	S	S	.	*	H	α-helix	trans	-68.7	-37.2	175.1	-81.5	169.5	0	0	0	113.1	L157 S158 L164 K165	L157-L161 PolarHBondContact O-N 3.3Å; S158-L161 PolarHBondContact O-N 3.18Å; L161-L164 PolarHBondContact O-N 3.17Å; L161-K165 WeakPolarHBondContact O-CG 3.34Å; L161-K165 PolarHBondContact O-N 2.66Å
162	Q	70.9	Confident	65	Low	136 Å²	136	102.3 Å²	102.3	64%	0.636	58%	0.58	S	S	*	*	H	α-helix	trans	-62.2	-45.7	175.7	-69.8	-107.5	5.2	0	0	111.3	S158 N159 K165 S166	S158-Q162 WeakPolarHBondContact O-CB 3.47Å; S158-Q162 WeakPolarHBondContact O-CG 3.44Å; S158-Q162 PolarHBondContact O-N 2.99Å; N159-Q162 PolarHBondContact O-N 3.47Å; Q162-K165 PolarHBondContact O-N 3.46Å; Q162-S166 PolarHBondContact O-N 3.3Å; Q162-S166 VanDerWaalsContact O-N 3.13Å
163	N	69.5	Low	66.1	Low	104 Å²	104	103.8 Å²	103.8	56%	0.556	58%	0.579	S	S	*	*	H	α-helix	trans	-63.2	-44.1	175.4	-68	-21.9	0	0	0	111	N159 K165 S166 T167	N159-N163 WeakPolarHBondContact O-CB 3.34Å; N159-N163 VanDerWaalsContact O-CG 3.23Å; N159-N163 PolarHBondContact O-N 3.49Å; N159-N163 PolarHBondContact O-ND2 3.02Å; N163-K165 VanDerWaalsContact C-N 3.33Å; N163-K165 PolarHBondContact O-N 3.31Å; N163-S166 PolarHBondContact O-N 2.8Å; N163-S166 VanDerWaalsContact O-N 3.1Å; N163-S166 PolarHBondContact O-OG 3.39Å; N163-T167 PolarHBondContact O-N 2.78Å; N163-T167 PolarHBondContact O-OG1 3.31Å
164	L	72	Confident	67.3	Low	90 Å²	90	96 Å²	96	47%	0.471	54%	0.539	S	S	.	.	H	α-helix	trans	-62	-37.7	177.3	-172.5	152.5	0	0	0	112.2	A160 L161 S166 T167 I168	A160-L164 WeakPolarHBondContact O-CB 3.29Å; A160-L164 PolarHBondContact O-N 2.94Å; L161-L164 PolarHBondContact O-N 3.17Å; L164-S166 PolarHBondContact O-N 3.1Å; L164-T167 CarbonylContact O-C 3.57Å; L164-T167 PolarHBondContact O-N 3.26Å; L164-I168 HydrophobicContact CD2-CD1 3.27Å; L164-I168 HydrophobicContact CD2-CG1 3.88Å; L164-I168 HydrophobicContact CG-CD1 4.39Å; L164-I168 VanDerWaalsContact O-CG1 3.31Å; L164-I168 WeakPolarHBondContact O-CG1 3.49Å; L164-I168 PolarHBondContact O-N 3.05Å
165	K	68.1	Low	69.1	Low	143 Å²	143	97.6 Å²	97.6	62%	0.622	54%	0.543	S	S	*	.	H	α-helix	trans	-62.9	-39.5	172.7	-75.7	179.9	-179.5	-173.6	0	112.5	L161 Q162 N163 T167 I168 N169	L161-K165 WeakPolarHBondContact O-CG 3.34Å; L161-K165 PolarHBondContact O-N 2.66Å; Q162-K165 PolarHBondContact O-N 3.46Å; N163-K165 VanDerWaalsContact C-N 3.33Å; N163-K165 PolarHBondContact O-N 3.31Å; K165-T167 VanDerWaalsContact C-N 3.31Å; K165-I168 PolarHBondContact O-N 3.2Å; K165-N169 PolarHBondContact O-N 2.65Å; K165-N169 VanDerWaalsContact O-N 3.16Å
166	S	67.2	Low	70.5	Confident	69 Å²	69	94.8 Å²	94.8	48%	0.483	53%	0.533	S	S	.	.	H	α-helix	trans	-66.1	-35.1	175	74.9	0	0	0	0	112.2	Q162 N163 L164 S170	Q162-S166 PolarHBondContact O-N 3.3Å; Q162-S166 VanDerWaalsContact O-N 3.13Å; N163-S166 PolarHBondContact O-N 2.8Å; N163-S166 VanDerWaalsContact O-N 3.1Å; N163-S166 PolarHBondContact O-OG 3.39Å; L164-S166 PolarHBondContact O-N 3.1Å; S166-S170 WeakPolarHBondContact O-CB 3.43Å; S166-S170 PolarHBondContact O-N 2.97Å; S166-S170 VanDerWaalsContact O-N 3.16Å; S166-S170 PolarHBondContact O-OG 3.05Å
167	T	64.2	Low	72	Confident	94 Å²	94	98.4 Å²	98.4	58%	0.577	54%	0.536	S	S	*	.	H	α-helix	trans	-76.6	-30.2	176.5	-45.6	0	0	0	0	112.9	N163 L164 K165 S170	N163-T167 PolarHBondContact O-N 2.78Å; N163-T167 PolarHBondContact O-OG1 3.31Å; L164-T167 CarbonylContact O-C 3.57Å; L164-T167 PolarHBondContact O-N 3.26Å; K165-T167 VanDerWaalsContact C-N 3.31Å; T167-S170 VanDerWaalsContact O-O 3.06Å
168	I	65.7	Low	73	Confident	116 Å²	116	95.5 Å²	95.5	60%	0.595	52%	0.518	S	S	*	.	H	α-helix	trans	-69.8	-38.9	174.5	-74.3	179.8	0	0	0	110.9	L164 K165	L164-I168 HydrophobicContact CD2-CD1 3.27Å; L164-I168 HydrophobicContact CD2-CG1 3.88Å; L164-I168 HydrophobicContact CG-CD1 4.39Å; L164-I168 VanDerWaalsContact O-CG1 3.31Å; L164-I168 WeakPolarHBondContact O-CG1 3.49Å; L164-I168 PolarHBondContact O-N 3.05Å; K165-I168 PolarHBondContact O-N 3.2Å
169	N	63.9	Low	73.9	Confident	140 Å²	140	94.9 Å²	94.9	75%	0.749	51%	0.509	S	S	*	.	H	α-helix	trans	-83.4	-17.6	-177.7	-69.8	-20.1	0	0	0	113.4	K165	K165-N169 PolarHBondContact O-N 2.65Å; K165-N169 VanDerWaalsContact O-N 3.16Å
170	S	66.1	Low	74.9	Confident	64 Å²	64	92.3 Å²	92.3	45%	0.448	50%	0.499	S	S	.	.	S	Bend	trans	-99.9	104.5	172.9	54.6	0	0	0	0	109.7	S166 T167	S166-S170 WeakPolarHBondContact O-CB 3.43Å; S166-S170 PolarHBondContact O-N 2.97Å; S166-S170 VanDerWaalsContact O-N 3.16Å; S166-S170 PolarHBondContact O-OG 3.05Å; T167-S170 VanDerWaalsContact O-O 3.06Å
171	L	68.7	Low	75.7	Confident	48 Å²	48	96.5 Å²	96.5	25%	0.251	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-55.9	132.1	170.7	-64	176.6	0	0	0	108.6	K109 Q111 E116 R173	K109-L171 HydrophobicContact CB-CD1 4.12Å; K109-L171 HydrophobicContact CB-CD2 3.85Å; Q111-L171 HydrophobicContact CG-CB 3.95Å; Q111-L171 HydrophobicContact CG-CD1 4.14Å; E116-L171 HydrophobicContact CG-CD1 4.01Å; L171-R173 PolarHBondContact O-N 2.69Å
