A0A044S5L3_ONCVO Loading...

C3H1-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A044S5L3, Species ONCVO (Onchocerca volvulus), Gene n/a, Length 366 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.4	Very low	38.2	Very low	237 Å²	237	168.2 Å²	168.2	100%	1.167	87%	0.872	S	S	*	*				0	74.4	0	-64.7	-168.5	148.5	0	0	107.1
2	S	38.4	Very low	37.8	Very low	108 Å²	108	160.8 Å²	160.8	76%	0.755	87%	0.868	S	S	*	*				80.3	97.1	94.7	-53.9	0	0	0	0	112.2
3	N	39.4	Very low	37.4	Very low	169 Å²	169	162 Å²	162	90%	0.904	87%	0.871	S	S	*	*				-170.2	115.7	114.6	-94.7	-22.2	0	0	0	111.9
4	L	35.2	Very low	36.9	Very low	161 Å²	161	157.4 Å²	157.4	84%	0.843	87%	0.866	S	S	*	*			trans	-67	143.1	162.6	-83.2	79.8	0	0	0	110
5	Y	40.2	Very low	37	Very low	207 Å²	207	153.3 Å²	153.3	81%	0.812	86%	0.861	S	S	*	*				-160.4	111.1	123.2	-128.8	-92.5	0	0	0	108.9
6	Q	37.5	Very low	36.8	Very low	186 Å²	186	152 Å²	152	87%	0.869	86%	0.858	S	S	*	*			trans	-130.9	123.8	177.3	-158.2	165.9	-11.1	0	0	103.9
7	Q	40.4	Very low	37.1	Very low	164 Å²	164	152.2 Å²	152.2	77%	0.766	86%	0.856	S	S	*	*			trans	-129.6	97.5	178.5	-151.1	161.5	-2.5	0	0	109.4
8	D	40.3	Very low	37.2	Very low	151 Å²	151	148.6 Å²	148.6	81%	0.807	84%	0.842	S	S	*	*			trans	9.2	133.5	156.3	-63.5	-34.3	0	0	0	122.9
9	Q	34.4	Very low	37.7	Very low	192 Å²	192	149.1 Å²	149.1	90%	0.897	84%	0.842	S	S	*	*			trans	-76.2	142.5	149.4	-64	173.3	3.8	0	0	109.9
10	A	41.6	Very low	37.7	Very low	103 Å²	103	153.4 Å²	153.4	85%	0.851	84%	0.844	S	S	*	*			trans	-150.7	116.5	153.8	0	0	0	0	0	111.1
11	N	33.3	Very low	38	Very low	172 Å²	172	153.2 Å²	153.2	92%	0.92	84%	0.843	S	S	*	*			trans	-68.3	145.9	165.1	-73.3	-36.5	0	0	0	110.5
12	G	34.3	Very low	38.2	Very low	80 Å²	80	148.4 Å²	148.4	83%	0.825	82%	0.82	S	S	*	*			trans	-158.1	93.4	171.5	0	0	0	0	0	112.1
13	I	32	Very low	38.3	Very low	176 Å²	176	152.6 Å²	152.6	90%	0.903	83%	0.825	S	S	*	*			trans	-84.3	128.3	164.9	-62.3	168.3	0	0	0	107
14	A	31	Very low	38.6	Very low	97 Å²	97	153.9 Å²	153.9	80%	0.802	82%	0.819	S	S	*	*			trans	157.6	158.3	141.1	0	0	0	0	0	112.8
15	A	37.9	Very low	39.1	Very low	96 Å²	96	152.3 Å²	152.3	79%	0.793	82%	0.818	S	S	*	*			trans	97.9	89.8	160.1	0	0	0	0	0	117.7
16	V	33.4	Very low	38.9	Very low	133 Å²	133	152.1 Å²	152.1	81%	0.806	82%	0.822	S	S	*	*			trans	-42.4	135.5	149.1	177.7	0	0	0	0	110.8
17	N	42.1	Very low	39.4	Very low	156 Å²	156	151.5 Å²	151.5	83%	0.834	82%	0.823	S	S	*	*			trans	-136.4	119.2	149.7	-91.2	-24.6	0	0	0	110
18	S	38.8	Very low	39.3	Very low	86 Å²	86	147.3 Å²	147.3	60%	0.601	82%	0.824	S	S	*	*			trans	-47.6	127.9	158.3	43	0	0	0	0	110.8
19	D	46.1	Very low	39	Very low	158 Å²	158	143.9 Å²	143.9	85%	0.845	82%	0.824	S	S	*	*				-174.9	118.3	123.1	-83.9	-22.7	0	0	0	111.1
20	R	39.3	Very low	39.4	Very low	235 Å²	235	142 Å²	142	89%	0.887	82%	0.819	S	S	*	*			trans	-69.6	129.6	172.2	-63.8	167.1	173.1	168.2	-2.4	107.8
21	N	42.7	Very low	39	Very low	151 Å²	151	149 Å²	149	81%	0.807	82%	0.823	S	S	*	*			trans	-165.6	107.9	140.6	-93.2	-24.2	0	0	0	111.4
22	I	43.5	Very low	39.6	Very low	136 Å²	136	145.9 Å²	145.9	70%	0.697	81%	0.811	S	S	*	*			trans	-102.3	116.8	170.6	-59.4	171.2	0	0	0	106.9	Y24	I22-Y24 HydrophobicContact CB-CE2 4.42Å; I22-Y24 HydrophobicContact CG2-CD2 3.51Å; I22-Y24 HydrophobicContact CG2-CE2 3.18Å; I22-Y24 HydrophobicContact CG2-CG 4.35Å
23	F	42	Very low	40.1	Very low	196 Å²	196	149 Å²	149	86%	0.86	81%	0.814	S	S	*	*			trans	-85.8	119.8	167.8	-89.1	-92.7	0	0	0	109.3
24	Y	44.5	Very low	41	Very low	196 Å²	196	145.4 Å²	145.4	77%	0.769	80%	0.8	S	S	*	*			trans	-118.8	136.6	162.8	-75.4	-69.8	0	0	0	109.7	I22	I22-Y24 HydrophobicContact CB-CE2 4.42Å; I22-Y24 HydrophobicContact CG2-CD2 3.51Å; I22-Y24 HydrophobicContact CG2-CE2 3.18Å; I22-Y24 HydrophobicContact CG2-CG 4.35Å
25	P	46.7	Very low	41.8	Very low	127 Å²	127	145.4 Å²	145.4	83%	0.825	79%	0.792	S	S	*	*			trans	-75.4	133	174	30.9	-29.9	0	0	0	110.2
26	K	36.2	Very low	42.7	Very low	204 Å²	204	145.3 Å²	145.3	89%	0.887	78%	0.782	S	S	*	*			trans	-85.1	109.7	-176.2	-171.1	-179.1	-170.7	179.9	0	109.4
27	L	46.4	Very low	43.8	Very low	173 Å²	173	144 Å²	144	91%	0.906	77%	0.774	S	S	*	*			trans	-140.2	114.9	161.8	-78.3	177.8	0	0	0	111.8
28	G	38.4	Very low	44.3	Very low	76 Å²	76	142.7 Å²	142.7	78%	0.784	77%	0.766	S	S	*	*			trans	58.9	101.4	132	0	0	0	0	0	117.9
29	G	35.4	Very low	45.1	Very low	79 Å²	79	144.5 Å²	144.5	81%	0.814	77%	0.768	S	S	*	*			trans	-66	144.9	-179.1	0	0	0	0	0	115.2
30	I	42	Very low	45.7	Very low	153 Å²	153	142.6 Å²	142.6	79%	0.785	76%	0.757	S	S	*	*			trans	-138.5	121.7	148	-54.4	178.9	0	0	0	105.7	T32	I30-T32 PolarHBondContact O-N 3.42Å
31	R	34	Very low	46.7	Very low	249 Å²	249	140.6 Å²	140.6	94%	0.94	75%	0.75	S	S	*	*			trans	-73.8	112.1	175.8	-71.8	176.9	166	-157.7	-3.3	108.4
32	T	45.8	Very low	47.9	Very low	107 Å²	107	136 Å²	136	66%	0.656	73%	0.729	S	S	*	*			trans	-133.5	106.4	164.6	43.1	0	0	0	0	109.6	I30 T34	I30-T32 PolarHBondContact O-N 3.42Å; T32-T34 PolarHBondContact O-N 3.24Å; T32-T34 VanDerWaalsContact O-N 3.13Å
33	T	43.7	Very low	49.3	Very low	146 Å²	146	132.7 Å²	132.7	90%	0.896	72%	0.716	S	S	*	*			trans	-65.4	102.1	172.6	47.1	0	0	0	0	109.4
34	T	51.8	Low	50.8	Low	100 Å²	100	126.1 Å²	126.1	61%	0.613	70%	0.697	S	S	*	*			trans	-143.5	152.9	173.8	45.7	0	0	0	0	110.9	T32 T36	T32-T34 PolarHBondContact O-N 3.24Å; T32-T34 VanDerWaalsContact O-N 3.13Å; T34-T36 PolarHBondContact O-N 3.17Å; T34-T36 PolarHBondContact O-OG1 3.24Å
35	P	48.1	Very low	52.2	Low	97 Å²	97	121.6 Å²	121.6	63%	0.63	69%	0.686	S	S	*	*			trans	-84.3	78.1	-159.1	34.8	-34.2	0	0	0	111.9	T37	P35-T37 PolarHBondContact O-N 2.99Å
36	T	56.1	Low	53.7	Low	94 Å²	94	120 Å²	120	58%	0.577	67%	0.67	S	S	*	*	H	α-helix	trans	-65.1	-22	-179.4	-35.6	0	0	0	0	113.2	T34 I38 L39 L40	T34-T36 PolarHBondContact O-N 3.17Å; T34-T36 PolarHBondContact O-OG1 3.24Å; T36-I38 VanDerWaalsContact C-N 3.34Å; T36-I38 PolarHBondContact O-N 3.32Å; T36-L39 PolarHBondContact O-N 3.49Å; T36-L40 HydrophobicContact CG2-CD1 4.39Å; T36-L40 PolarHBondContact O-N 2.91Å
37	T	55.5	Low	56	Low	106 Å²	106	115.2 Å²	115.2	65%	0.65	65%	0.654	S	S	*	*	H	α-helix	trans	-69.2	-27.4	-174.7	-35.9	0	0	0	0	113.7	P35	P35-T37 PolarHBondContact O-N 2.99Å
38	I	54.2	Low	57.9	Low	128 Å²	128	111.9 Å²	111.9	66%	0.656	63%	0.634	S	S	*	*	H	α-helix	trans	-77.4	-35.6	179.8	-60	176.4	0	0	0	110.7	T36 R41 S42	T36-I38 VanDerWaalsContact C-N 3.34Å; T36-I38 PolarHBondContact O-N 3.32Å; I38-R41 PolarHBondContact O-N 3.45Å; I38-S42 PolarHBondContact O-N 3.05Å
39	L	55.2	Low	60.2	Low	124 Å²	124	115.7 Å²	115.7	65%	0.649	63%	0.629	S	S	*	*	H	α-helix	trans	-70.4	-34.9	-179.8	-148.6	86.9	0	0	0	112.3	T36 R41 S42 T43	T36-L39 PolarHBondContact O-N 3.49Å; L39-R41 PolarHBondContact O-N 3.36Å; L39-S42 PolarHBondContact O-N 3.03Å; L39-S42 PolarHBondContact O-OG 2.94Å; L39-T43 WeakPolarHBondContact O-CG2 3.43Å; L39-T43 PolarHBondContact O-N 3.38Å; L39-T43 PolarHBondContact O-OG1 3.3Å
40	L	58.3	Low	62.7	Low	118 Å²	118	116.8 Å²	116.8	62%	0.618	62%	0.615	S	S	*	*	H	α-helix	trans	-68.1	-32.5	177.7	-110.7	82.1	0	0	0	113.3	T36 T43 A44	T36-L40 HydrophobicContact CG2-CD1 4.39Å; T36-L40 PolarHBondContact O-N 2.91Å; L40-T43 PolarHBondContact O-OG1 2.98Å; L40-A44 PolarHBondContact O-N 3.05Å
41	R	61	Low	64.8	Low	192 Å²	192	112.9 Å²	112.9	73%	0.725	60%	0.601	S	S	*	*	H	α-helix	trans	-74.8	-33.6	178.8	-75.4	-174.1	175.7	-169.8	-0.4	112.2	I38 L39 L45	I38-R41 PolarHBondContact O-N 3.45Å; L39-R41 PolarHBondContact O-N 3.36Å; R41-L45 PolarHBondContact O-N 3.31Å
42	S	66.7	Low	67.4	Low	54 Å²	54	106.9 Å²	106.9	38%	0.378	58%	0.582	S	S	.	*	H	α-helix	trans	-70.8	-39.2	178	63.8	0	0	0	0	111.8	I38 L39 L45 I46	I38-S42 PolarHBondContact O-N 3.05Å; L39-S42 PolarHBondContact O-N 3.03Å; L39-S42 PolarHBondContact O-OG 2.94Å; S42-L45 PolarHBondContact O-N 3.35Å; S42-I46 WeakPolarHBondContact O-CD1 3.49Å; S42-I46 VanDerWaalsContact O-CG1 3.28Å; S42-I46 WeakPolarHBondContact O-CG1 3.46Å; S42-I46 PolarHBondContact O-N 3.3Å; S42-I46 VanDerWaalsContact O-N 3.15Å
43	T	73.8	Confident	69.5	Low	67 Å²	67	109.6 Å²	109.6	41%	0.411	58%	0.581	S	S	.	*	H	α-helix	trans	-65.7	-43.7	175.3	55.6	0	0	0	0	111.9	L39 L40 L45 I46 D47	L39-T43 WeakPolarHBondContact O-CG2 3.43Å; L39-T43 PolarHBondContact O-N 3.38Å; L39-T43 PolarHBondContact O-OG1 3.3Å; L40-T43 PolarHBondContact O-OG1 2.98Å; T43-L45 VanDerWaalsContact C-N 3.32Å; T43-L45 PolarHBondContact O-N 3.03Å; T43-I46 WeakPolarHBondContact O-CB 3.44Å; T43-I46 PolarHBondContact O-N 3.41Å; T43-I46 VanDerWaalsContact O-N 3.09Å; T43-D47 PolarHBondContact O-N 3.26Å
44	A	73	Confident	71.6	Confident	58 Å²	58	107.6 Å²	107.6	48%	0.479	56%	0.561	S	S	.	*	H	α-helix	trans	-60.8	-37.1	177.1	0	0	0	0	0	113.4	L40 Q48	L40-A44 PolarHBondContact O-N 3.05Å; A44-Q48 PolarHBondContact O-N 3.37Å; A44-Q48 VanDerWaalsContact O-N 3.07Å
45	L	74	Confident	73.3	Confident	101 Å²	101	106.5 Å²	106.5	53%	0.529	55%	0.551	S	S	.	*	H	α-helix	trans	-69.1	-34.6	174.7	-81.2	167.8	0	0	0	112.6	R41 S42 T43 K49	R41-L45 PolarHBondContact O-N 3.31Å; S42-L45 PolarHBondContact O-N 3.35Å; T43-L45 VanDerWaalsContact C-N 3.32Å; T43-L45 PolarHBondContact O-N 3.03Å; L45-K49 WeakPolarHBondContact O-CG 3.42Å; L45-K49 PolarHBondContact O-N 3.03Å
46	I	78.7	Confident	75.3	Confident	95 Å²	95	107.4 Å²	107.4	49%	0.487	55%	0.551	S	S	.	*	H	α-helix	trans	-66.4	-46.8	174.8	-68.1	163.7	0	0	0	109.6	S42 T43 Q48 K49 L50	S42-I46 WeakPolarHBondContact O-CD1 3.49Å; S42-I46 VanDerWaalsContact O-CG1 3.28Å; S42-I46 WeakPolarHBondContact O-CG1 3.46Å; S42-I46 PolarHBondContact O-N 3.3Å; S42-I46 VanDerWaalsContact O-N 3.15Å; T43-I46 WeakPolarHBondContact O-CB 3.44Å; T43-I46 PolarHBondContact O-N 3.41Å; T43-I46 VanDerWaalsContact O-N 3.09Å; I46-Q48 VanDerWaalsContact C-N 3.32Å; I46-Q48 PolarHBondContact O-N 3.24Å; I46-K49 PolarHBondContact O-N 2.72Å; I46-K49 VanDerWaalsContact O-N 3.12Å; I46-L50 HydrophobicContact CG2-CD1 3.88Å; I46-L50 HydrophobicContact CG2-CG 4.29Å; I46-L50 WeakPolarHBondContact O-CG 3.45Å; I46-L50 PolarHBondContact O-N 3.44Å
47	D	83.3	Confident	77	Confident	103 Å²	103	107.7 Å²	107.7	55%	0.551	54%	0.544	S	S	*	.	H	α-helix	trans	-61.7	-39	178.8	-69.2	-20.7	0	0	0	112.1	T43 K49 L50 C51	T43-D47 PolarHBondContact O-N 3.26Å; D47-K49 PolarHBondContact O-N 3.1Å; D47-L50 PolarHBondContact O-N 3.02Å; D47-C51 WeakPolarHBondContact O-CB 3.34Å; D47-C51 PolarHBondContact O-N 3.38Å
48	Q	86.3	Confident	78.6	Confident	103 Å²	103	108.2 Å²	108.2	48%	0.481	54%	0.537	S	S	.	.	H	α-helix	trans	-62.8	-42.3	174.8	-166.8	-172.1	31.6	0	0	112.1	A44 I46 K52	A44-Q48 PolarHBondContact O-N 3.37Å; A44-Q48 VanDerWaalsContact O-N 3.07Å; I46-Q48 VanDerWaalsContact C-N 3.32Å; I46-Q48 PolarHBondContact O-N 3.24Å; Q48-K52 WeakPolarHBondContact O-CG 3.33Å; Q48-K52 PolarHBondContact O-N 2.93Å; Q48-K52 VanDerWaalsContact O-N 3.1Å
49	K	87.5	Confident	80.4	Confident	155 Å²	155	107.3 Å²	107.3	67%	0.674	53%	0.533	S	S	*	.	H	α-helix	trans	-67.2	-41.2	177.4	-75	-179	178.4	-177.9	0	111.7	L45 I46 D47 K52 Y53	L45-K49 WeakPolarHBondContact O-CG 3.42Å; L45-K49 PolarHBondContact O-N 3.03Å; I46-K49 PolarHBondContact O-N 2.72Å; I46-K49 VanDerWaalsContact O-N 3.12Å; D47-K49 PolarHBondContact O-N 3.1Å; K49-K52 PolarHBondContact O-N 3.32Å; K49-Y53 WeakPolarHBondContact O-CB 3.5Å; K49-Y53 PolarHBondContact O-N 3.4Å
50	L	88.4	Confident	82.1	Confident	103 Å²	103	103.8 Å²	103.8	54%	0.539	52%	0.522	S	S	.	.	H	α-helix	trans	-63.5	-42.1	176.8	-70.2	174.4	0	0	0	111.7	I46 D47 Y53 H54	I46-L50 HydrophobicContact CG2-CD1 3.88Å; I46-L50 HydrophobicContact CG2-CG 4.29Å; I46-L50 WeakPolarHBondContact O-CG 3.45Å; I46-L50 PolarHBondContact O-N 3.44Å; D47-L50 PolarHBondContact O-N 3.02Å; L50-Y53 PolarHBondContact O-N 3.22Å; L50-H54 WeakPolarHBondContact O-CB 3.36Å; L50-H54 PolarHBondContact O-N 3.5Å
51	C	85.6	Confident	83.7	Confident	71 Å²	71	100.9 Å²	100.9	48%	0.48	51%	0.507	S	S	.	.	H	α-helix	trans	-62.9	-45.5	176	-175.2	0	0	0	0	112	D47 Y53 H54 N55	D47-C51 WeakPolarHBondContact O-CB 3.34Å; D47-C51 PolarHBondContact O-N 3.38Å; C51-Y53 VanDerWaalsContact C-N 3.35Å; C51-Y53 PolarHBondContact O-N 3.02Å; C51-H54 PolarHBondContact O-N 2.91Å; C51-N55 PolarHBondContact O-N 3.44Å; C51-N55 PolarHBondContact O-ND2 3.21Å
52	K	88.7	Confident	85.1	Confident	123 Å²	123	94.4 Å²	94.4	54%	0.535	49%	0.491	S	S	.	.	H	α-helix	trans	-58.9	-44.4	174.8	-74	176.8	179.6	180	0	111.9	Q48 K49 N55 L56	Q48-K52 WeakPolarHBondContact O-CG 3.33Å; Q48-K52 PolarHBondContact O-N 2.93Å; Q48-K52 VanDerWaalsContact O-N 3.1Å; K49-K52 PolarHBondContact O-N 3.32Å; K52-N55 PolarHBondContact O-N 3.23Å; K52-L56 WeakPolarHBondContact O-CG 3.48Å; K52-L56 PolarHBondContact O-N 3.37Å
53	Y	89.3	Confident	86.3	Confident	163 Å²	163	97.2 Å²	97.2	64%	0.639	50%	0.502	S	S	*	.	H	α-helix	trans	-62	-45.1	177.1	176.9	-97.4	0	0	0	112.3	K49 L50 C51 N55 L56 K57	K49-Y53 WeakPolarHBondContact O-CB 3.5Å; K49-Y53 PolarHBondContact O-N 3.4Å; L50-Y53 PolarHBondContact O-N 3.22Å; C51-Y53 VanDerWaalsContact C-N 3.35Å; C51-Y53 PolarHBondContact O-N 3.02Å; Y53-N55 VanDerWaalsContact C-N 3.34Å; Y53-N55 PolarHBondContact O-N 3.44Å; Y53-L56 PolarHBondContact O-N 3.47Å; Y53-K57 WeakPolarHBondContact O-CB 3.46Å; Y53-K57 PolarHBondContact O-N 3.35Å
54	H	87.9	Confident	87.2	Confident	104 Å²	104	99.3 Å²	99.3	48%	0.481	51%	0.507	S	S	.	.	H	α-helix	trans	-63.4	-39.6	178.6	-174.2	-116.7	0	0	0	112.2	L50 C51 K57 K58	L50-H54 WeakPolarHBondContact O-CB 3.36Å; L50-H54 PolarHBondContact O-N 3.5Å; C51-H54 PolarHBondContact O-N 2.91Å; H54-K57 PolarHBondContact O-N 3.45Å; H54-K58 WeakPolarHBondContact CE1-CE 3.46Å; H54-K58 PolarHBondContact CE1-NZ 3.03Å; H54-K58 WeakPolarHBondContact O-CG 3.45Å; H54-K58 PolarHBondContact O-N 3.09Å
55	N	87.5	Confident	88.1	Confident	77 Å²	77	102.8 Å²	102.8	41%	0.412	51%	0.513	S	S	.	.	H	α-helix	trans	-65.9	-42.7	174.7	-69.5	-28.2	0	0	0	112.2	C51 K52 Y53 K57 K58 N59	C51-N55 PolarHBondContact O-N 3.44Å; C51-N55 PolarHBondContact O-ND2 3.21Å; K52-N55 PolarHBondContact O-N 3.23Å; Y53-N55 VanDerWaalsContact C-N 3.34Å; Y53-N55 PolarHBondContact O-N 3.44Å; N55-K57 VanDerWaalsContact C-N 3.32Å; N55-K57 PolarHBondContact O-N 2.73Å; N55-K58 PolarHBondContact O-N 3.29Å; N55-N59 VanDerWaalsContact O-CG 3.24Å; N55-N59 PolarHBondContact O-N 2.77Å; N55-N59 PolarHBondContact O-OD1 2.99Å
56	L	90.2	Very high	89.1	Confident	117 Å²	117	102.4 Å²	102.4	61%	0.613	51%	0.512	S	S	*	.	H	α-helix	trans	-61.5	-40.7	174.5	-74.5	169.4	0	0	0	112	K52 Y53 N59 A60	K52-L56 WeakPolarHBondContact O-CG 3.48Å; K52-L56 PolarHBondContact O-N 3.37Å; Y53-L56 PolarHBondContact O-N 3.47Å; L56-N59 PolarHBondContact O-N 2.64Å; L56-A60 WeakPolarHBondContact O-CB 3.41Å; L56-A60 PolarHBondContact O-N 3Å
57	K	90.8	Very high	89.8	Confident	100 Å²	100	100.5 Å²	100.5	44%	0.435	51%	0.505	S	S	.	.	H	α-helix	trans	-64.5	-44.3	177.1	-177	54.2	177.5	153	0	111.6	Y53 H54 N55 N59 A60 D61	Y53-K57 WeakPolarHBondContact O-CB 3.46Å; Y53-K57 PolarHBondContact O-N 3.35Å; H54-K57 PolarHBondContact O-N 3.45Å; N55-K57 VanDerWaalsContact C-N 3.32Å; N55-K57 PolarHBondContact O-N 2.73Å; K57-N59 VanDerWaalsContact C-N 3.33Å; K57-N59 PolarHBondContact O-N 3.33Å; K57-A60 PolarHBondContact O-N 3.38Å; K57-D61 WeakPolarHBondContact CE-OD1 3.46Å; K57-D61 IonicContact NZ-OD1 2.81Å; K57-D61 PolarHBondContact NZ-OD1 2.96Å; K57-D61 IonicContact NZ-OD2 2.69Å; K57-D61 VanDerWaalsContact O-CG 3.23Å; K57-D61 PolarHBondContact O-N 2.94Å
58	K	90.1	Very high	90.3	Very high	116 Å²	116	100.6 Å²	100.6	50%	0.504	50%	0.502	S	S	.	.	H	α-helix	trans	-58.3	-42.9	173	-76.1	-178.6	173	179.2	0	112.5	H54 N55 D61 S62	H54-K58 WeakPolarHBondContact CE1-CE 3.46Å; H54-K58 PolarHBondContact CE1-NZ 3.03Å; H54-K58 WeakPolarHBondContact O-CG 3.45Å; H54-K58 PolarHBondContact O-N 3.09Å; N55-K58 PolarHBondContact O-N 3.29Å; K58-D61 PolarHBondContact O-N 3.32Å; K58-S62 WeakPolarHBondContact O-CB 3.45Å; K58-S62 PolarHBondContact O-N 3Å
59	N	91.1	Very high	90.6	Very high	109 Å²	109	97.9 Å²	97.9	58%	0.583	50%	0.497	S	S	*	.	H	α-helix	trans	-66.3	-39	177.8	-68.1	-10.8	0	0	0	111.8	N55 L56 K57 S62 L63	N55-N59 VanDerWaalsContact O-CG 3.24Å; N55-N59 PolarHBondContact O-N 2.77Å; N55-N59 PolarHBondContact O-OD1 2.99Å; L56-N59 PolarHBondContact O-N 2.64Å; K57-N59 VanDerWaalsContact C-N 3.33Å; K57-N59 PolarHBondContact O-N 3.33Å; N59-S62 PolarHBondContact O-N 3.29Å; N59-L63 WeakPolarHBondContact O-CB 3.47Å; N59-L63 PolarHBondContact O-N 3.41Å