172	P	76.3	Confident	76.3	Confident	75 Å²	75	92.7 Å²	92.7	49%	0.487	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-56.5	133.2	178	18.2	-27.5	0	0	0	110	Y110 Q111 L174	Y110-P172 HydrophobicContact CD1-CB 4.04Å; Y110-P172 HydrophobicContact CD1-CG 3.64Å; Y110-P172 WeakPolarHBondContact CD1-O 3.26Å; Y110-P172 HydrophobicContact CE1-CB 4.14Å; Y110-P172 HydrophobicContact CE1-CG 3.64Å; Q111-P172 PolarHBondContact N-O 3.24Å; Q111-P172 VanDerWaalsContact N-O 3.15Å; P172-L174 PolarHBondContact O-N 3.3Å
173	R	77.3	Confident	77.1	Confident	196 Å²	196	89.4 Å²	89.4	74%	0.74	47%	0.469	S	S	*	.	B	Isolated β-bridge	trans	-71.7	119.4	177	-70.3	-82.7	170.8	98.5	-2.9	108.6	Q111 L171	Q111-R173 WeakPolarHBondContact O-CA 3.37Å; Q111-R173 VanDerWaalsContact OE1-NE 3.08Å; L171-R173 PolarHBondContact O-N 2.69Å
174	L	78.7	Confident	78.1	Confident	15 Å²	15	92.1 Å²	92.1	8%	0.079	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-79.7	124.8	173.4	-161.2	62.3	0	0	0	108.2	Y110 Q111 V119 P172 E178 K179 L182	Y110-L174 HydrophobicContact CD1-CB 4.39Å; Y110-L174 HydrophobicContact CD1-CD1 4.07Å; Y110-L174 HydrophobicContact CE1-CD1 4.38Å; Y110-L174 HydrophobicContact CG-CB 4.41Å; Y110-L174 HydrophobicContact CG-CD1 4.33Å; Q111-L174 PolarHBondContact O-N 3.34Å; V119-L174 HydrophobicContact CG2-CD2 4.25Å; P172-L174 PolarHBondContact O-N 3.3Å; L174-E178 HydrophobicContact CD1-CB 3.72Å; L174-E178 HydrophobicContact CD1-CG 3.5Å; L174-E178 VanDerWaalsContact CD1-CG 3.5Å; L174-E178 HydrophobicContact CG-CB 4.27Å; L174-K179 HydrophobicContact CD2-CB 3.5Å; L174-K179 VanDerWaalsContact CD2-CB 3.5Å; L174-K179 HydrophobicContact CD2-CG 3.82Å; L174-K179 HydrophobicContact CG-CB 3.87Å; L174-L182 HydrophobicContact CD1-CD1 3.99Å; L174-L182 HydrophobicContact CD2-CD1 4.28Å
175	S	84.7	Confident	78.9	Confident	70 Å²	70	92.8 Å²	92.8	49%	0.49	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-69.5	150.3	170.5	177.2	0	0	0	0	109.6	L177 E178 K179	S175-L177 PolarHBondContact O-N 2.89Å; S175-E178 PolarHBondContact O-N 3.03Å; S175-K179 PolarHBondContact O-N 3.27Å
176	T	85.7	Confident	79.8	Confident	96 Å²	96	89 Å²	89	59%	0.589	46%	0.455	S	S	*	.	H	α-helix	trans	-51.8	-38.7	174	-49	0	0	0	0	112.1	F112 S180	F112-T176 HydrophobicContact CE2-CG2 4.42Å; F112-T176 HydrophobicContact CZ-CG2 4.43Å; T176-S180 VanDerWaalsContact O-CB 3.24Å; T176-S180 WeakPolarHBondContact O-CB 3.46Å; T176-S180 PolarHBondContact O-N 3.11Å
177	L	88.3	Confident	80.8	Confident	142 Å²	142	91 Å²	91	74%	0.743	45%	0.453	S	S	*	.	H	α-helix	trans	-64.5	-42.8	176.5	-69.4	174.5	0	0	0	112.2	S175 R181	S175-L177 PolarHBondContact O-N 2.89Å; L177-R181 WeakPolarHBondContact O-CB 3.23Å; L177-R181 PolarHBondContact O-N 3.32Å
178	E	85.3	Confident	82	Confident	83 Å²	83	87.6 Å²	87.6	39%	0.388	43%	0.432	S	S	.	.	H	α-helix	trans	-74	-38	-178.3	-167.2	63	-166.6	0	0	111.2	L174 S175 R181 L182	L174-E178 HydrophobicContact CD1-CB 3.72Å; L174-E178 HydrophobicContact CD1-CG 3.5Å; L174-E178 VanDerWaalsContact CD1-CG 3.5Å; L174-E178 HydrophobicContact CG-CB 4.27Å; S175-E178 PolarHBondContact O-N 3.03Å; E178-R181 PolarHBondContact O-N 2.93Å; E178-L182 HydrophobicContact CG-CD1 4.27Å; E178-L182 VanDerWaalsContact O-CG 3.27Å; E178-L182 WeakPolarHBondContact O-CG 3.39Å; E178-L182 PolarHBondContact O-N 3.21Å
179	K	85.1	Confident	83.1	Confident	43 Å²	43	88.2 Å²	88.2	19%	0.187	43%	0.432	C	S	.	.	H	α-helix	trans	-59.8	-53.6	172	-172	179	172.6	-171.6	0	110.7	F112 L174 S175 R181 L182 D183	F112-K179 HydrophobicContact CB-CD 4.22Å; F112-K179 HydrophobicContact CD1-CD 3.61Å; F112-K179 HydrophobicContact CD2-CB 4.32Å; F112-K179 HydrophobicContact CD2-CD 3.8Å; F112-K179 HydrophobicContact CE1-CD 3.84Å; F112-K179 HydrophobicContact CE2-CB 4.45Å; F112-K179 HydrophobicContact CE2-CD 4.04Å; F112-K179 HydrophobicContact CG-CD 3.58Å; F112-K179 HydrophobicContact CZ-CD 4.05Å; L174-K179 HydrophobicContact CD2-CB 3.5Å; L174-K179 VanDerWaalsContact CD2-CB 3.5Å; L174-K179 HydrophobicContact CD2-CG 3.82Å; L174-K179 HydrophobicContact CG-CB 3.87Å; S175-K179 PolarHBondContact O-N 3.27Å; K179-R181 VanDerWaalsContact C-N 3.3Å; K179-R181 PolarHBondContact O-N 3.37Å; K179-L182 PolarHBondContact O-N 3.44Å; K179-D183 WeakPolarHBondContact CE-OD2 3.43Å; K179-D183 WeakPolarHBondContact CG-OD2 3.14Å; K179-D183 WeakPolarHBondContact O-CB 2.93Å; K179-D183 VanDerWaalsContact O-CG 3.24Å; K179-D183 PolarHBondContact O-N 3.2Å
180	S	88.1	Confident	84.3	Confident	51 Å²	51	89.2 Å²	89.2	36%	0.357	43%	0.43	S	S	.	.	H	α-helix	trans	-54.8	-47.6	178.1	179.4	0	0	0	0	111	T176 L182 D183 W184	T176-S180 VanDerWaalsContact O-CB 3.24Å; T176-S180 WeakPolarHBondContact O-CB 3.46Å; T176-S180 PolarHBondContact O-N 3.11Å; S180-L182 VanDerWaalsContact C-N 3.31Å; S180-L182 PolarHBondContact O-N 2.88Å; S180-D183 PolarHBondContact O-N 3.48Å; S180-W184 WeakPolarHBondContact O-CB 3.45Å; S180-W184 PolarHBondContact O-N 3.48Å; S180-W184 VanDerWaalsContact OG-CD1 3.32Å; S180-W184 PolarHBondContact OG-NE1 3.21Å