60	A	91.9	Very high	91	Very high	50 Å²	50	96.1 Å²	96.1	41%	0.413	49%	0.494	S	S	.	.	H	α-helix	trans	-64.4	-44.7	175.9	0	0	0	0	0	112	L56 K57 S62 L63 E64	L56-A60 WeakPolarHBondContact O-CB 3.41Å; L56-A60 PolarHBondContact O-N 3Å; K57-A60 PolarHBondContact O-N 3.38Å; A60-S62 VanDerWaalsContact C-N 3.35Å; A60-L63 PolarHBondContact O-N 3.06Å; A60-E64 PolarHBondContact O-N 3.47Å
61	D	91.9	Very high	91.4	Very high	57 Å²	57	98 Å²	98	31%	0.305	50%	0.498	S	S	.	.	H	α-helix	trans	-66.8	-37.8	178.4	-61.9	-18.6	0	0	0	111	K57 K58 E64 Q65	K57-D61 WeakPolarHBondContact CE-OD1 3.46Å; K57-D61 IonicContact NZ-OD1 2.81Å; K57-D61 PolarHBondContact NZ-OD1 2.96Å; K57-D61 IonicContact NZ-OD2 2.69Å; K57-D61 VanDerWaalsContact O-CG 3.23Å; K57-D61 PolarHBondContact O-N 2.94Å; K58-D61 PolarHBondContact O-N 3.32Å; D61-E64 PolarHBondContact O-N 3.04Å; D61-Q65 WeakPolarHBondContact O-CG 3.42Å; D61-Q65 PolarHBondContact O-N 3.37Å; D61-Q65 VanDerWaalsContact O-N 3.08Å
62	S	90.2	Very high	91.8	Very high	56 Å²	56	100.1 Å²	100.1	39%	0.392	50%	0.504	S	S	.	.	H	α-helix	trans	-65.6	-39.3	173.4	-177.1	0	0	0	0	112.5	K58 N59 A60 N66	K58-S62 WeakPolarHBondContact O-CB 3.45Å; K58-S62 PolarHBondContact O-N 3Å; N59-S62 PolarHBondContact O-N 3.29Å; A60-S62 VanDerWaalsContact C-N 3.35Å; S62-N66 VanDerWaalsContact O-CG 3.26Å; S62-N66 PolarHBondContact O-N 3.33Å; S62-N66 PolarHBondContact O-ND2 3.27Å
63	L	92.8	Very high	92.1	Very high	113 Å²	113	100.6 Å²	100.6	59%	0.592	51%	0.506	S	S	*	.	H	α-helix	trans	-65	-43.9	175.1	-179	62.2	0	0	0	111.2	N59 A60 Q65 N66 T67	N59-L63 WeakPolarHBondContact O-CB 3.47Å; N59-L63 PolarHBondContact O-N 3.41Å; A60-L63 PolarHBondContact O-N 3.06Å; L63-Q65 PolarHBondContact O-N 3.5Å; L63-N66 PolarHBondContact O-N 3.01Å; L63-T67 HydrophobicContact CD1-CG2 4.44Å; L63-T67 WeakPolarHBondContact O-CG2 3.38Å; L63-T67 PolarHBondContact O-N 2.98Å
64	E	92.5	Very high	92.4	Very high	112 Å²	112	95.2 Å²	95.2	52%	0.523	50%	0.495	S	S	.	.	H	α-helix	trans	-58.3	-49.3	177.2	-171.3	165.6	-162.5	0	0	111	A60 D61 N66 T67 E68	A60-E64 PolarHBondContact O-N 3.47Å; D61-E64 PolarHBondContact O-N 3.04Å; E64-N66 VanDerWaalsContact C-N 3.34Å; E64-N66 PolarHBondContact O-N 3.5Å; E64-T67 PolarHBondContact O-N 3.46Å; E64-T67 VanDerWaalsContact O-N 3.1Å; E64-T67 PolarHBondContact O-OG1 2.93Å; E64-E68 WeakPolarHBondContact O-CG 3.35Å; E64-E68 PolarHBondContact O-N 3.38Å
65	Q	92.4	Very high	92.7	Very high	131 Å²	131	96.6 Å²	96.6	61%	0.612	50%	0.502	S	S	*	.	H	α-helix	trans	-57.3	-42.9	175.1	-72.3	176.5	-1.7	0	0	112.9	D61 L63 T67 E68 A69	D61-Q65 WeakPolarHBondContact O-CG 3.42Å; D61-Q65 PolarHBondContact O-N 3.37Å; D61-Q65 VanDerWaalsContact O-N 3.08Å; L63-Q65 PolarHBondContact O-N 3.5Å; Q65-T67 VanDerWaalsContact C-N 3.35Å; Q65-T67 PolarHBondContact O-N 3.34Å; Q65-E68 PolarHBondContact O-N 3.07Å; Q65-A69 WeakPolarHBondContact O-CB 3.38Å; Q65-A69 PolarHBondContact O-N 3.01Å
66	N	93	Very high	92.9	Very high	92 Å²	92	98.6 Å²	98.6	49%	0.492	51%	0.509	S	S	.	.	H	α-helix	trans	-64.8	-38.3	177.1	-73.1	-26.9	0	0	0	112	S62 L63 E64 A69 L70	S62-N66 VanDerWaalsContact O-CG 3.26Å; S62-N66 PolarHBondContact O-N 3.33Å; S62-N66 PolarHBondContact O-ND2 3.27Å; L63-N66 PolarHBondContact O-N 3.01Å; E64-N66 VanDerWaalsContact C-N 3.34Å; E64-N66 PolarHBondContact O-N 3.5Å; N66-A69 PolarHBondContact O-N 3.21Å; N66-L70 WeakPolarHBondContact O-CG 3.17Å; N66-L70 PolarHBondContact O-N 3.01Å
67	T	94.1	Very high	93	Very high	56 Å²	56	98.2 Å²	98.2	34%	0.344	51%	0.506	S	S	.	.	H	α-helix	trans	-68.6	-36.7	176.8	65.9	0	0	0	0	112.5	L63 E64 Q65 L70 K71	L63-T67 HydrophobicContact CD1-CG2 4.44Å; L63-T67 WeakPolarHBondContact O-CG2 3.38Å; L63-T67 PolarHBondContact O-N 2.98Å; E64-T67 PolarHBondContact O-N 3.46Å; E64-T67 VanDerWaalsContact O-N 3.1Å; E64-T67 PolarHBondContact O-OG1 2.93Å; Q65-T67 VanDerWaalsContact C-N 3.35Å; Q65-T67 PolarHBondContact O-N 3.34Å; T67-L70 PolarHBondContact O-N 3.45Å; T67-K71 WeakPolarHBondContact O-CG 3.5Å; T67-K71 PolarHBondContact O-N 3.48Å
68	E	93.5	Very high	93.1	Very high	105 Å²	105	98.9 Å²	98.9	49%	0.491	51%	0.514	S	S	.	.	H	α-helix	trans	-67.2	-42.9	175.1	-69.4	-176.4	161.5	0	0	111.4	E64 Q65 L70 K71 L72	E64-E68 WeakPolarHBondContact O-CG 3.35Å; E64-E68 PolarHBondContact O-N 3.38Å; Q65-E68 PolarHBondContact O-N 3.07Å; E68-L70 VanDerWaalsContact C-N 3.33Å; E68-L70 PolarHBondContact O-N 3.47Å; E68-K71 PolarHBondContact O-N 3.1Å; E68-L72 PolarHBondContact O-N 2.94Å
69	A	93.7	Very high	93.1	Very high	46 Å²	46	100.6 Å²	100.6	38%	0.38	52%	0.518	S	S	.	.	H	α-helix	trans	-61.1	-40.1	174.5	0	0	0	0	0	112.3	Q65 N66 L72 K73	Q65-A69 WeakPolarHBondContact O-CB 3.38Å; Q65-A69 PolarHBondContact O-N 3.01Å; N66-A69 PolarHBondContact O-N 3.21Å; A69-L72 PolarHBondContact O-N 3.42Å; A69-K73 WeakPolarHBondContact O-CG 3.32Å; A69-K73 PolarHBondContact O-N 3.35Å
70	L	95.6	Very high	93.1	Very high	118 Å²	118	97.7 Å²	97.7	62%	0.618	50%	0.503	S	S	*	.	H	α-helix	trans	-65.4	-40.5	174.6	-78.4	170.9	0	0	0	112.4	N66 T67 E68 K73 A74	N66-L70 WeakPolarHBondContact O-CG 3.17Å; N66-L70 PolarHBondContact O-N 3.01Å; T67-L70 PolarHBondContact O-N 3.45Å; E68-L70 VanDerWaalsContact C-N 3.33Å; E68-L70 PolarHBondContact O-N 3.47Å; L70-K73 PolarHBondContact O-N 3.23Å; L70-A74 WeakPolarHBondContact O-CB 3.42Å; L70-A74 PolarHBondContact O-N 3.05Å
71	K	96.3	Very high	92.9	Very high	142 Å²	142	99.3 Å²	99.3	62%	0.617	51%	0.507	S	S	*	.	H	α-helix	trans	-61.5	-43.7	175.5	-75.2	171.4	-176.8	171	0	111.8	T67 E68 A74 Q75	T67-K71 WeakPolarHBondContact O-CG 3.5Å; T67-K71 PolarHBondContact O-N 3.48Å; E68-K71 PolarHBondContact O-N 3.1Å; K71-A74 PolarHBondContact O-N 3.22Å; K71-Q75 WeakPolarHBondContact O-CB 3.33Å; K71-Q75 PolarHBondContact O-N 3.43Å
72	L	94.8	Very high	92.6	Very high	115 Å²	115	101.4 Å²	101.4	60%	0.602	52%	0.518	S	S	*	.	H	α-helix	trans	-63.6	-44.2	177.1	-70.5	174.3	0	0	0	111.8	E68 A69 A74 Q75 E76	E68-L72 PolarHBondContact O-N 2.94Å; A69-L72 PolarHBondContact O-N 3.42Å; L72-A74 PolarHBondContact O-N 3.46Å; L72-Q75 PolarHBondContact O-N 3.43Å; L72-E76 PolarHBondContact O-N 3.45Å
73	K	95.2	Very high	92.3	Very high	134 Å²	134	104.8 Å²	104.8	58%	0.583	52%	0.523	S	S	*	.	H	α-helix	trans	-60.9	-42.2	174.6	-74.9	-177.2	178.8	-178.9	0	112.4	A69 L70 Q75 E76 I77	A69-K73 WeakPolarHBondContact O-CG 3.32Å; A69-K73 PolarHBondContact O-N 3.35Å; L70-K73 PolarHBondContact O-N 3.23Å; K73-Q75 VanDerWaalsContact C-N 3.35Å; K73-Q75 PolarHBondContact O-N 3.33Å; K73-E76 PolarHBondContact O-N 3.28Å; K73-I77 WeakPolarHBondContact O-CG1 3.49Å; K73-I77 PolarHBondContact O-N 3.09Å
74	A	93.9	Very high	91.7	Very high	50 Å²	50	106.7 Å²	106.7	41%	0.413	53%	0.526	S	S	.	.	H	α-helix	trans	-63.7	-40.5	177	0	0	0	0	0	111.9	L70 K71 L72 E76 I77 L78	L70-A74 WeakPolarHBondContact O-CB 3.42Å; L70-A74 PolarHBondContact O-N 3.05Å; K71-A74 PolarHBondContact O-N 3.22Å; L72-A74 PolarHBondContact O-N 3.46Å; A74-E76 VanDerWaalsContact C-N 3.35Å; A74-E76 PolarHBondContact O-N 2.91Å; A74-I77 PolarHBondContact O-N 3.4Å; A74-L78 WeakPolarHBondContact O-CG 3.37Å; A74-L78 PolarHBondContact O-N 3.44Å
75	Q	94.2	Very high	91	Very high	132 Å²	132	103.7 Å²	103.7	62%	0.617	52%	0.521	S	S	*	.	H	α-helix	trans	-63.1	-40.4	175.9	-171.8	175	5.6	0	0	111.9	K71 L72 K73 L78 Y79	K71-Q75 WeakPolarHBondContact O-CB 3.33Å; K71-Q75 PolarHBondContact O-N 3.43Å; L72-Q75 PolarHBondContact O-N 3.43Å; K73-Q75 VanDerWaalsContact C-N 3.35Å; K73-Q75 PolarHBondContact O-N 3.33Å; Q75-L78 PolarHBondContact O-N 3.32Å; Q75-Y79 PolarHBondContact O-N 3.28Å
76	E	93.5	Very high	90	Very high	120 Å²	120	104 Å²	104	56%	0.561	52%	0.522	S	S	*	.	H	α-helix	trans	-64.6	-42.9	176	-171.5	-177.4	179.7	0	0	112.3	L72 K73 A74 L78 Y79 N80	L72-E76 PolarHBondContact O-N 3.45Å; K73-E76 PolarHBondContact O-N 3.28Å; A74-E76 VanDerWaalsContact C-N 3.35Å; A74-E76 PolarHBondContact O-N 2.91Å; E76-L78 VanDerWaalsContact C-N 3.35Å; E76-L78 PolarHBondContact O-N 2.74Å; E76-Y79 PolarHBondContact O-N 3.41Å; E76-N80 WeakPolarHBondContact O-CB 3.33Å; E76-N80 PolarHBondContact O-N 2.75Å; E76-N80 PolarHBondContact O-ND2 2.92Å
77	I	92.4	Very high	88.8	Confident	109 Å²	109	104.1 Å²	104.1	56%	0.559	52%	0.523	S	S	*	.	H	α-helix	trans	-60	-46.3	175.6	-67.4	167	0	0	0	110.4	K73 A74 Y79 N80 V81	K73-I77 WeakPolarHBondContact O-CG1 3.49Å; K73-I77 PolarHBondContact O-N 3.09Å; A74-I77 PolarHBondContact O-N 3.4Å; I77-Y79 VanDerWaalsContact C-N 3.34Å; I77-Y79 PolarHBondContact O-N 3.4Å; I77-N80 PolarHBondContact O-N 3.1Å; I77-V81 HydrophobicContact CG2-CG2 4.36Å; I77-V81 WeakPolarHBondContact O-CG2 3.32Å; I77-V81 PolarHBondContact O-N 2.75Å
78	L	92.1	Very high	87.4	Confident	113 Å²	113	105.1 Å²	105.1	59%	0.592	53%	0.532	S	S	*	.	H	α-helix	trans	-61.2	-41.3	177.7	-72.4	172.9	0	0	0	112.3	A74 Q75 E76 V81 N82	A74-L78 WeakPolarHBondContact O-CG 3.37Å; A74-L78 PolarHBondContact O-N 3.44Å; Q75-L78 PolarHBondContact O-N 3.32Å; E76-L78 VanDerWaalsContact C-N 3.35Å; E76-L78 PolarHBondContact O-N 2.74Å; L78-V81 PolarHBondContact O-N 3.13Å; L78-N82 WeakPolarHBondContact O-CB 3.47Å; L78-N82 PolarHBondContact O-N 2.99Å; L78-N82 PolarHBondContact O-ND2 2.95Å
79	Y	91	Very high	85.7	Confident	152 Å²	152	108.3 Å²	108.3	60%	0.596	55%	0.545	S	S	*	.	H	α-helix	trans	-61.2	-45.3	175	-180	-102	0	0	0	111.7	Q75 E76 I77 N82 R83	Q75-Y79 PolarHBondContact O-N 3.28Å; E76-Y79 PolarHBondContact O-N 3.41Å; I77-Y79 VanDerWaalsContact C-N 3.34Å; I77-Y79 PolarHBondContact O-N 3.4Å; Y79-N82 PolarHBondContact O-N 3.48Å; Y79-R83 WeakPolarHBondContact O-CB 3.42Å; Y79-R83 PolarHBondContact O-N 3.05Å
80	N	89.2	Confident	84	Confident	49 Å²	49	110.8 Å²	110.8	26%	0.262	56%	0.555	S	S	.	*	H	α-helix	trans	-66.7	-37.3	179.2	-75.9	-39.1	0	0	0	113	E76 I77 R83 K84	E76-N80 WeakPolarHBondContact O-CB 3.33Å; E76-N80 PolarHBondContact O-N 2.75Å; E76-N80 PolarHBondContact O-ND2 2.92Å; I77-N80 PolarHBondContact O-N 3.1Å; N80-R83 PolarHBondContact O-N 2.74Å; N80-K84 WeakPolarHBondContact O-CG 3.2Å; N80-K84 PolarHBondContact O-N 2.72Å
81	V	89.3	Confident	82	Confident	83 Å²	83	109.9 Å²	109.9	50%	0.503	56%	0.558	S	S	.	*	H	α-helix	trans	-64.6	-47.6	174.1	171	0	0	0	0	110.6	I77 L78 R83 K84 A85	I77-V81 HydrophobicContact CG2-CG2 4.36Å; I77-V81 WeakPolarHBondContact O-CG2 3.32Å; I77-V81 PolarHBondContact O-N 2.75Å; L78-V81 PolarHBondContact O-N 3.13Å; V81-R83 VanDerWaalsContact C-N 3.32Å; V81-R83 PolarHBondContact O-N 3.25Å; V81-K84 PolarHBondContact O-N 3.02Å; V81-A85 PolarHBondContact O-N 3.37Å
82	N	85.3	Confident	80	Confident	101 Å²	101	107.2 Å²	107.2	54%	0.54	56%	0.563	S	S	.	*	H	α-helix	trans	-60.9	-40.8	177.2	-77.1	-29	0	0	0	112	L78 Y79 A85 Q86	L78-N82 WeakPolarHBondContact O-CB 3.47Å; L78-N82 PolarHBondContact O-N 2.99Å; L78-N82 PolarHBondContact O-ND2 2.95Å; Y79-N82 PolarHBondContact O-N 3.48Å; N82-A85 PolarHBondContact O-N 2.99Å; N82-Q86 WeakPolarHBondContact O-CG 3.38Å; N82-Q86 PolarHBondContact O-N 3.5Å
83	R	82.7	Confident	78	Confident	127 Å²	127	107.1 Å²	107.1	48%	0.479	57%	0.567	S	S	.	*	H	α-helix	trans	-64	-42.1	176	-164.6	-177.9	76.3	-175.9	1.9	112.3	Y79 N80 V81 Q86 N87	Y79-R83 WeakPolarHBondContact O-CB 3.42Å; Y79-R83 PolarHBondContact O-N 3.05Å; N80-R83 PolarHBondContact O-N 2.74Å; V81-R83 VanDerWaalsContact C-N 3.32Å; V81-R83 PolarHBondContact O-N 3.25Å; R83-Q86 PolarHBondContact O-N 2.91Å; R83-N87 PolarHBondContact O-N 3.08Å
84	K	80.9	Confident	76	Confident	153 Å²	153	109.6 Å²	109.6	67%	0.665	58%	0.578	S	S	*	*	H	α-helix	trans	-65	-37.9	175.6	-74.2	178.5	-179.5	-177.1	0	111.9	N80 V81 S88	N80-K84 WeakPolarHBondContact O-CG 3.2Å; N80-K84 PolarHBondContact O-N 2.72Å; V81-K84 PolarHBondContact O-N 3.02Å; K84-S88 WeakPolarHBondContact O-CB 3.13Å; K84-S88 PolarHBondContact O-N 3.12Å; K84-S88 VanDerWaalsContact O-N 3.1Å; K84-S88 PolarHBondContact O-OG 3.43Å
85	A	76.9	Confident	74	Confident	50 Å²	50	114.4 Å²	114.4	41%	0.413	60%	0.597	S	S	.	*	H	α-helix	trans	-66.5	-37.2	175.6	0	0	0	0	0	112.5	V81 N82 S88 F89	V81-A85 PolarHBondContact O-N 3.37Å; N82-A85 PolarHBondContact O-N 2.99Å; A85-S88 WeakPolarHBondContact CA-OG 3.43Å; A85-S88 PolarHBondContact O-OG 3.28Å; A85-F89 PolarHBondContact O-N 2.91Å
86	Q	72.2	Confident	72.1	Confident	138 Å²	138	117.3 Å²	117.3	65%	0.645	61%	0.611	S	S	*	*	H	α-helix	trans	-71.9	-42.2	176.1	-72.1	-174	-11.9	0	0	112.7	N82 R83 S88 F89 T90	N82-Q86 WeakPolarHBondContact O-CG 3.38Å; N82-Q86 PolarHBondContact O-N 3.5Å; R83-Q86 PolarHBondContact O-N 2.91Å; Q86-S88 VanDerWaalsContact C-N 3.33Å; Q86-S88 PolarHBondContact O-N 2.94Å; Q86-F89 PolarHBondContact O-N 3.47Å; Q86-T90 PolarHBondContact O-N 2.95Å; Q86-T90 PolarHBondContact O-OG1 3.46Å
87	N	68.4	Low	70	Confident	94 Å²	94	119.3 Å²	119.3	50%	0.503	62%	0.623	S	S	.	*	H	α-helix	trans	-70.1	-27.9	179.8	-72.7	-6.6	0	0	0	113.4	R83 T90 S91	R83-N87 PolarHBondContact O-N 3.08Å; N87-T90 PolarHBondContact O-OG1 2.95Å; N87-S91 PolarHBondContact O-OG 3.23Å
88	S	63.7	Low	67.8	Low	76 Å²	76	125.2 Å²	125.2	53%	0.531	64%	0.639	S	S	.	*	H	α-helix	trans	-73.5	-29.8	173.4	44.4	0	0	0	0	112.4	K84 A85 Q86	K84-S88 WeakPolarHBondContact O-CB 3.13Å; K84-S88 PolarHBondContact O-N 3.12Å; K84-S88 VanDerWaalsContact O-N 3.1Å; K84-S88 PolarHBondContact O-OG 3.43Å; A85-S88 WeakPolarHBondContact CA-OG 3.43Å; A85-S88 PolarHBondContact O-OG 3.28Å; Q86-S88 VanDerWaalsContact C-N 3.33Å; Q86-S88 PolarHBondContact O-N 2.94Å
89	F	58.1	Low	65.6	Low	173 Å²	173	125.6 Å²	125.6	76%	0.759	65%	0.648	S	S	*	*	H	α-helix	trans	-74.7	-30.1	174.9	-114.4	-91.4	0	0	0	113.9	A85 Q86	A85-F89 PolarHBondContact O-N 2.91Å; Q86-F89 PolarHBondContact O-N 3.47Å
90	T	59.1	Low	63.5	Low	97 Å²	97	129.3 Å²	129.3	60%	0.595	66%	0.661	S	S	*	*	H	α-helix	trans	-85.6	-14.3	-176.8	54.5	0	0	0	0	114.3	Q86 N87	Q86-T90 PolarHBondContact O-N 2.95Å; Q86-T90 PolarHBondContact O-OG1 3.46Å; N87-T90 PolarHBondContact O-OG1 2.95Å
91	S	53.3	Low	61.5	Low	99 Å²	99	136.1 Å²	136.1	69%	0.692	69%	0.688	S	S	*	*	H	α-helix	trans	-93.6	-14.4	-178.9	-54.2	0	0	0	0	113.8	N87	N87-S91 PolarHBondContact O-OG 3.23Å
92	A	53.5	Low	59.6	Low	86 Å²	86	140.7 Å²	140.7	71%	0.711	71%	0.707	S	S	*	*	S	Bend	trans	-93.8	-3.2	-173	0	0	0	0	0	115.5
93	T	53.9	Low	58	Low	113 Å²	113	143.1 Å²	143.1	69%	0.693	72%	0.72	S	S	*	*	S	Bend	trans	-114.1	9.3	-170.6	43.7	0	0	0	0	116.1
94	K	53.1	Low	56	Low	187 Å²	187	144 Å²	144	81%	0.813	73%	0.734	S	S	*	*	S	Bend	trans	-86.1	-8.2	179.9	-90.4	-177.7	177.2	178	0	116.9
95	N	52.2	Low	54.7	Low	151 Å²	151	144 Å²	144	81%	0.807	74%	0.736	S	S	*	*	S	Bend	trans	-126.5	76.4	179	-75.8	-16.2	0	0	0	111.5
96	Q	54.5	Low	53.5	Low	193 Å²	193	153 Å²	153	90%	0.902	76%	0.76	S	S	*	*			trans	-175.4	67.2	151.3	-103.3	172	88.1	0	0	110.7	R98	Q96-R98 PolarHBondContact O-N 2.92Å
97	I	49.3	Very low	52.3	Low	161 Å²	161	153.9 Å²	153.9	83%	0.826	77%	0.769	S	S	*	*			trans	-79.5	101.7	160.3	-61.8	170.3	0	0	0	106.8
98	R	46.1	Very low	51.6	Low	234 Å²	234	156.5 Å²	156.5	88%	0.883	78%	0.778	S	S	*	*			trans	-129.1	110.5	150.5	-76.3	-166.2	-178.6	-150.4	1.7	107.4	Q96 R100	Q96-R98 PolarHBondContact O-N 2.92Å; R98-R100 PolarHBondContact O-N 3.43Å
99	P	44.1	Very low	51.1	Low	120 Å²	120	164.2 Å²	164.2	78%	0.779	80%	0.795	S	S	*	*			trans	-81.2	109.2	173.4	31.9	-26.8	0	0	0	107.4
100	R	48.3	Very low	50.4	Low	231 Å²	231	164.7 Å²	164.7	87%	0.872	80%	0.797	S	S	*	*			trans	-129.4	108.5	164.9	-107.8	-175.5	175.7	-169.4	-0.4	109.7	R98	R98-R100 PolarHBondContact O-N 3.43Å
101	K	47.1	Very low	49.7	Very low	192 Å²	192	165.5 Å²	165.5	84%	0.835	80%	0.802	S	S	*	*			trans	71.7	82.6	158.1	-56.2	-173.7	178.6	-175	0	116.4	L103	K101-L103 PolarHBondContact O-N 3.33Å
102	I	49	Very low	49.2	Very low	178 Å²	178	168.7 Å²	168.7	91%	0.913	81%	0.811	S	S	*	*			trans	-78.9	92.1	152.1	-62	168.9	0	0	0	107.1
103	L	51.1	Low	48.9	Very low	153 Å²	153	172.5 Å²	172.5	80%	0.801	81%	0.814	S	S	*	*	S	Bend	trans	-168.9	135.8	150.6	-153.1	62	0	0	0	107.6	K101	K101-L103 PolarHBondContact O-N 3.33Å
104	N	41.4	Very low	48.9	Very low	145 Å²	145	176.1 Å²	176.1	78%	0.775	82%	0.82	S	S	*	*	S	Bend	trans	92	24	170.3	-68.8	-6.6	0	0	0	122.6
105	Q	54.4	Low	49.1	Very low	153 Å²	153	176.6 Å²	176.6	72%	0.715	82%	0.822	S	S	*	*			trans	-111.5	15.9	164.8	-82	-176.1	11.8	0	0	115.8	N107	Q105-N107 PolarHBondContact O-N 2.97Å
106	R	51.7	Low	49.5	Very low	240 Å²	240	173.7 Å²	173.7	91%	0.906	81%	0.806	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-7.9	171.8	-115.3	175.8	177.4	159.5	-1.7	114.2
107	N	46.6	Very low	50.1	Low	156 Å²	156	169.4 Å²	169.4	83%	0.834	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.5	10	-179.3	-81.1	-12.7	0	0	0	115.6	Q105	Q105-N107 PolarHBondContact O-N 2.97Å
108	Q	53.9	Low	51.3	Low	148 Å²	148	167.3 Å²	167.3	69%	0.692	78%	0.779	S	S	*	*	S	Bend	trans	-107.8	8.6	174.8	-64.1	-171.7	9.3	0	0	114.2	K110	Q108-K110 PolarHBondContact O-N 3.35Å