181	R	88.7	Confident	85.5	Confident	146 Å²	146	90.6 Å²	90.6	55%	0.551	43%	0.43	S	S	*	.	H	α-helix	trans	-57.9	-41.4	177.3	-174.1	-178.6	-170.9	176.2	4.1	113	L177 E178 K179 K185	L177-R181 WeakPolarHBondContact O-CB 3.23Å; L177-R181 PolarHBondContact O-N 3.32Å; E178-R181 PolarHBondContact O-N 2.93Å; K179-R181 VanDerWaalsContact C-N 3.3Å; K179-R181 PolarHBondContact O-N 3.37Å; R181-K185 VanDerWaalsContact O-CG 3.31Å; R181-K185 WeakPolarHBondContact O-CG 3.34Å; R181-K185 PolarHBondContact O-N 2.88Å; R181-K185 VanDerWaalsContact O-N 3.13Å
182	L	86.9	Confident	86.4	Confident	26 Å²	26	92.8 Å²	92.8	14%	0.136	45%	0.449	C	S	.	.	H	α-helix	trans	-72	-44.5	179.3	-70.7	166.5	0	0	0	111.6	V119 L174 E178 K179 S180 W184 K185 Q186	V119-L182 HydrophobicContact CB-CD1 4.48Å; V119-L182 HydrophobicContact CG1-CB 4.42Å; V119-L182 HydrophobicContact CG1-CD1 3.74Å; V119-L182 HydrophobicContact CG1-CD2 4.06Å; V119-L182 HydrophobicContact CG1-CG 4.3Å; V119-L182 HydrophobicContact CG2-CD1 3.95Å; L174-L182 HydrophobicContact CD1-CD1 3.99Å; L174-L182 HydrophobicContact CD2-CD1 4.28Å; E178-L182 HydrophobicContact CG-CD1 4.27Å; E178-L182 VanDerWaalsContact O-CG 3.27Å; E178-L182 WeakPolarHBondContact O-CG 3.39Å; E178-L182 PolarHBondContact O-N 3.21Å; K179-L182 PolarHBondContact O-N 3.44Å; S180-L182 VanDerWaalsContact C-N 3.31Å; S180-L182 PolarHBondContact O-N 2.88Å; L182-W184 VanDerWaalsContact C-N 3.29Å; L182-W184 PolarHBondContact O-N 3.39Å; L182-K185 PolarHBondContact O-N 2.86Å; L182-Q186 WeakPolarHBondContact O-CG 3.26Å; L182-Q186 PolarHBondContact O-N 3.4Å
183	D	88.6	Confident	87	Confident	67 Å²	67	91.8 Å²	91.8	36%	0.358	44%	0.439	S	S	.	.	H	α-helix	trans	-59.4	-42.8	176.6	-67.1	-5.8	0	0	0	110.2	K179 S180 Q186 Y187	K179-D183 WeakPolarHBondContact CE-OD2 3.43Å; K179-D183 WeakPolarHBondContact CG-OD2 3.14Å; K179-D183 WeakPolarHBondContact O-CB 2.93Å; K179-D183 VanDerWaalsContact O-CG 3.24Å; K179-D183 PolarHBondContact O-N 3.2Å; S180-D183 PolarHBondContact O-N 3.48Å; D183-Q186 PolarHBondContact O-N 3.48Å; D183-Y187 VanDerWaalsContact O-CB 3.27Å; D183-Y187 WeakPolarHBondContact O-CB 3.48Å; D183-Y187 PolarHBondContact O-N 3.46Å
184	W	90	Very high	87.5	Confident	160 Å²	160	86.4 Å²	86.4	61%	0.606	42%	0.422	S	S	*	.	H	α-helix	trans	-61.7	-45.6	174.3	-83	114.1	0	0	0	112.6	S180 L182 Y187 V188	S180-W184 WeakPolarHBondContact O-CB 3.45Å; S180-W184 PolarHBondContact O-N 3.48Å; S180-W184 VanDerWaalsContact OG-CD1 3.32Å; S180-W184 PolarHBondContact OG-NE1 3.21Å; L182-W184 VanDerWaalsContact C-N 3.29Å; L182-W184 PolarHBondContact O-N 3.39Å; W184-Y187 HydrophobicContact CE3-CD1 4.44Å; W184-Y187 HydrophobicContact CZ3-CD1 4.41Å; W184-Y187 PolarHBondContact O-N 3.27Å; W184-V188 VanDerWaalsContact O-CG2 3.26Å; W184-V188 WeakPolarHBondContact O-CG2 3.36Å; W184-V188 PolarHBondContact O-N 3.37Å
185	K	88.9	Confident	87.9	Confident	105 Å²	105	91.7 Å²	91.7	46%	0.457	45%	0.45	S	S	.	.	H	α-helix	trans	-61.7	-46.5	177.2	-76.7	175.9	175.4	-175.4	0	111.6	R181 L182 Y187 V188 E189	R181-K185 VanDerWaalsContact O-CG 3.31Å; R181-K185 WeakPolarHBondContact O-CG 3.34Å; R181-K185 PolarHBondContact O-N 2.88Å; R181-K185 VanDerWaalsContact O-N 3.13Å; L182-K185 PolarHBondContact O-N 2.86Å; K185-Y187 VanDerWaalsContact C-N 3.3Å; K185-Y187 PolarHBondContact O-N 3.11Å; K185-V188 PolarHBondContact O-N 3.5Å; K185-E189 WeakPolarHBondContact O-CG 3.44Å; K185-E189 PolarHBondContact O-N 3.38Å
186	Q	87.2	Confident	88	Confident	62 Å²	62	93.4 Å²	93.4	29%	0.29	45%	0.454	S	S	.	.	H	α-helix	trans	-62.1	-39.4	177.3	-72.7	178.7	-8.1	0	0	111.6	I120 L182 D183 E189 K190	I120-Q186 PolarHBondContact O-NE2 2.98Å; L182-Q186 WeakPolarHBondContact O-CG 3.26Å; L182-Q186 PolarHBondContact O-N 3.4Å; D183-Q186 PolarHBondContact O-N 3.48Å; Q186-E189 PolarHBondContact O-N 2.95Å; Q186-K190 WeakPolarHBondContact O-CB 3.37Å; Q186-K190 PolarHBondContact O-N 3.41Å
187	Y	88.6	Confident	88.1	Confident	113 Å²	113	92.7 Å²	92.7	44%	0.443	45%	0.446	S	S	.	.	H	α-helix	trans	-64.1	-46.4	175.6	-178.2	-99.6	0	0	0	112.1	D183 W184 K185 E189 K190 E191 L193	D183-Y187 VanDerWaalsContact O-CB 3.27Å; D183-Y187 WeakPolarHBondContact O-CB 3.48Å; D183-Y187 PolarHBondContact O-N 3.46Å; W184-Y187 HydrophobicContact CE3-CD1 4.44Å; W184-Y187 HydrophobicContact CZ3-CD1 4.41Å; W184-Y187 PolarHBondContact O-N 3.27Å; K185-Y187 VanDerWaalsContact C-N 3.3Å; K185-Y187 PolarHBondContact O-N 3.11Å; Y187-E189 VanDerWaalsContact C-N 3.32Å; Y187-E189 PolarHBondContact O-N 2.93Å; Y187-K190 PolarHBondContact O-N 2.96Å; Y187-E191 HydrophobicContact CD2-CG 4.06Å; Y187-E191 HydrophobicContact CE1-CG 4.2Å; Y187-E191 HydrophobicContact CE2-CG 3.64Å; Y187-E191 WeakPolarHBondContact O-CB 3.46Å; Y187-E191 PolarHBondContact O-N 2.99Å; Y187-L193 HydrophobicContact CD1-CD1 4.02Å; Y187-L193 HydrophobicContact CE1-CD1 3.49Å; Y187-L193 VanDerWaalsContact CE1-CD1 3.49Å