109	R	52.9	Low	52.9	Low	239 Å²	239	162.2 Å²	162.2	90%	0.902	77%	0.77	S	S	*	*	S	Bend	trans	-83.5	8.7	171.7	-72.1	-173.6	175.1	-176.8	-1.6	113.9
110	K	42.8	Very low	54.8	Low	182 Å²	182	160.2 Å²	160.2	79%	0.791	75%	0.752	S	S	*	*	S	Bend	trans	-119.5	134.1	173.7	-76.1	177.3	174.2	178.8	0	106.8	Q108	Q108-K110 PolarHBondContact O-N 3.35Å
111	V	45.3	Very low	56.9	Low	114 Å²	114	151.9 Å²	151.9	69%	0.691	72%	0.721	S	S	*	*			trans	82.9	45.2	-175.9	-153.1	0	0	0	0	115.3	E113	V111-E113 HydrophobicContact CG1-CG 3.98Å
112	N	41.1	Very low	59	Low	166 Å²	166	143.4 Å²	143.4	89%	0.888	68%	0.684	S	S	*	*			trans	-91.7	78.2	133.6	-88.4	-11.2	0	0	0	105.5	K114	N112-K114 PolarHBondContact O-N 3.45Å; N112-K114 VanDerWaalsContact O-N 3.07Å
113	E	47.9	Very low	61	Low	166 Å²	166	136.2 Å²	136.2	78%	0.776	65%	0.649	S	S	*	*			trans	-52.6	118.2	167.4	-82.7	176.6	170.4	0	0	107.2	V111 K115	V111-E113 HydrophobicContact CG1-CG 3.98Å; E113-K115 VanDerWaalsContact C-N 3.32Å; E113-K115 PolarHBondContact O-N 2.98Å
114	K	54.4	Low	63	Low	190 Å²	190	132.3 Å²	132.3	83%	0.826	63%	0.631	S	S	*	*			trans	-46.7	98.1	177.3	-69.8	167.1	176.2	173.5	0	107.7	N112 I116	N112-K114 PolarHBondContact O-N 3.45Å; N112-K114 VanDerWaalsContact O-N 3.07Å; K114-I116 PolarHBondContact O-N 2.9Å
115	K	56.3	Low	65.5	Low	196 Å²	196	126.5 Å²	126.5	85%	0.852	60%	0.6	S	S	*	*			trans	-61.3	91.8	156.5	-166.1	179	-173.7	-176.6	0	103.5	E113 N117	E113-K115 VanDerWaalsContact C-N 3.32Å; E113-K115 PolarHBondContact O-N 2.98Å; K115-N117 PolarHBondContact O-N 3.45Å
116	I	60.7	Low	67.4	Low	90 Å²	90	119.4 Å²	119.4	46%	0.462	57%	0.567	S	S	.	*			trans	-54	113.4	177.3	-69.4	161.3	0	0	0	103.4	K114 N118 L142	K114-I116 PolarHBondContact O-N 2.9Å; I116-N118 PolarHBondContact O-N 2.99Å; I116-L142 HydrophobicContact CD1-CD1 4.38Å; I116-L142 HydrophobicContact CD1-CD2 4.05Å; I116-L142 HydrophobicContact CG1-CD1 4.3Å; I116-L142 HydrophobicContact CG2-CD1 4.3Å; I116-L142 HydrophobicContact CG2-CD2 4.05Å
117	N	68.7	Low	69.5	Low	103 Å²	103	117.6 Å²	117.6	55%	0.551	56%	0.561	S	S	*	*			trans	-58.2	99.5	173.1	-76.4	-30.7	0	0	0	105.3	K115 D119 L120	K115-N117 PolarHBondContact O-N 3.45Å; N117-D119 PolarHBondContact O-N 3.39Å; N117-D119 VanDerWaalsContact O-N 3.11Å; N117-L120 HydrophobicContact CB-CB 4.3Å; N117-L120 HydrophobicContact CB-CD1 3.89Å; N117-L120 HydrophobicContact CB-CG 3.98Å; N117-L120 WeakPolarHBondContact O-CB 3.39Å; N117-L120 PolarHBondContact O-N 3.29Å
118	N	73.5	Confident	71.8	Confident	117 Å²	117	112.2 Å²	112.2	63%	0.626	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-59.4	-26.3	-175.4	-159.5	13.8	0	0	0	110	I116 L120 Y121	I116-N118 PolarHBondContact O-N 2.99Å; N118-L120 PolarHBondContact O-N 3.01Å; N118-Y121 VanDerWaalsContact O-CB 3.32Å; N118-Y121 WeakPolarHBondContact O-CB 3.38Å; N118-Y121 PolarHBondContact O-N 3.45Å; N118-Y121 VanDerWaalsContact O-N 3.13Å
119	D	78.9	Confident	73.8	Confident	128 Å²	128	110.5 Å²	110.5	68%	0.684	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-62.1	-22.7	173.3	-54	-19.6	0	0	0	113.8	N117 T123	N117-D119 PolarHBondContact O-N 3.39Å; N117-D119 VanDerWaalsContact O-N 3.11Å; D119-T123 WeakPolarHBondContact O-CG2 3.47Å
120	L	85.2	Confident	75.7	Confident	78 Å²	78	106.3 Å²	106.3	41%	0.408	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-100.1	-0.7	178.2	-62	178.1	0	0	0	113.1	N117 N118 K122 T123 F155	N117-L120 HydrophobicContact CB-CB 4.3Å; N117-L120 HydrophobicContact CB-CD1 3.89Å; N117-L120 HydrophobicContact CB-CG 3.98Å; N117-L120 WeakPolarHBondContact O-CB 3.39Å; N117-L120 PolarHBondContact O-N 3.29Å; N118-L120 PolarHBondContact O-N 3.01Å; L120-K122 PolarHBondContact O-N 3.41Å; L120-T123 PolarHBondContact O-N 2.95Å; L120-T123 PolarHBondContact O-OG1 3.43Å; L120-F155 HydrophobicContact CD2-CE1 3.39Å; L120-F155 HydrophobicContact CD2-CE2 4.26Å; L120-F155 HydrophobicContact CD2-CZ 3.13Å
121	Y	91.7	Very high	78.2	Confident	56 Å²	56	103.1 Å²	103.1	22%	0.22	50%	0.498	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	125.6	-178.2	-177.7	-105.9	0	0	0	111.1	N118 T123 L142 R151	N118-Y121 VanDerWaalsContact O-CB 3.32Å; N118-Y121 WeakPolarHBondContact O-CB 3.38Å; N118-Y121 PolarHBondContact O-N 3.45Å; N118-Y121 VanDerWaalsContact O-N 3.13Å; Y121-T123 PolarHBondContact O-N 3.28Å; Y121-T123 VanDerWaalsContact O-N 3.16Å; Y121-L142 HydrophobicContact CD2-CB 4.47Å; Y121-L142 HydrophobicContact CD2-CD2 3.82Å; Y121-L142 HydrophobicContact CE2-CD2 3.93Å; Y121-R151 WeakPolarHBondContact O-CD 3.22Å
122	K	92.1	Very high	80.4	Confident	13 Å²	13	101 Å²	101	6%	0.057	50%	0.499	C	S	.	.	T	Hydrogen-bonded Turn	trans	53	29.1	-178.7	-62.2	179	-179.6	-91.3	0	114.3	L120 T124 L142 A144 E149 L150 R151	L120-K122 PolarHBondContact O-N 3.41Å; K122-T124 VanDerWaalsContact C-N 3.3Å; K122-L142 WeakPolarHBondContact CA-O 3.49Å; K122-L142 PolarHBondContact N-O 2.84Å; K122-A144 HydrophobicContact CB-CB 4.26Å; K122-E149 WeakPolarHBondContact CB-O 3.46Å; K122-E149 HydrophobicContact CD-CB 4.13Å; K122-E149 IonicContact NZ-OE1 3.66Å; K122-E149 PolarHBondContact NZ-OE1 2.97Å; K122-E149 IonicContact NZ-OE2 2.73Å; K122-E149 PolarHBondContact NZ-OE2 2.94Å; K122-L150 CarbonylContact O-C 3.55Å; K122-L150 WeakPolarHBondContact O-CA 3.49Å; K122-R151 HydrophobicContact CB-CG 4.33Å; K122-R151 PolarHBondContact O-N 3.38Å
123	T	91	Very high	82.9	Confident	27 Å²	27	97.7 Å²	97.7	17%	0.166	48%	0.481	C	S	.	.			trans	-82.3	-8	177.3	58.5	0	0	0	0	114.2	D119 L120 Y121 R151 A153	D119-T123 WeakPolarHBondContact O-CG2 3.47Å; L120-T123 PolarHBondContact O-N 2.95Å; L120-T123 PolarHBondContact O-OG1 3.43Å; Y121-T123 PolarHBondContact O-N 3.28Å; Y121-T123 VanDerWaalsContact O-N 3.16Å; T123-R151 WeakPolarHBondContact CA-O 3.2Å; T123-R151 HydrophobicContact CG2-CB 4.47Å; T123-A153 HydrophobicContact CG2-CB 3.8Å
124	T	91.6	Very high	85.1	Confident	71 Å²	71	95.2 Å²	95.2	44%	0.436	48%	0.479	S	S	.	.	S	Bend	trans	-138.4	150.5	178	53.4	0	0	0	0	110.8	K122 F143 A144 L150	K122-T124 VanDerWaalsContact C-N 3.3Å; T124-F143 WeakPolarHBondContact O-CA 3.37Å; T124-F143 WeakPolarHBondContact OG1-CD1 3.47Å; T124-F143 WeakPolarHBondContact OG1-CE1 3.45Å; T124-A144 PolarHBondContact O-N 3.49Å; T124-L150 VanDerWaalsContact C-CD1 3.45Å
125	L	94.1	Very high	87.1	Confident	23 Å²	23	87.4 Å²	87.4	12%	0.12	45%	0.448	C	S	.	.	B	Isolated β-bridge	trans	-70.7	138.1	179.9	-76.9	170.8	0	0	0	112.1	R127 W129 A144 L150 M169	L125-R127 PolarHBondContact O-N 3.43Å; L125-W129 HydrophobicContact CD2-CE3 4.11Å; L125-W129 HydrophobicContact CD2-CZ3 3.89Å; L125-A144 HydrophobicContact CD2-CB 4.18Å; L125-L150 HydrophobicContact CD2-CD1 4.49Å; L125-L150 HydrophobicContact CG-CD1 4.21Å; L125-L150 HydrophobicContact CG-CD2 4.35Å; L125-M169 HydrophobicContact CD1-CE 3.75Å; L125-M169 HydrophobicContact CD1-SD 4.39Å
126	C	95.8	Very high	88.9	Confident	4 Å²	4	89.9 Å²	89.9	3%	0.027	45%	0.452	C	S	.	.			trans	-64.5	129.8	174.3	177.2	0	0	0	0	110.5	W129 R130 F143 A144 H145	C126-W129 HydrophobicContact CB-CB 3.87Å; C126-W129 PolarHBondContact O-N 3.19Å; C126-R130 VanDerWaalsContact O-CB 3.31Å; C126-R130 WeakPolarHBondContact O-CB 3.34Å; C126-R130 PolarHBondContact O-N 2.98Å; C126-F143 HydrophobicContact CB-CB 3.7Å; C126-A144 WeakPolarHBondContact CB-O 3.32Å; C126-A144 PolarHBondContact N-O 3.33Å; C126-H145 VanDerWaalsContact CB-CD2 3.42Å; C126-H145 WeakPolarHBondContact CB-CD2 3.24Å
127	R	95	Very high	90.6	Very high	203 Å²	203	90 Å²	90	77%	0.766	45%	0.453	S	S	*	.	H	α-helix	trans	-64.9	-42.2	-179.3	-65.8	-175.8	-177.1	-161.5	0.4	112.7	L125 R130 N131	L125-R127 PolarHBondContact O-N 3.43Å; R127-R130 PolarHBondContact O-N 3.4Å; R127-N131 WeakPolarHBondContact O-CB 3.35Å; R127-N131 PolarHBondContact O-N 3.1Å; R127-N131 PolarHBondContact O-OD1 2.92Å
128	S	95.5	Very high	91.7	Very high	43 Å²	43	86.7 Å²	86.7	30%	0.301	44%	0.443	S	S	.	.	H	α-helix	trans	-61	-50.4	177.6	-56.1	0	0	0	0	110.3	R130 N131 G132 I133	S128-R130 PolarHBondContact O-N 2.94Å; S128-N131 CarbonylContact O-C 3.56Å; S128-N131 PolarHBondContact O-N 2.93Å; S128-N131 VanDerWaalsContact O-N 3.12Å; S128-G132 PolarHBondContact O-N 3.12Å; S128-I133 CarbonylContact C-O 3.57Å; S128-I133 WeakPolarHBondContact CB-O 3.47Å; S128-I133 WeakPolarHBondContact O-CA 3.22Å; S128-I133 PolarHBondContact O-N 3.25Å
129	W	95.5	Very high	92.6	Very high	111 Å²	111	89.1 Å²	89.1	42%	0.42	45%	0.451	S	S	.	.	H	α-helix	trans	-60.5	-44.7	177.9	-177.2	85.4	0	0	0	112.4	L125 C126 N131 G132 H145 G146	L125-W129 HydrophobicContact CD2-CE3 4.11Å; L125-W129 HydrophobicContact CD2-CZ3 3.89Å; C126-W129 HydrophobicContact CB-CB 3.87Å; C126-W129 PolarHBondContact O-N 3.19Å; W129-N131 PolarHBondContact O-N 3.48Å; W129-G132 PolarHBondContact O-N 3.07Å; W129-H145 HydrophobicContact CB-CB 4.39Å; W129-H145 HydrophobicContact CD2-CB 4.41Å; W129-H145 HydrophobicContact CG-CB 3.88Å; W129-H145 VanDerWaalsContact CZ2-O 3.23Å; W129-H145 WeakPolarHBondContact CZ2-O 3.47Å; W129-H145 PolarHBondContact NE1-O 3.3Å; W129-G146 VanDerWaalsContact CZ2-CA 3.49Å
130	R	93.5	Very high	93.3	Very high	152 Å²	152	93 Å²	93	57%	0.574	46%	0.456	S	S	*	.	H	α-helix	trans	-57.2	-36.7	175.7	179.2	-173.2	-69.2	171.5	-4.3	112.4	C126 R127 S128 G132	C126-R130 VanDerWaalsContact O-CB 3.31Å; C126-R130 WeakPolarHBondContact O-CB 3.34Å; C126-R130 PolarHBondContact O-N 2.98Å; R127-R130 PolarHBondContact O-N 3.4Å; S128-R130 PolarHBondContact O-N 2.94Å; R130-G132 VanDerWaalsContact C-N 3.25Å; R130-G132 PolarHBondContact O-N 3.37Å
131	N	94	Very high	93.7	Very high	114 Å²	114	89.3 Å²	89.3	61%	0.61	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	4.6	179.9	-65.4	-0.3	0	0	0	112.8	R127 S128 W129 I133	R127-N131 WeakPolarHBondContact O-CB 3.35Å; R127-N131 PolarHBondContact O-N 3.1Å; R127-N131 PolarHBondContact O-OD1 2.92Å; S128-N131 CarbonylContact O-C 3.56Å; S128-N131 PolarHBondContact O-N 2.93Å; S128-N131 VanDerWaalsContact O-N 3.12Å; W129-N131 PolarHBondContact O-N 3.48Å; N131-I133 HydrophobicContact CB-CD1 4.04Å; N131-I133 HydrophobicContact CB-CG1 4.15Å; N131-I133 PolarHBondContact O-N 3.5Å
132	G	92.6	Very high	93.8	Very high	69 Å²	69	90 Å²	90	71%	0.711	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	12.7	-174.8	0	0	0	0	0	114.3	S128 W129 R130	S128-G132 PolarHBondContact O-N 3.12Å; W129-G132 PolarHBondContact O-N 3.07Å; R130-G132 VanDerWaalsContact C-N 3.25Å; R130-G132 PolarHBondContact O-N 3.37Å
133	I	93.4	Very high	94	Very high	98 Å²	98	94.1 Å²	94.1	50%	0.503	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-95.1	132.9	-179.1	-56.9	171.1	0	0	0	109.2	S128 N131 C135	S128-I133 CarbonylContact C-O 3.57Å; S128-I133 WeakPolarHBondContact CB-O 3.47Å; S128-I133 WeakPolarHBondContact O-CA 3.22Å; S128-I133 PolarHBondContact O-N 3.25Å; N131-I133 HydrophobicContact CB-CD1 4.04Å; N131-I133 HydrophobicContact CB-CG1 4.15Å; N131-I133 PolarHBondContact O-N 3.5Å; I133-C135 PolarHBondContact O-N 3.07Å
134	P	93.1	Very high	94.2	Very high	113 Å²	113	92.8 Å²	92.8	73%	0.734	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-52.8	126	174.3	-27.1	34.5	0	0	0	112.3	R136	P134-R136 PolarHBondContact O-N 3.11Å
135	C	96.4	Very high	94.4	Very high	27 Å²	27	90.8 Å²	90.8	18%	0.182	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-75.7	122.3	178.1	-174.8	0	0	0	0	110.5	I133 L137 G138 H145	I133-C135 PolarHBondContact O-N 3.07Å; C135-L137 PolarHBondContact O-N 2.85Å; C135-L137 VanDerWaalsContact O-N 3.1Å; C135-G138 PolarHBondContact O-N 2.98Å; C135-H145 WeakPolarHBondContact CB-NE2 3.28Å; C135-H145 PolarHBondContact SG-NE2 3.5Å; C135-H145 VanDerWaalsContact SG-NE2 3.38Å
136	R	95.5	Very high	94.3	Very high	248 Å²	248	89.7 Å²	89.7	94%	0.936	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-19.8	177.9	-60.3	-177	-176.7	-173.3	0.1	114	P134	P134-R136 PolarHBondContact O-N 3.11Å
137	L	94.8	Very high	94	Very high	92 Å²	92	91.9 Å²	91.9	48%	0.482	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-16.4	179	-60.4	176.8	0	0	0	113	C135 E139 R140 C141	C135-L137 PolarHBondContact O-N 2.85Å; C135-L137 VanDerWaalsContact O-N 3.1Å; L137-E139 PolarHBondContact O-N 3.37Å; L137-R140 WeakPolarHBondContact O-CB 3.47Å; L137-R140 PolarHBondContact O-N 3.21Å; L137-R140 VanDerWaalsContact O-N 3.13Å; L137-C141 HydrophobicContact CB-CB 3.92Å; L137-C141 HydrophobicContact CD1-CB 4.43Å
138	G	92.2	Very high	93.8	Very high	34 Å²	34	89 Å²	89	35%	0.351	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	52.6	-136.6	-174.2	0	0	0	0	0	111.8	C135 R140 C141 H145	C135-G138 PolarHBondContact O-N 2.98Å; G138-R140 PolarHBondContact O-N 2.69Å; G138-R140 VanDerWaalsContact O-N 3.17Å; G138-C141 VanDerWaalsContact O-CB 3.25Å; G138-C141 WeakPolarHBondContact O-CB 3.21Å; G138-C141 PolarHBondContact O-N 2.95Å; G138-C141 VanDerWaalsContact O-N 3.11Å; G138-H145 PolarHBondContact O-CE1 3.38Å
139	E	92.3	Very high	93.6	Very high	167 Å²	167	89.2 Å²	89.2	78%	0.78	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-64.5	-18.8	179.7	-63.4	176.3	-179.6	0	0	114	L137 C141	L137-E139 PolarHBondContact O-N 3.37Å; E139-C141 PolarHBondContact O-N 3.29Å
140	R	93.2	Very high	93.5	Very high	210 Å²	210	85.3 Å²	85.3	79%	0.792	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-79.7	2.6	176.4	-58	-176.3	-66.3	-179.1	-2.5	113	L137 G138 L142	L137-R140 WeakPolarHBondContact O-CB 3.47Å; L137-R140 PolarHBondContact O-N 3.21Å; L137-R140 VanDerWaalsContact O-N 3.13Å; G138-R140 PolarHBondContact O-N 2.69Å; G138-R140 VanDerWaalsContact O-N 3.17Å; R140-L142 PolarHBondContact O-N 2.88Å
141	C	95.2	Very high	93.2	Very high	1 Å²	1	84.4 Å²	84.4	1%	0.007	42%	0.423	C	S	.	.			trans	-63.9	124.7	176.4	-166	0	0	0	0	110.5	L137 G138 E139 F143 H145	L137-C141 HydrophobicContact CB-CB 3.92Å; L137-C141 HydrophobicContact CD1-CB 4.43Å; G138-C141 VanDerWaalsContact O-CB 3.25Å; G138-C141 WeakPolarHBondContact O-CB 3.21Å; G138-C141 PolarHBondContact O-N 2.95Å; G138-C141 VanDerWaalsContact O-N 3.11Å; E139-C141 PolarHBondContact O-N 3.29Å; C141-F143 PolarHBondContact O-N 2.94Å; C141-H145 WeakPolarHBondContact CB-NE2 3.47Å; C141-H145 PolarHBondContact SG-NE2 2.75Å
142	L	94.1	Very high	92.6	Very high	70 Å²	70	81.3 Å²	81.3	37%	0.366	41%	0.406	S	S	.	.	S	Bend	trans	-71.8	-7.9	174.8	-56.7	-179.8	0	0	0	112.7	I116 Y121 K122 R140	I116-L142 HydrophobicContact CD1-CD1 4.38Å; I116-L142 HydrophobicContact CD1-CD2 4.05Å; I116-L142 HydrophobicContact CG1-CD1 4.3Å; I116-L142 HydrophobicContact CG2-CD1 4.3Å; I116-L142 HydrophobicContact CG2-CD2 4.05Å; Y121-L142 HydrophobicContact CD2-CB 4.47Å; Y121-L142 HydrophobicContact CD2-CD2 3.82Å; Y121-L142 HydrophobicContact CE2-CD2 3.93Å; K122-L142 WeakPolarHBondContact CA-O 3.49Å; K122-L142 PolarHBondContact N-O 2.84Å; R140-L142 PolarHBondContact O-N 2.88Å
143	F	94.8	Very high	91.7	Very high	99 Å²	99	78.4 Å²	78.4	43%	0.434	38%	0.375	S	S	.	.	S	Bend	trans	-106.8	152.8	179.4	-57.1	-75.2	0	0	0	110.1	T124 C126 C141	T124-F143 WeakPolarHBondContact O-CA 3.37Å; T124-F143 WeakPolarHBondContact OG1-CD1 3.47Å; T124-F143 WeakPolarHBondContact OG1-CE1 3.45Å; C126-F143 HydrophobicContact CB-CB 3.7Å; C141-F143 PolarHBondContact O-N 2.94Å
144	A	95.5	Very high	90.5	Very high	0 Å²	0	84.9 Å²	84.9	0%	0	39%	0.393	C	S	.	.	B	Isolated β-bridge	trans	-74.5	129.9	-178.1	0	0	0	0	0	112.2	K122 T124 L125 C126 G146 E149 L150	K122-A144 HydrophobicContact CB-CB 4.26Å; T124-A144 PolarHBondContact O-N 3.49Å; L125-A144 HydrophobicContact CD2-CB 4.18Å; C126-A144 WeakPolarHBondContact CB-O 3.32Å; C126-A144 PolarHBondContact N-O 3.33Å; A144-G146 PolarHBondContact O-N 2.96Å; A144-E149 HydrophobicContact CB-CB 3.69Å; A144-L150 HydrophobicContact CB-CB 3.9Å; A144-L150 HydrophobicContact CB-CD1 3.77Å; A144-L150 HydrophobicContact CB-CG 4.47Å
145	H	95.7	Very high	89.3	Confident	28 Å²	28	85.6 Å²	85.6	13%	0.13	39%	0.385	C	S	.	.	S	Bend	trans	-87.3	35.6	169	-65.7	162	0	0	0	112	C126 W129 C135 G138 C141 H148 E149	C126-H145 VanDerWaalsContact CB-CD2 3.42Å; C126-H145 WeakPolarHBondContact CB-CD2 3.24Å; W129-H145 HydrophobicContact CB-CB 4.39Å; W129-H145 HydrophobicContact CD2-CB 4.41Å; W129-H145 HydrophobicContact CG-CB 3.88Å; W129-H145 VanDerWaalsContact CZ2-O 3.23Å; W129-H145 WeakPolarHBondContact CZ2-O 3.47Å; W129-H145 PolarHBondContact NE1-O 3.3Å; C135-H145 WeakPolarHBondContact CB-NE2 3.28Å; C135-H145 PolarHBondContact SG-NE2 3.5Å; C135-H145 VanDerWaalsContact SG-NE2 3.38Å; G138-H145 PolarHBondContact O-CE1 3.38Å; C141-H145 WeakPolarHBondContact CB-NE2 3.47Å; C141-H145 PolarHBondContact SG-NE2 2.75Å; H145-H148 PolarHBondContact O-CE1 2.92Å; H145-H148 VanDerWaalsContact O-CE1 3.31Å; H145-E149 WeakPolarHBondContact CB-OE2 3.44Å; H145-E149 IonicContact CG-OE2 3.84Å; H145-E149 PolarHBondContact N-OE2 3.28Å