188	V	90.1	Very high	88	Confident	22 Å²	22	89.7 Å²	89.7	13%	0.133	43%	0.427	C	S	.	.	H	α-helix	trans	-60.9	-41.3	177.5	170.5	0	0	0	0	111.4	W184 K185 S192 L193 E194	W184-V188 VanDerWaalsContact O-CG2 3.26Å; W184-V188 WeakPolarHBondContact O-CG2 3.36Å; W184-V188 PolarHBondContact O-N 3.37Å; K185-V188 PolarHBondContact O-N 3.5Å; V188-S192 CarbonylContact O-C 3.6Å; V188-S192 WeakPolarHBondContact O-CA 3.37Å; V188-S192 PolarHBondContact O-N 3.13Å; V188-S192 VanDerWaalsContact O-N 3.12Å; V188-L193 HydrophobicContact CG1-CB 4.32Å; V188-L193 PolarHBondContact O-N 2.87Å; V188-E194 HydrophobicContact CG1-CB 4.08Å
189	E	88.4	Confident	87.9	Confident	128 Å²	128	88.4 Å²	88.4	60%	0.598	43%	0.431	S	S	*	.	H	α-helix	trans	-68	-44.7	175.6	-72.4	177.3	-171.3	0	0	112.1	K185 Q186 Y187 S192	K185-E189 WeakPolarHBondContact O-CG 3.44Å; K185-E189 PolarHBondContact O-N 3.38Å; Q186-E189 PolarHBondContact O-N 2.95Å; Y187-E189 VanDerWaalsContact C-N 3.32Å; Y187-E189 PolarHBondContact O-N 2.93Å; E189-S192 PolarHBondContact O-N 3.27Å
190	K	88.7	Confident	87.8	Confident	162 Å²	162	90.6 Å²	90.6	70%	0.704	44%	0.442	S	S	*	.	H	α-helix	trans	-63	-47	-178.9	-179.5	-173.7	171.7	-164.6	0	112.2	Q186 Y187 S192	Q186-K190 WeakPolarHBondContact O-CB 3.37Å; Q186-K190 PolarHBondContact O-N 3.41Å; Y187-K190 PolarHBondContact O-N 2.96Å; K190-S192 PolarHBondContact O-N 3.45Å
191	E	90.5	Very high	87.6	Confident	93 Å²	93	92 Å²	92	44%	0.435	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	1.6	-179.7	-61.2	-58.1	138.7	0	0	112.2	Y187 L193	Y187-E191 HydrophobicContact CD2-CG 4.06Å; Y187-E191 HydrophobicContact CE1-CG 4.2Å; Y187-E191 HydrophobicContact CE2-CG 3.64Å; Y187-E191 WeakPolarHBondContact O-CB 3.46Å; Y187-E191 PolarHBondContact O-N 2.99Å; E191-L193 HydrophobicContact CB-CD1 3.69Å; E191-L193 HydrophobicContact CB-CD2 4.48Å; E191-L193 HydrophobicContact CB-CG 3.62Å; E191-L193 HydrophobicContact CG-CD1 4.37Å; E191-L193 PolarHBondContact O-N 3.43Å
192	S	88	Confident	87.2	Confident	93 Å²	93	93.3 Å²	93.3	65%	0.65	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	33.6	-176.6	-57.8	0	0	0	0	113.5	V188 E189 K190 E194	V188-S192 CarbonylContact O-C 3.6Å; V188-S192 WeakPolarHBondContact O-CA 3.37Å; V188-S192 PolarHBondContact O-N 3.13Å; V188-S192 VanDerWaalsContact O-N 3.12Å; E189-S192 PolarHBondContact O-N 3.27Å; K190-S192 PolarHBondContact O-N 3.45Å; S192-E194 PolarHBondContact O-N 2.73Å
193	L	88.9	Confident	86.9	Confident	55 Å²	55	93.3 Å²	93.3	29%	0.288	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-3.2	-177.6	-67.1	169.2	0	0	0	113.3	Y187 V188 E191 D195 D196 L197	Y187-L193 HydrophobicContact CD1-CD1 4.02Å; Y187-L193 HydrophobicContact CE1-CD1 3.49Å; Y187-L193 VanDerWaalsContact CE1-CD1 3.49Å; V188-L193 HydrophobicContact CG1-CB 4.32Å; V188-L193 PolarHBondContact O-N 2.87Å; E191-L193 HydrophobicContact CB-CD1 3.69Å; E191-L193 HydrophobicContact CB-CD2 4.48Å; E191-L193 HydrophobicContact CB-CG 3.62Å; E191-L193 HydrophobicContact CG-CD1 4.37Å; E191-L193 PolarHBondContact O-N 3.43Å; L193-D195 VanDerWaalsContact C-N 3.27Å; L193-D195 PolarHBondContact O-N 3.37Å; L193-D196 PolarHBondContact O-N 3.46Å; L193-L197 VanDerWaalsContact O-CB 3.26Å; L193-L197 WeakPolarHBondContact O-CB 3.28Å; L193-L197 PolarHBondContact O-N 2.77Å
194	E	88.1	Confident	86.5	Confident	83 Å²	83	99 Å²	99	39%	0.388	48%	0.482	S	S	.	.	H	α-helix	trans	-58.9	-39.3	-176.8	-178.2	62.1	-156.3	0	0	112.2	V188 S192 K198	V188-E194 HydrophobicContact CG1-CB 4.08Å; S192-E194 PolarHBondContact O-N 2.73Å; E194-K198 HydrophobicContact CG-CD 4.37Å; E194-K198 VanDerWaalsContact CG-NZ 3.27Å; E194-K198 WeakPolarHBondContact O-CB 3.33Å; E194-K198 WeakPolarHBondContact O-CD 3.3Å; E194-K198 VanDerWaalsContact O-CG 3.23Å; E194-K198 WeakPolarHBondContact O-CG 3.33Å; E194-K198 PolarHBondContact O-N 3.26Å; E194-K198 WeakPolarHBondContact OE1-CE 3.45Å; E194-K198 IonicContact OE1-NZ 3.2Å; E194-K198 PolarHBondContact OE1-NZ 3.25Å
195	D	86.9	Confident	86.1	Confident	125 Å²	125	98 Å²	98	67%	0.668	49%	0.485	S	S	*	.	H	α-helix	trans	-74.5	-38.8	179.4	-73.6	-21.6	0	0	0	111.9	L193 K198 A199	L193-D195 VanDerWaalsContact C-N 3.27Å; L193-D195 PolarHBondContact O-N 3.37Å; D195-K198 PolarHBondContact O-N 3.11Å; D195-A199 WeakPolarHBondContact O-CB 3.29Å; D195-A199 PolarHBondContact O-N 3.37Å
196	D	87.6	Confident	86	Confident	107 Å²	107	93 Å²	93	57%	0.572	46%	0.463	S	S	*	.	H	α-helix	trans	-66.4	-44.4	175.3	-174.3	42.6	0	0	0	111.3	L193 K198 A199 H200	L193-D196 PolarHBondContact O-N 3.46Å; D196-K198 VanDerWaalsContact C-N 3.33Å; D196-K198 PolarHBondContact O-N 2.79Å; D196-A199 CarbonylContact O-C 3.58Å; D196-A199 WeakPolarHBondContact O-CB 3.37Å; D196-A199 PolarHBondContact O-N 3.22Å; D196-A199 VanDerWaalsContact O-N 3.1Å; D196-H200 WeakPolarHBondContact O-CB 3.22Å; D196-H200 PolarHBondContact O-N 2.95Å
197	L	87.6	Confident	86.1	Confident	80 Å²	80	97 Å²	97	42%	0.419	48%	0.476	S	S	.	.	H	α-helix	trans	-62.7	-40.8	176.5	-173	63.5	0	0	0	111.5	L193 H200 N201	L193-L197 VanDerWaalsContact O-CB 3.26Å; L193-L197 WeakPolarHBondContact O-CB 3.28Å; L193-L197 PolarHBondContact O-N 2.77Å; L197-H200 PolarHBondContact O-N 3.43Å; L197-N201 WeakPolarHBondContact O-CB 3.3Å; L197-N201 VanDerWaalsContact O-CG 3.25Å; L197-N201 PolarHBondContact O-N 3.41Å; L197-N201 PolarHBondContact O-ND2 3.38Å