146	G	92.5	Very high	87.6	Confident	0 Å²	0	87.7 Å²	87.7	0%	0	40%	0.397	C	S	.	.	S	Bend	trans	145.3	173.9	172.5	0	0	0	0	0	114	W129 A144 H148 E149 L150	W129-G146 VanDerWaalsContact CZ2-CA 3.49Å; A144-G146 PolarHBondContact O-N 2.96Å; G146-H148 PolarHBondContact O-N 3.15Å; G146-E149 PolarHBondContact O-N 3.33Å; G146-E149 VanDerWaalsContact O-N 3.11Å; G146-L150 PolarHBondContact O-N 3.3Å
147	P	89.1	Confident	85.9	Confident	50 Å²	50	80.8 Å²	80.8	33%	0.325	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-49.9	-46.2	175.2	9.9	-22.7	0	0	0	112.5	E149 L150 Y165	P147-E149 PolarHBondContact O-N 3.45Å; P147-E149 VanDerWaalsContact O-N 3.16Å; P147-L150 WeakPolarHBondContact O-CB 3.33Å; P147-L150 PolarHBondContact O-N 3.02Å; P147-Y165 HydrophobicContact CB-CD2 3.69Å; P147-Y165 HydrophobicContact CB-CE2 3.14Å; P147-Y165 VanDerWaalsContact O-CZ 3.23Å; P147-Y165 PolarHBondContact O-OH 3.09Å
148	H	90.3	Very high	84.3	Confident	143 Å²	143	82.2 Å²	82.2	66%	0.662	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-61.2	-24.1	-179	65	-80.6	0	0	0	114.5	H145 G146	H145-H148 PolarHBondContact O-CE1 2.92Å; H145-H148 VanDerWaalsContact O-CE1 3.31Å; G146-H148 PolarHBondContact O-N 3.15Å
149	E	93	Very high	82.9	Confident	47 Å²	47	84.7 Å²	84.7	22%	0.22	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-95.6	-15.8	177	-74.9	-159	146.8	0	0	113.2	K122 A144 H145 G146 P147 R151	K122-E149 WeakPolarHBondContact CB-O 3.46Å; K122-E149 HydrophobicContact CD-CB 4.13Å; K122-E149 IonicContact NZ-OE1 3.66Å; K122-E149 PolarHBondContact NZ-OE1 2.97Å; K122-E149 IonicContact NZ-OE2 2.73Å; K122-E149 PolarHBondContact NZ-OE2 2.94Å; A144-E149 HydrophobicContact CB-CB 3.69Å; H145-E149 WeakPolarHBondContact CB-OE2 3.44Å; H145-E149 IonicContact CG-OE2 3.84Å; H145-E149 PolarHBondContact N-OE2 3.28Å; G146-E149 PolarHBondContact O-N 3.33Å; G146-E149 VanDerWaalsContact O-N 3.11Å; P147-E149 PolarHBondContact O-N 3.45Å; P147-E149 VanDerWaalsContact O-N 3.16Å; E149-R151 PolarHBondContact O-N 3.23Å
150	L	91.5	Very high	81.4	Confident	30 Å²	30	80.6 Å²	80.6	16%	0.157	40%	0.395	C	S	.	.			trans	-76.8	114.6	-169.8	-169.3	70.3	0	0	0	110.8	K122 T124 L125 A144 G146 P147	K122-L150 CarbonylContact O-C 3.55Å; K122-L150 WeakPolarHBondContact O-CA 3.49Å; T124-L150 VanDerWaalsContact C-CD1 3.45Å; L125-L150 HydrophobicContact CD2-CD1 4.49Å; L125-L150 HydrophobicContact CG-CD1 4.21Å; L125-L150 HydrophobicContact CG-CD2 4.35Å; A144-L150 HydrophobicContact CB-CB 3.9Å; A144-L150 HydrophobicContact CB-CD1 3.77Å; A144-L150 HydrophobicContact CB-CG 4.47Å; G146-L150 PolarHBondContact O-N 3.3Å; P147-L150 WeakPolarHBondContact O-CB 3.33Å; P147-L150 PolarHBondContact O-N 3.02Å
151	R	88.7	Confident	79.7	Confident	133 Å²	133	75.6 Å²	75.6	50%	0.502	38%	0.38	S	S	.	.			trans	-90.4	138.8	178.3	-60.9	-173.7	-177.9	177.9	-1.2	110.7	Y121 K122 T123 E149 A153	Y121-R151 WeakPolarHBondContact O-CD 3.22Å; K122-R151 HydrophobicContact CB-CG 4.33Å; K122-R151 PolarHBondContact O-N 3.38Å; T123-R151 WeakPolarHBondContact CA-O 3.2Å; T123-R151 HydrophobicContact CG2-CB 4.47Å; E149-R151 PolarHBondContact O-N 3.23Å; R151-A153 PolarHBondContact O-N 3.42Å
152	I	81.1	Confident	77.8	Confident	48 Å²	48	78.9 Å²	78.9	25%	0.246	40%	0.401	C	S	.	.			trans	-70.2	116.7	167.9	-61.9	-172.4	0	0	0	108.1	R154 L160 H161	I152-R154 PolarHBondContact O-N 3.49Å; I152-L160 HydrophobicContact CD1-CB 4.32Å; I152-L160 WeakPolarHBondContact CD1-O 2.76Å; I152-H161 VanDerWaalsContact CD1-O 3.24Å; I152-H161 WeakPolarHBondContact CD1-O 3.4Å
153	A	74.3	Confident	76	Confident	8 Å²	8	81 Å²	81	7%	0.066	41%	0.405	C	S	.	.			trans	-61.3	109.5	167.2	0	0	0	0	0	108.7	T123 R151 F155 V156	T123-A153 HydrophobicContact CG2-CB 3.8Å; R151-A153 PolarHBondContact O-N 3.42Å; A153-F155 HydrophobicContact CB-CD1 3.99Å; A153-F155 HydrophobicContact CB-CE1 3.47Å; A153-F155 VanDerWaalsContact CB-CE1 3.47Å; A153-F155 HydrophobicContact CB-CE2 4.32Å; A153-F155 HydrophobicContact CB-CZ 3.61Å; A153-F155 PolarHBondContact O-N 3.49Å; A153-V156 HydrophobicContact CB-CB 4.02Å; A153-V156 HydrophobicContact CB-CG2 3.54Å; A153-V156 PolarHBondContact O-N 3.49Å
154	R	67.6	Low	74.2	Confident	235 Å²	235	79.3 Å²	79.3	89%	0.887	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-24.2	-178.9	-70.3	-179.8	68.4	114.5	-1	113.3	I152	I152-R154 PolarHBondContact O-N 3.49Å
155	F	66.6	Low	72.1	Confident	128 Å²	128	81 Å²	81	56%	0.561	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-15.6	179.5	64	-89.5	0	0	0	114.6	L120 A153	L120-F155 HydrophobicContact CD2-CE1 3.39Å; L120-F155 HydrophobicContact CD2-CE2 4.26Å; L120-F155 HydrophobicContact CD2-CZ 3.13Å; A153-F155 HydrophobicContact CB-CD1 3.99Å; A153-F155 HydrophobicContact CB-CE1 3.47Å; A153-F155 VanDerWaalsContact CB-CE1 3.47Å; A153-F155 HydrophobicContact CB-CE2 4.32Å; A153-F155 HydrophobicContact CB-CZ 3.61Å; A153-F155 PolarHBondContact O-N 3.49Å
156	V	62.6	Low	69.9	Low	70 Å²	70	83.9 Å²	83.9	42%	0.424	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-31	-176.3	-174.8	0	0	0	0	111.9	A153	A153-V156 HydrophobicContact CB-CB 4.02Å; A153-V156 HydrophobicContact CB-CG2 3.54Å; A153-V156 PolarHBondContact O-N 3.49Å
157	Y	59.5	Low	67.8	Low	103 Å²	103	90 Å²	90	40%	0.404	45%	0.452	S	S	.	.			trans	-137.8	85.6	-176.3	-63.1	-63	0	0	0	111.8	G159 L160	Y157-G159 PolarHBondContact O-N 3.4Å; Y157-G159 VanDerWaalsContact O-N 3.12Å; Y157-L160 HydrophobicContact CD1-CD1 3.49Å; Y157-L160 VanDerWaalsContact CD1-CD1 3.49Å; Y157-L160 HydrophobicContact CD2-CD1 4.4Å; Y157-L160 HydrophobicContact CE1-CD1 4.24Å; Y157-L160 HydrophobicContact CG-CD1 3.59Å
158	P	61.5	Low	66	Low	123 Å²	123	96 Å²	96	80%	0.799	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	114.3	168.6	-13.4	27.2	0	0	0	108.8
159	G	62.2	Low	63.9	Low	86 Å²	86	93.8 Å²	93.8	89%	0.887	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.4	5.5	171.8	0	0	0	0	0	117.7	Y157	Y157-G159 PolarHBondContact O-N 3.4Å; Y157-G159 VanDerWaalsContact O-N 3.12Å
160	L	60.3	Low	61.8	Low	81 Å²	81	97.8 Å²	97.8	42%	0.424	48%	0.483	S	S	.	.			trans	-88.9	130.3	169.7	-83.3	159.6	0	0	0	110.6	I152 Y157 D164	I152-L160 HydrophobicContact CD1-CB 4.32Å; I152-L160 WeakPolarHBondContact CD1-O 2.76Å; Y157-L160 HydrophobicContact CD1-CD1 3.49Å; Y157-L160 VanDerWaalsContact CD1-CD1 3.49Å; Y157-L160 HydrophobicContact CD2-CD1 4.4Å; Y157-L160 HydrophobicContact CE1-CD1 4.24Å; Y157-L160 HydrophobicContact CG-CD1 3.59Å; L160-D164 HydrophobicContact CD2-CB 3.86Å; L160-D164 VanDerWaalsContact CD2-OD2 3.22Å; L160-D164 WeakPolarHBondContact CD2-OD2 3.25Å
161	H	58	Low	59.3	Low	105 Å²	105	99.7 Å²	99.7	49%	0.486	50%	0.498	S	S	.	.			trans	-77.3	142.6	-179.5	-168.8	-98.1	0	0	0	109.6	I152 Y163 D164	I152-H161 VanDerWaalsContact CD1-O 3.24Å; I152-H161 WeakPolarHBondContact CD1-O 3.4Å; H161-Y163 AromaticContact CE1-CD2 3.21Å; H161-Y163 WeakPolarHBondContact CE1-CD2 3.5Å; H161-Y163 AromaticContact CE1-CE2 3.54Å; H161-Y163 AromaticContact ND1-CD2 3.35Å; H161-Y163 VanDerWaalsContact ND1-CD2 3.35Å; H161-Y163 WeakPolarHBondContact ND1-CD2 2.82Å; H161-Y163 PolarHBondContact O-N 3.36Å; H161-D164 PolarHBondContact N-OD2 2.93Å; H161-D164 WeakPolarHBondContact O-CB 3.46Å; H161-D164 PolarHBondContact O-N 3.39Å
162	P	56	Low	57	Low	69 Å²	69	98.3 Å²	98.3	45%	0.448	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-44.3	-30.7	-179.9	-34.6	38	0	0	0	115.8	Y165	P162-Y165 WeakPolarHBondContact O-CD1 3.46Å; P162-Y165 WeakPolarHBondContact O-CE1 3.16Å
163	Y	54.8	Low	55.2	Low	115 Å²	115	102.9 Å²	102.9	45%	0.451	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-3.4	-177.7	-56.8	-67.9	0	0	0	115.5	H161 Y165 E166	H161-Y163 AromaticContact CE1-CD2 3.21Å; H161-Y163 WeakPolarHBondContact CE1-CD2 3.5Å; H161-Y163 AromaticContact CE1-CE2 3.54Å; H161-Y163 AromaticContact ND1-CD2 3.35Å; H161-Y163 VanDerWaalsContact ND1-CD2 3.35Å; H161-Y163 WeakPolarHBondContact ND1-CD2 2.82Å; H161-Y163 PolarHBondContact O-N 3.36Å; Y163-Y165 PolarHBondContact O-N 3.34Å; Y163-Y165 VanDerWaalsContact O-N 3.12Å; Y163-E166 PolarHBondContact O-N 3.22Å