198	K	85.1	Confident	86	Confident	80 Å²	80	95 Å²	95	35%	0.348	47%	0.473	S	S	.	.	H	α-helix	trans	-63.7	-41.7	172.3	-80.9	169.7	174.8	142.5	0	111.9	E194 D195 D196 K202	E194-K198 HydrophobicContact CG-CD 4.37Å; E194-K198 VanDerWaalsContact CG-NZ 3.27Å; E194-K198 WeakPolarHBondContact O-CB 3.33Å; E194-K198 WeakPolarHBondContact O-CD 3.3Å; E194-K198 VanDerWaalsContact O-CG 3.23Å; E194-K198 WeakPolarHBondContact O-CG 3.33Å; E194-K198 PolarHBondContact O-N 3.26Å; E194-K198 WeakPolarHBondContact OE1-CE 3.45Å; E194-K198 IonicContact OE1-NZ 3.2Å; E194-K198 PolarHBondContact OE1-NZ 3.25Å; D195-K198 PolarHBondContact O-N 3.11Å; D196-K198 VanDerWaalsContact C-N 3.33Å; D196-K198 PolarHBondContact O-N 2.79Å; K198-K202 WeakPolarHBondContact O-CB 3.28Å; K198-K202 WeakPolarHBondContact O-CD 3.2Å; K198-K202 VanDerWaalsContact O-CG 3.28Å; K198-K202 WeakPolarHBondContact O-CG 3.48Å; K198-K202 PolarHBondContact O-N 2.88Å; K198-K202 VanDerWaalsContact O-N 3.11Å
199	A	83.9	Confident	86	Confident	56 Å²	56	97.4 Å²	97.4	46%	0.463	48%	0.483	S	S	.	.	H	α-helix	trans	-65	-43.7	177.9	0	0	0	0	0	111	D195 D196 K202 G203	D195-A199 WeakPolarHBondContact O-CB 3.29Å; D195-A199 PolarHBondContact O-N 3.37Å; D196-A199 CarbonylContact O-C 3.58Å; D196-A199 WeakPolarHBondContact O-CB 3.37Å; D196-A199 PolarHBondContact O-N 3.22Å; D196-A199 VanDerWaalsContact O-N 3.1Å; A199-K202 CarbonylContact O-C 3.52Å; A199-K202 PolarHBondContact O-N 2.94Å; A199-G203 VanDerWaalsContact O-CA 3.3Å; A199-G203 WeakPolarHBondContact O-CA 3.22Å; A199-G203 PolarHBondContact O-N 3.41Å
200	H	83.8	Confident	86.1	Confident	89 Å²	89	97.8 Å²	97.8	41%	0.412	48%	0.479	S	S	.	.	H	α-helix	trans	-63.8	-42	176.7	-175.8	-90	0	0	0	111.9	D196 L197 K202 G203 G206	D196-H200 WeakPolarHBondContact O-CB 3.22Å; D196-H200 PolarHBondContact O-N 2.95Å; L197-H200 PolarHBondContact O-N 3.43Å; H200-K202 VanDerWaalsContact C-N 3.29Å; H200-K202 PolarHBondContact O-N 2.83Å; H200-G203 PolarHBondContact O-N 2.82Å; H200-G206 VanDerWaalsContact O-CA 3.26Å; H200-G206 WeakPolarHBondContact O-CA 3.19Å; H200-G206 PolarHBondContact O-N 2.83Å
201	N	82.4	Confident	86.3	Confident	81 Å²	81	93.6 Å²	93.6	43%	0.433	46%	0.462	S	S	.	.	H	α-helix	trans	-64.9	-31.6	176.4	-75.5	-34.7	0	0	0	113.4	L197	L197-N201 WeakPolarHBondContact O-CB 3.3Å; L197-N201 VanDerWaalsContact O-CG 3.25Å; L197-N201 PolarHBondContact O-N 3.41Å; L197-N201 PolarHBondContact O-ND2 3.38Å
202	K	81.6	Confident	86.4	Confident	172 Å²	172	91 Å²	91	75%	0.748	46%	0.456	S	S	*	.	H	α-helix	trans	-91.5	-13.9	176.9	-67.8	165.2	174.6	173.4	0	113.4	K198 A199 H200	K198-K202 WeakPolarHBondContact O-CB 3.28Å; K198-K202 WeakPolarHBondContact O-CD 3.2Å; K198-K202 VanDerWaalsContact O-CG 3.28Å; K198-K202 WeakPolarHBondContact O-CG 3.48Å; K198-K202 PolarHBondContact O-N 2.88Å; K198-K202 VanDerWaalsContact O-N 3.11Å; A199-K202 CarbonylContact O-C 3.52Å; A199-K202 PolarHBondContact O-N 2.94Å; H200-K202 VanDerWaalsContact C-N 3.29Å; H200-K202 PolarHBondContact O-N 2.83Å
203	G	81	Confident	86.6	Confident	26 Å²	26	92.4 Å²	92.4	27%	0.268	45%	0.451	S	S	.	.	S	Bend	trans	-76.1	170.8	-171.8	0	0	0	0	0	111.9	A199 H200 E205 G206	A199-G203 VanDerWaalsContact O-CA 3.3Å; A199-G203 WeakPolarHBondContact O-CA 3.22Å; A199-G203 PolarHBondContact O-N 3.41Å; H200-G203 PolarHBondContact O-N 2.82Å; G203-E205 PolarHBondContact O-N 2.88Å; G203-E205 VanDerWaalsContact O-N 3.13Å; G203-G206 PolarHBondContact O-N 3.45Å
204	K	79.4	Confident	86.8	Confident	186 Å²	186	96 Å²	96	81%	0.809	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-23.4	176.6	-167.9	178.5	177.2	-172.1	0	113
205	E	81.7	Confident	87.1	Confident	140 Å²	140	94.6 Å²	94.6	65%	0.654	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	7.1	179.3	-60.6	-177.9	-175.8	0	0	113	G203 R210	G203-E205 PolarHBondContact O-N 2.88Å; G203-E205 VanDerWaalsContact O-N 3.13Å; E205-R210 PolarHBondContact O-NH1 3.32Å
206	G	86.7	Confident	87.5	Confident	0 Å²	0	94.7 Å²	94.7	0%	0	45%	0.45	C	S	.	.	S	Bend	trans	-69.2	149.4	173.4	0	0	0	0	0	112	H200 G203 L208 E209 R210	H200-G206 VanDerWaalsContact O-CA 3.26Å; H200-G206 WeakPolarHBondContact O-CA 3.19Å; H200-G206 PolarHBondContact O-N 2.83Å; G203-G206 PolarHBondContact O-N 3.45Å; G206-L208 PolarHBondContact O-N 3.34Å; G206-E209 PolarHBondContact O-N 3.27Å; G206-R210 PolarHBondContact O-N 3.09Å
207	Y	88.9	Confident	87.9	Confident	145 Å²	145	91 Å²	91	57%	0.569	44%	0.435	S	S	*	.	H	α-helix	trans	-57.5	-39.3	172.9	175.6	-99.5	0	0	0	111.7	R210 Q211	Y207-R210 PolarHBondContact O-N 2.69Å; Y207-Q211 WeakPolarHBondContact O-CB 3.42Å; Y207-Q211 PolarHBondContact O-N 2.85Å
208	L	87.6	Confident	88.2	Confident	73 Å²	73	89.8 Å²	89.8	38%	0.382	43%	0.433	S	S	.	.	H	α-helix	trans	-62.7	-43.4	178.5	-63.5	176.9	0	0	0	112.1	L90 G206 Q211 A212	L90-L208 HydrophobicContact CD1-CD1 4.07Å; G206-L208 PolarHBondContact O-N 3.34Å; L208-Q211 PolarHBondContact O-N 3.34Å; L208-A212 VanDerWaalsContact O-CB 3.28Å; L208-A212 WeakPolarHBondContact O-CB 3.32Å; L208-A212 PolarHBondContact O-N 2.74Å
209	E	88.5	Confident	88.7	Confident	71 Å²	71	90.5 Å²	90.5	33%	0.332	44%	0.438	S	S	.	.	H	α-helix	trans	-69	-38.2	176.8	-175.9	61.6	-159.4	0	0	111.4	G206 Q211 A212 F213	G206-E209 PolarHBondContact O-N 3.27Å; E209-Q211 VanDerWaalsContact C-N 3.33Å; E209-Q211 PolarHBondContact O-N 2.94Å; E209-A212 PolarHBondContact O-N 3.04Å; E209-F213 VanDerWaalsContact O-CB 3.29Å; E209-F213 WeakPolarHBondContact O-CB 3.28Å; E209-F213 PolarHBondContact O-N 3.47Å
210	R	91.5	Very high	89.3	Confident	136 Å²	136	93.8 Å²	93.8	51%	0.513	44%	0.438	S	S	.	.	H	α-helix	trans	-59.8	-44	173.2	-75.3	-166.5	-71.1	-88.4	-5.1	111.8	E205 G206 Y207 F213 F214	E205-R210 PolarHBondContact O-NH1 3.32Å; G206-R210 PolarHBondContact O-N 3.09Å; Y207-R210 PolarHBondContact O-N 2.69Å; R210-F213 PolarHBondContact O-N 3.43Å; R210-F214 PolarHBondContact O-N 2.99Å
211	Q	92.6	Very high	89.8	Confident	74 Å²	74	96.1 Å²	96.1	35%	0.346	45%	0.449	S	S	.	.	H	α-helix	trans	-67.7	-43.2	177.9	-170.2	66.8	-2.2	0	0	111.6	Y207 L208 E209 F213 F214 N215	Y207-Q211 WeakPolarHBondContact O-CB 3.42Å; Y207-Q211 PolarHBondContact O-N 2.85Å; L208-Q211 PolarHBondContact O-N 3.34Å; E209-Q211 VanDerWaalsContact C-N 3.33Å; E209-Q211 PolarHBondContact O-N 2.94Å; Q211-F213 VanDerWaalsContact C-N 3.29Å; Q211-F213 PolarHBondContact O-N 3.33Å; Q211-F214 PolarHBondContact O-N 3.38Å; Q211-N215 PolarHBondContact O-N 3.01Å
212	A	91.5	Very high	90.4	Very high	38 Å²	38	99.1 Å²	99.1	31%	0.314	46%	0.456	S	S	.	.	H	α-helix	trans	-62.3	-37.4	174.9	0	0	0	0	0	111.9	L208 E209 R216	L208-A212 VanDerWaalsContact O-CB 3.28Å; L208-A212 WeakPolarHBondContact O-CB 3.32Å; L208-A212 PolarHBondContact O-N 2.74Å; E209-A212 PolarHBondContact O-N 3.04Å; A212-R216 VanDerWaalsContact O-CB 3.3Å; A212-R216 WeakPolarHBondContact O-CB 3.14Å; A212-R216 PolarHBondContact O-N 3.19Å
213	F	92.1	Very high	91	Very high	124 Å²	124	95.1 Å²	95.1	54%	0.544	44%	0.44	S	S	.	.	H	α-helix	trans	-64.2	-47.1	173	176	-91.8	0	0	0	111.4	E209 R210 Q211 N215 R216 A217	E209-F213 VanDerWaalsContact O-CB 3.29Å; E209-F213 WeakPolarHBondContact O-CB 3.28Å; E209-F213 PolarHBondContact O-N 3.47Å; R210-F213 PolarHBondContact O-N 3.43Å; Q211-F213 VanDerWaalsContact C-N 3.29Å; Q211-F213 PolarHBondContact O-N 3.33Å; F213-N215 VanDerWaalsContact C-N 3.31Å; F213-N215 PolarHBondContact O-N 3.33Å; F213-R216 PolarHBondContact O-N 2.86Å; F213-A217 HydrophobicContact CE1-CB 4.25Å; F213-A217 HydrophobicContact CZ-CB 4.44Å; F213-A217 VanDerWaalsContact O-CB 3.22Å; F213-A217 WeakPolarHBondContact O-CB 3.39Å; F213-A217 PolarHBondContact O-N 3.26Å
214	F	94.7	Very high	91.5	Very high	129 Å²	129	100.7 Å²	100.7	57%	0.566	45%	0.454	S	S	*	.	H	α-helix	trans	-56.7	-47.4	176.1	178.8	-98	0	0	0	111	R210 Q211 A217 S218	R210-F214 PolarHBondContact O-N 2.99Å; Q211-F214 PolarHBondContact O-N 3.38Å; F214-A217 PolarHBondContact O-N 3.17Å; F214-S218 WeakPolarHBondContact O-CB 3.5Å; F214-S218 PolarHBondContact O-N 2.84Å
215	N	94.6	Very high	92.2	Very high	54 Å²	54	96.2 Å²	96.2	29%	0.289	44%	0.436	S	S	.	.	H	α-helix	trans	-61.4	-47.6	177.3	-69	-12.5	0	0	0	111.4	Q211 F213 A217 S218 E219	Q211-N215 PolarHBondContact O-N 3.01Å; F213-N215 VanDerWaalsContact C-N 3.31Å; F213-N215 PolarHBondContact O-N 3.33Å; N215-A217 PolarHBondContact O-N 3.05Å; N215-S218 PolarHBondContact O-N 2.89Å; N215-E219 WeakPolarHBondContact O-CB 3.48Å; N215-E219 WeakPolarHBondContact O-CG 3.37Å; N215-E219 PolarHBondContact O-N 2.88Å
216	R	94.2	Very high	92.8	Very high	127 Å²	127	93.6 Å²	93.6	48%	0.479	42%	0.42	S	S	.	.	H	α-helix	trans	-63.1	-39	177.6	-174	-171.6	-65.3	148.8	3.1	112.5	A212 F213 R220	A212-R216 VanDerWaalsContact O-CB 3.3Å; A212-R216 WeakPolarHBondContact O-CB 3.14Å; A212-R216 PolarHBondContact O-N 3.19Å; F213-R216 PolarHBondContact O-N 2.86Å; R216-R220 WeakPolarHBondContact O-CB 3.36Å; R216-R220 PolarHBondContact O-N 3.49Å
217	A	95.6	Very high	93.1	Very high	30 Å²	30	98.8 Å²	98.8	25%	0.248	44%	0.444	C	S	.	.	H	α-helix	trans	-68.7	-46.7	178.4	0	0	0	0	0	110.9	F213 F214 N215 R220 E221	F213-A217 HydrophobicContact CE1-CB 4.25Å; F213-A217 HydrophobicContact CZ-CB 4.44Å; F213-A217 VanDerWaalsContact O-CB 3.22Å; F213-A217 WeakPolarHBondContact O-CB 3.39Å; F213-A217 PolarHBondContact O-N 3.26Å; F214-A217 PolarHBondContact O-N 3.17Å; N215-A217 PolarHBondContact O-N 3.05Å; A217-R220 WeakPolarHBondContact O-CB 3.32Å; A217-R220 PolarHBondContact O-N 2.87Å; A217-R220 VanDerWaalsContact O-N 3.17Å; A217-E221 WeakPolarHBondContact O-CB 3.18Å; A217-E221 PolarHBondContact O-N 2.86Å
218	S	95.5	Very high	93.2	Very high	55 Å²	55	97.4 Å²	97.4	39%	0.385	45%	0.446	S	S	.	.	H	α-helix	trans	-60.1	-45.6	175.1	179.4	0	0	0	0	111.7	F214 N215 R220 E221 Y222	F214-S218 WeakPolarHBondContact O-CB 3.5Å; F214-S218 PolarHBondContact O-N 2.84Å; N215-S218 PolarHBondContact O-N 2.89Å; S218-R220 VanDerWaalsContact C-N 3.32Å; S218-R220 PolarHBondContact O-N 3.12Å; S218-E221 PolarHBondContact O-N 3.45Å; S218-Y222 WeakPolarHBondContact O-CB 3.17Å; S218-Y222 PolarHBondContact O-N 2.76Å
219	E	95.3	Very high	93.4	Very high	94 Å²	94	99.3 Å²	99.3	44%	0.439	45%	0.451	S	S	.	.	H	α-helix	trans	-57.9	-43.5	173.4	-76.3	170.4	-166.4	0	0	111.5	K79 N215 Q223	K79-E219 IonicContact NZ-OE1 2.76Å; K79-E219 PolarHBondContact NZ-OE1 3.4Å; K79-E219 IonicContact NZ-OE2 3.92Å; N215-E219 WeakPolarHBondContact O-CB 3.48Å; N215-E219 WeakPolarHBondContact O-CG 3.37Å; N215-E219 PolarHBondContact O-N 2.88Å; E219-Q223 VanDerWaalsContact O-CG 3.24Å; E219-Q223 WeakPolarHBondContact O-CG 3.37Å; E219-Q223 PolarHBondContact O-N 3.33Å
220	R	95.1	Very high	93.5	Very high	125 Å²	125	101.3 Å²	101.3	47%	0.472	46%	0.459	S	S	.	.	H	α-helix	trans	-66.7	-44.7	179.1	-169.9	-172.2	-65.7	122.1	-3.3	111.8	R216 A217 S218 Q223 Y224	R216-R220 WeakPolarHBondContact O-CB 3.36Å; R216-R220 PolarHBondContact O-N 3.49Å; A217-R220 WeakPolarHBondContact O-CB 3.32Å; A217-R220 PolarHBondContact O-N 2.87Å; A217-R220 VanDerWaalsContact O-N 3.17Å; S218-R220 VanDerWaalsContact C-N 3.32Å; S218-R220 PolarHBondContact O-N 3.12Å; R220-Q223 PolarHBondContact O-N 3.33Å; R220-Y224 HydrophobicContact CG-CD2 3.88Å; R220-Y224 HydrophobicContact CG-CE2 3.44Å; R220-Y224 VanDerWaalsContact CG-CE2 3.44Å; R220-Y224 WeakPolarHBondContact O-CD2 3.21Å; R220-Y224 PolarHBondContact O-N 3.04Å
221	E	94.7	Very high	93.4	Very high	139 Å²	139	97.9 Å²	97.9	65%	0.65	46%	0.455	S	S	*	.	H	α-helix	trans	-59.7	-47.5	176.2	-177.7	174.6	-153.6	0	0	111.1	A217 S218 Q223 Y224 E225	A217-E221 WeakPolarHBondContact O-CB 3.18Å; A217-E221 PolarHBondContact O-N 2.86Å; S218-E221 PolarHBondContact O-N 3.45Å; E221-Q223 VanDerWaalsContact C-N 3.3Å; E221-Q223 PolarHBondContact O-N 3.08Å; E221-Y224 PolarHBondContact O-N 3.19Å; E221-Y224 VanDerWaalsContact O-N 3.12Å; E221-E225 PolarHBondContact O-N 3.14Å
222	Y	95.2	Very high	93.1	Very high	143 Å²	143	98.5 Å²	98.5	56%	0.561	46%	0.464	S	S	*	.	H	α-helix	trans	-57.8	-41.5	175.8	176.7	-106.8	0	0	0	112.2	S218 E225 R226	S218-Y222 WeakPolarHBondContact O-CB 3.17Å; S218-Y222 PolarHBondContact O-N 2.76Å; Y222-E225 PolarHBondContact O-N 3.01Å; Y222-R226 WeakPolarHBondContact O-CB 3.24Å; Y222-R226 PolarHBondContact O-N 3.34Å
223	Q	93.8	Very high	92.8	Very high	89 Å²	89	100.6 Å²	100.6	42%	0.416	48%	0.476	S	S	.	.	H	α-helix	trans	-67	-38.4	176.5	-68.3	-72.8	5.5	0	0	112.5	E219 R220 E221 Q227	E219-Q223 VanDerWaalsContact O-CG 3.24Å; E219-Q223 WeakPolarHBondContact O-CG 3.37Å; E219-Q223 PolarHBondContact O-N 3.33Å; R220-Q223 PolarHBondContact O-N 3.33Å; E221-Q223 VanDerWaalsContact C-N 3.3Å; E221-Q223 PolarHBondContact O-N 3.08Å; Q223-Q227 WeakPolarHBondContact O-CB 3.31Å; Q223-Q227 VanDerWaalsContact O-CG 3.24Å; Q223-Q227 WeakPolarHBondContact O-CG 3.4Å; Q223-Q227 PolarHBondContact O-N 2.9Å; Q223-Q227 PolarHBondContact O-NE2 2.88Å
224	Y	92.9	Very high	92.4	Very high	143 Å²	143	98.7 Å²	98.7	56%	0.561	48%	0.479	S	S	*	.	H	α-helix	trans	-65	-47.2	174.3	-76.8	-58.4	0	0	0	111.4	R220 E221 R226 Q227 L228	R220-Y224 HydrophobicContact CG-CD2 3.88Å; R220-Y224 HydrophobicContact CG-CE2 3.44Å; R220-Y224 VanDerWaalsContact CG-CE2 3.44Å; R220-Y224 WeakPolarHBondContact O-CD2 3.21Å; R220-Y224 PolarHBondContact O-N 3.04Å; E221-Y224 PolarHBondContact O-N 3.19Å; E221-Y224 VanDerWaalsContact O-N 3.12Å; Y224-R226 VanDerWaalsContact C-N 3.31Å; Y224-R226 PolarHBondContact O-N 3.36Å; Y224-Q227 PolarHBondContact O-N 3.04Å; Y224-Q227 VanDerWaalsContact O-N 3.14Å; Y224-L228 WeakPolarHBondContact O-CG 3.24Å; Y224-L228 PolarHBondContact O-N 3.46Å
225	E	93.6	Very high	91.3	Very high	92 Å²	92	103.4 Å²	103.4	43%	0.43	49%	0.493	S	S	.	.	H	α-helix	trans	-61.9	-41	178.2	-159	-158.2	-176.7	0	0	111.2	E221 Y222 Q227 L228 K229	E221-E225 PolarHBondContact O-N 3.14Å; Y222-E225 PolarHBondContact O-N 3.01Å; E225-Q227 VanDerWaalsContact C-N 3.34Å; E225-Q227 PolarHBondContact O-N 3.09Å; E225-L228 PolarHBondContact O-N 3.25Å; E225-K229 HydrophobicContact CG-CD 4.38Å; E225-K229 WeakPolarHBondContact O-CB 3.48Å; E225-K229 VanDerWaalsContact O-CG 3.31Å; E225-K229 WeakPolarHBondContact O-CG 3.35Å; E225-K229 PolarHBondContact O-N 2.83Å; E225-K229 WeakPolarHBondContact OE1-CE 3.37Å; E225-K229 IonicContact OE1-NZ 2.69Å; E225-K229 PolarHBondContact OE1-NZ 2.97Å; E225-K229 IonicContact OE2-NZ 2.85Å; E225-K229 PolarHBondContact OE2-NZ 2.92Å
226	R	93.3	Very high	90	Very high	84 Å²	84	110 Å²	110	32%	0.317	52%	0.519	S	S	.	.	H	α-helix	trans	-61.6	-40.2	174.7	-173.4	-179.9	-176.6	-137.8	5.7	112	Y222 Y224 K230	Y222-R226 WeakPolarHBondContact O-CB 3.24Å; Y222-R226 PolarHBondContact O-N 3.34Å; Y224-R226 VanDerWaalsContact C-N 3.31Å; Y224-R226 PolarHBondContact O-N 3.36Å; R226-K230 HydrophobicContact CG-CD 4.47Å; R226-K230 WeakPolarHBondContact O-CB 3.47Å; R226-K230 VanDerWaalsContact O-CG 3.26Å; R226-K230 WeakPolarHBondContact O-CG 3.48Å; R226-K230 PolarHBondContact O-N 2.97Å
227	Q	93.7	Very high	88.1	Confident	110 Å²	110	112.8 Å²	112.8	51%	0.514	55%	0.55	S	S	.	*	H	α-helix	trans	-68.8	-42.1	176.3	-74.5	171	75.2	0	0	111.9	Q223 Y224 E225 K230 S231	Q223-Q227 WeakPolarHBondContact O-CB 3.31Å; Q223-Q227 VanDerWaalsContact O-CG 3.24Å; Q223-Q227 WeakPolarHBondContact O-CG 3.4Å; Q223-Q227 PolarHBondContact O-N 2.9Å; Q223-Q227 PolarHBondContact O-NE2 2.88Å; Y224-Q227 PolarHBondContact O-N 3.04Å; Y224-Q227 VanDerWaalsContact O-N 3.14Å; E225-Q227 VanDerWaalsContact C-N 3.34Å; E225-Q227 PolarHBondContact O-N 3.09Å; Q227-K230 PolarHBondContact O-N 3.46Å; Q227-S231 WeakPolarHBondContact O-CB 3.4Å; Q227-S231 PolarHBondContact O-N 3.38Å; Q227-S231 PolarHBondContact O-OG 3.19Å
228	L	91.6	Very high	87.7	Confident	115 Å²	115	117 Å²	117	60%	0.602	57%	0.565	S	S	*	*	H	α-helix	trans	-60.4	-45.6	174.1	-71.1	172.5	0	0	0	111.3	Y224 E225 K230 S231 T232	Y224-L228 WeakPolarHBondContact O-CG 3.24Å; Y224-L228 PolarHBondContact O-N 3.46Å; E225-L228 PolarHBondContact O-N 3.25Å; L228-K230 PolarHBondContact O-N 3.12Å; L228-S231 PolarHBondContact O-N 3.32Å; L228-S231 PolarHBondContact O-OG 3.05Å; L228-T232 WeakPolarHBondContact O-CB 3.25Å; L228-T232 WeakPolarHBondContact O-CG2 3.49Å; L228-T232 PolarHBondContact O-N 3.33Å; L228-T232 PolarHBondContact O-OG1 3.49Å
229	K	90.8	Very high	87.3	Confident	114 Å²	114	120.2 Å²	120.2	50%	0.496	58%	0.575	S	S	.	*	H	α-helix	trans	-59.6	-43.5	173.9	-74.3	170.6	178.1	164.4	0	112.3	E225 T232 S233	E225-K229 HydrophobicContact CG-CD 4.38Å; E225-K229 WeakPolarHBondContact O-CB 3.48Å; E225-K229 VanDerWaalsContact O-CG 3.31Å; E225-K229 WeakPolarHBondContact O-CG 3.35Å; E225-K229 PolarHBondContact O-N 2.83Å; E225-K229 WeakPolarHBondContact OE1-CE 3.37Å; E225-K229 IonicContact OE1-NZ 2.69Å; E225-K229 PolarHBondContact OE1-NZ 2.97Å; E225-K229 IonicContact OE2-NZ 2.85Å; E225-K229 PolarHBondContact OE2-NZ 2.92Å; K229-T232 WeakPolarHBondContact CA-OG1 3.26Å; K229-T232 PolarHBondContact O-OG1 3.36Å; K229-T232 VanDerWaalsContact O-OG1 3.09Å; K229-S233 VanDerWaalsContact O-CB 3.25Å; K229-S233 WeakPolarHBondContact O-CB 3.49Å; K229-S233 PolarHBondContact O-N 2.99Å
230	K	90.9	Very high	86.8	Confident	113 Å²	113	121.7 Å²	121.7	49%	0.491	58%	0.582	S	S	.	*	H	α-helix	trans	-64	-44.8	176.5	-75.3	173	177.7	-173.8	0	112.6	R226 Q227 L228 S233 S234	R226-K230 HydrophobicContact CG-CD 4.47Å; R226-K230 WeakPolarHBondContact O-CB 3.47Å; R226-K230 VanDerWaalsContact O-CG 3.26Å; R226-K230 WeakPolarHBondContact O-CG 3.48Å; R226-K230 PolarHBondContact O-N 2.97Å; Q227-K230 PolarHBondContact O-N 3.46Å; L228-K230 PolarHBondContact O-N 3.12Å; K230-S233 PolarHBondContact O-N 3.35Å; K230-S234 PolarHBondContact O-N 3.39Å
231	S	89.4	Confident	86.3	Confident	63 Å²	63	121.5 Å²	121.5	44%	0.441	59%	0.589	S	S	.	*	H	α-helix	trans	-68	-35.5	-179.7	69.8	0	0	0	0	113.2	Q227 L228 S234	Q227-S231 WeakPolarHBondContact O-CB 3.4Å; Q227-S231 PolarHBondContact O-N 3.38Å; Q227-S231 PolarHBondContact O-OG 3.19Å; L228-S231 PolarHBondContact O-N 3.32Å; L228-S231 PolarHBondContact O-OG 3.05Å; S231-S234 PolarHBondContact O-OG 3.5Å
232	T	87	Confident	85.8	Confident	88 Å²	88	120.4 Å²	120.4	54%	0.54	59%	0.585	S	S	.	*	H	α-helix	trans	-77	-32.1	176.6	52.4	0	0	0	0	112.5	L228 K229	L228-T232 WeakPolarHBondContact O-CB 3.25Å; L228-T232 WeakPolarHBondContact O-CG2 3.49Å; L228-T232 PolarHBondContact O-N 3.33Å; L228-T232 PolarHBondContact O-OG1 3.49Å; K229-T232 WeakPolarHBondContact CA-OG1 3.26Å; K229-T232 PolarHBondContact O-OG1 3.36Å; K229-T232 VanDerWaalsContact O-OG1 3.09Å
233	S	84.8	Confident	85.2	Confident	81 Å²	81	118.9 Å²	118.9	57%	0.566	59%	0.587	S	S	*	*	H	α-helix	trans	-70.8	-33.3	176	-172.9	0	0	0	0	113.1	K229 K230 R235	K229-S233 VanDerWaalsContact O-CB 3.25Å; K229-S233 WeakPolarHBondContact O-CB 3.49Å; K229-S233 PolarHBondContact O-N 2.99Å; K230-S233 PolarHBondContact O-N 3.35Å; S233-R235 VanDerWaalsContact C-N 3.34Å
234	S	82.7	Confident	84.6	Confident	84 Å²	84	121 Å²	121	59%	0.587	60%	0.599	S	S	*	*	H	α-helix	trans	-75.2	-22.4	-179.8	74	0	0	0	0	113.5	K230 S231 K236 T237	K230-S234 PolarHBondContact O-N 3.39Å; S231-S234 PolarHBondContact O-OG 3.5Å; S234-K236 VanDerWaalsContact C-N 3.3Å; S234-T237 PolarHBondContact O-OG1 3.22Å
235	R	73.4	Confident	83.9	Confident	228 Å²	228	119.3 Å²	119.3	86%	0.86	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-9.6	177.9	-161.8	178.2	-72.8	-176.2	-2.7	113.2	S233	S233-R235 VanDerWaalsContact C-N 3.34Å
236	K	67	Low	83.1	Confident	194 Å²	194	121.6 Å²	121.6	84%	0.843	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	14.7	-174.9	-96.8	-177.9	175	-179.5	0	114.7	S234	S234-K236 VanDerWaalsContact C-N 3.3Å
237	T	52.7	Low	82.2	Confident	185 Å²	185	125 Å²	125	100%	1.135	64%	0.643	S	S	*	*			trans	-113.6	0	176.3	61.7	0	0	0	0	112	S234	S234-T237 PolarHBondContact O-OG1 3.22Å

Retrieved 237 of 237 residues in 35.4 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).