164	D	56.9	Low	53.4	Low	63 Å²	63	109 Å²	109	34%	0.337	57%	0.568	S	S	.	*	H	α-helix	trans	-67.7	-14.2	-179.7	-63.8	-29.3	0	0	0	112.6	L160 H161 E166	L160-D164 HydrophobicContact CD2-CB 3.86Å; L160-D164 VanDerWaalsContact CD2-OD2 3.22Å; L160-D164 WeakPolarHBondContact CD2-OD2 3.25Å; H161-D164 PolarHBondContact N-OD2 2.93Å; H161-D164 WeakPolarHBondContact O-CB 3.46Å; H161-D164 PolarHBondContact O-N 3.39Å; D164-E166 VanDerWaalsContact C-N 3.33Å
165	Y	52.9	Low	51.9	Low	35 Å²	35	102.4 Å²	102.4	14%	0.137	56%	0.558	C	S	.	*	H	α-helix	trans	-69.6	-28.2	175.2	71.8	-108.4	0	0	0	112.8	P147 P162 Y163 I167 R168 M169	P147-Y165 HydrophobicContact CB-CD2 3.69Å; P147-Y165 HydrophobicContact CB-CE2 3.14Å; P147-Y165 VanDerWaalsContact O-CZ 3.23Å; P147-Y165 PolarHBondContact O-OH 3.09Å; P162-Y165 WeakPolarHBondContact O-CD1 3.46Å; P162-Y165 WeakPolarHBondContact O-CE1 3.16Å; Y163-Y165 PolarHBondContact O-N 3.34Å; Y163-Y165 VanDerWaalsContact O-N 3.12Å; Y165-I167 VanDerWaalsContact C-N 3.26Å; Y165-I167 PolarHBondContact O-N 2.81Å; Y165-R168 PolarHBondContact O-N 3.3Å; Y165-M169 WeakPolarHBondContact O-CG 3.42Å; Y165-M169 PolarHBondContact O-N 3.33Å
166	E	48.7	Very low	50.4	Low	89 Å²	89	101.8 Å²	101.8	42%	0.416	57%	0.57	S	S	.	*	H	α-helix	trans	-66	-35.7	-178.9	-68.2	-169.4	-180	0	0	110.6	Y163 D164 R168 N170	Y163-E166 PolarHBondContact O-N 3.22Å; D164-E166 VanDerWaalsContact C-N 3.33Å; E166-R168 VanDerWaalsContact C-N 3.33Å; E166-R168 PolarHBondContact O-N 3.25Å; E166-N170 VanDerWaalsContact O-CB 3.29Å; E166-N170 WeakPolarHBondContact O-CB 3.45Å; E166-N170 VanDerWaalsContact O-CG 3.28Å; E166-N170 PolarHBondContact O-N 2.8Å; E166-N170 VanDerWaalsContact O-N 3.16Å; E166-N170 PolarHBondContact O-ND2 3.16Å
167	I	48.6	Very low	49	Very low	128 Å²	128	102.6 Å²	102.6	66%	0.656	58%	0.579	S	S	*	*	H	α-helix	trans	-67.7	-37.1	177	-54.9	177.8	0	0	0	110.5	Y165 S171	Y165-I167 VanDerWaalsContact C-N 3.26Å; Y165-I167 PolarHBondContact O-N 2.81Å; I167-S171 PolarHBondContact O-N 2.69Å
168	R	50.2	Low	47.9	Very low	176 Å²	176	105.9 Å²	105.9	66%	0.664	60%	0.603	S	S	*	*	H	α-helix	trans	-76.2	-34.8	-177.4	-158.9	178.4	-158.8	170.5	6.5	113.4	Y165 E166	Y165-R168 PolarHBondContact O-N 3.3Å; E166-R168 VanDerWaalsContact C-N 3.33Å; E166-R168 PolarHBondContact O-N 3.25Å
169	M	46.5	Very low	46.4	Very low	97 Å²	97	110 Å²	110	48%	0.478	60%	0.604	S	S	.	*	H	α-helix	trans	-85.6	-24.5	-177.3	-64.5	-65.7	179.4	0	0	113.1	L125 Y165	L125-M169 HydrophobicContact CD1-CE 3.75Å; L125-M169 HydrophobicContact CD1-SD 4.39Å; Y165-M169 WeakPolarHBondContact O-CG 3.42Å; Y165-M169 PolarHBondContact O-N 3.33Å
170	N	48.8	Very low	44.9	Very low	132 Å²	132	109.3 Å²	109.3	71%	0.706	60%	0.597	S	S	*	*	S	Bend	trans	-91.9	-5.2	175.4	-64.3	-35	0	0	0	113.2	E166	E166-N170 VanDerWaalsContact O-CB 3.29Å; E166-N170 WeakPolarHBondContact O-CB 3.45Å; E166-N170 VanDerWaalsContact O-CG 3.28Å; E166-N170 PolarHBondContact O-N 2.8Å; E166-N170 VanDerWaalsContact O-N 3.16Å; E166-N170 PolarHBondContact O-ND2 3.16Å
171	S	40.1	Very low	43.6	Very low	69 Å²	69	117 Å²	117	48%	0.483	62%	0.62	S	S	.	*	S	Bend	trans	-67.6	129.9	170.2	-160	0	0	0	0	108.1	I167 N173	I167-S171 PolarHBondContact O-N 2.69Å; S171-N173 PolarHBondContact O-N 3.11Å; S171-N173 VanDerWaalsContact O-N 3.09Å
172	P	41.2	Very low	42.3	Very low	105 Å²	105	117.6 Å²	117.6	68%	0.682	63%	0.627	S	S	*	*			trans	-51.7	125.1	177	-21	29.7	0	0	0	108.5	T174	P172-T174 PolarHBondContact O-N 3.16Å; P172-T174 PolarHBondContact O-OG1 2.8Å
173	N	41.5	Very low	41.4	Very low	143 Å²	143	123 Å²	123	77%	0.765	65%	0.651	S	S	*	*			trans	-62.1	81.3	168.7	-71.2	-35.7	0	0	0	108.2	S171 S175	S171-N173 PolarHBondContact O-N 3.11Å; S171-N173 VanDerWaalsContact O-N 3.09Å; N173-S175 PolarHBondContact O-N 3.04Å; N173-S175 PolarHBondContact O-OG 3.23Å
174	T	37	Very low	40.5	Very low	136 Å²	136	127.1 Å²	127.1	83%	0.834	67%	0.671	S	S	*	*			trans	-75.2	55.4	154.6	23.4	0	0	0	0	108.1	P172 S176	P172-T174 PolarHBondContact O-N 3.16Å; P172-T174 PolarHBondContact O-OG1 2.8Å; T174-S176 PolarHBondContact O-N 3.45Å
175	S	35.5	Very low	39.3	Very low	98 Å²	98	133.4 Å²	133.4	69%	0.685	69%	0.691	S	S	*	*			trans	-75	79.2	165.8	45.1	0	0	0	0	108.2	N173	N173-S175 PolarHBondContact O-N 3.04Å; N173-S175 PolarHBondContact O-OG 3.23Å
176	S	36.8	Very low	38.3	Very low	115 Å²	115	137.4 Å²	137.4	80%	0.804	71%	0.714	S	S	*	*			trans	171.9	81	153.7	58.1	0	0	0	0	111.5	T174	T174-S176 PolarHBondContact O-N 3.45Å
177	S	31.7	Very low	37.3	Very low	87 Å²	87	144.5 Å²	144.5	61%	0.608	74%	0.739	S	S	*	*			trans	-166.4	116.7	149.6	176.5	0	0	0	0	109.3	Y179	S177-Y179 PolarHBondContact O-N 3.12Å; S177-Y179 PolarHBondContact OG-N 3.18Å; S177-Y179 PolarHBondContact OG-O 3.48Å
178	N	36.2	Very low	36.6	Very low	171 Å²	171	149 Å²	149	91%	0.914	75%	0.747	S	S	*	*	S	Bend	trans	-70.4	12.2	172.1	-77	-31.8	0	0	0	113.3
179	Y	31.2	Very low	35.7	Very low	211 Å²	211	147 Å²	147	83%	0.827	76%	0.755	S	S	*	*			trans	-134.2	102.2	175.8	-80.8	-94.5	0	0	0	109.2	S177	S177-Y179 PolarHBondContact O-N 3.12Å; S177-Y179 PolarHBondContact OG-N 3.18Å; S177-Y179 PolarHBondContact OG-O 3.48Å
180	G	31.1	Very low	35.1	Very low	71 Å²	71	146.7 Å²	146.7	73%	0.732	77%	0.768	S	S	*	*			trans	-160.5	24.8	-178.7	0	0	0	0	0	115.4	N182	G180-N182 PolarHBondContact O-N 3.26Å
181	R	31.8	Very low	34.3	Very low	242 Å²	242	147.3 Å²	147.3	91%	0.913	77%	0.771	S	S	*	*			trans	-57.3	118.3	156.4	-82.1	-172.8	-94.6	-149.4	-4.9	106.9
182	N	32.1	Very low	34.1	Very low	117 Å²	117	150.1 Å²	150.1	63%	0.626	79%	0.785	S	S	*	*			trans	125.3	62.2	164.6	-68.8	-57.1	0	0	0	116.4	G180	G180-N182 PolarHBondContact O-N 3.26Å
183	L	36.4	Very low	33.8	Very low	182 Å²	182	153.3 Å²	153.3	95%	0.953	79%	0.791	S	S	*	*			trans	-103.8	54.9	151	-151.3	78.9	0	0	0	110.8
184	K	36.5	Very low	33.1	Very low	202 Å²	202	158.1 Å²	158.1	88%	0.878	80%	0.798	S	S	*	*			trans	-132.8	71.2	155.7	-102.3	-172.1	178.2	-179.7	0	106.4
185	R	31.2	Very low	32.9	Very low	196 Å²	196	156.4 Å²	156.4	74%	0.74	80%	0.798	S	S	*	*			trans	-146	110.8	168.1	-111.4	177	173.8	132.3	-2.5	109.8
186	N	31.8	Very low	32.7	Very low	119 Å²	119	156.6 Å²	156.6	64%	0.636	80%	0.799	S	S	*	*			trans	80.3	79	147.8	-50.7	-32.2	0	0	0	118.4
187	Y	27.9	Very low	32.6	Very low	238 Å²	238	157.9 Å²	157.9	93%	0.933	80%	0.803	S	S	*	*			trans	-92.5	94.6	130.5	-66.4	-79.2	0	0	0	107.1	V189	Y187-V189 PolarHBondContact O-N 2.96Å
188	R	32.5	Very low	32.5	Very low	221 Å²	221	158.9 Å²	158.9	83%	0.834	81%	0.81	S	S	*	*			trans	-77.5	105.5	163.1	-84.7	-169.7	176.3	-170.3	-0.6	107	A190	R188-A190 PolarHBondContact O-N 3.4Å; R188-A190 VanDerWaalsContact O-N 3.09Å
189	V	31.8	Very low	32.4	Very low	136 Å²	136	156.9 Å²	156.9	82%	0.824	80%	0.803	S	S	*	*			trans	-63.3	101	159.4	177	0	0	0	0	106.7	Y187	Y187-V189 PolarHBondContact O-N 2.96Å
190	A	33.7	Very low	32.3	Very low	90 Å²	90	153.6 Å²	153.6	74%	0.744	80%	0.799	S	S	*	*			trans	-93.7	90.2	167.5	0	0	0	0	0	107.9	R188	R188-A190 PolarHBondContact O-N 3.4Å; R188-A190 VanDerWaalsContact O-N 3.09Å
191	N	31.7	Very low	32.4	Very low	145 Å²	145	158.4 Å²	158.4	78%	0.775	81%	0.806	S	S	*	*			trans	-79.2	110.8	163.9	-160.8	8.8	0	0	0	106.5
192	V	36	Very low	32.3	Very low	128 Å²	128	152.4 Å²	152.4	78%	0.776	80%	0.796	S	S	*	*			trans	-122.9	124.2	170.2	178.5	0	0	0	0	109.1
193	Q	35.2	Very low	32.3	Very low	172 Å²	172	151.7 Å²	151.7	80%	0.804	81%	0.806	S	S	*	*			trans	-66.5	129.2	-174.2	-69.8	144.7	-59.2	0	0	113
194	R	27.2	Very low	32	Very low	243 Å²	243	149.9 Å²	149.9	92%	0.917	80%	0.803	S	S	*	*				23	110.9	128.5	-162.7	-176.2	-76.2	175.7	-4.6	117.1
195	A	33.1	Very low	31.7	Very low	100 Å²	100	143.6 Å²	143.6	83%	0.826	80%	0.795	S	S	*	*			trans	-163.5	128.8	136.5	0	0	0	0	0	111.8
196	S	30.7	Very low	31.6	Very low	103 Å²	103	145.3 Å²	145.3	72%	0.72	80%	0.802	S	S	*	*			trans	-58.7	145.3	178.6	-35.1	0	0	0	0	113.9
197	T	35.5	Very low	31.8	Very low	142 Å²	142	147.1 Å²	147.1	87%	0.871	81%	0.811	S	S	*	*				168.8	143.7	109.7	41.9	0	0	0	0	112.3
198	S	28.5	Very low	31.8	Very low	108 Å²	108	142.2 Å²	142.2	76%	0.755	81%	0.806	S	S	*	*			trans	-60	151.1	-174.4	-41.4	0	0	0	0	115.9
199	T	34.1	Very low	31.8	Very low	128 Å²	128	136.6 Å²	136.6	79%	0.785	80%	0.798	S	S	*	*				167.8	115.8	112.6	-64.4	0	0	0	0	112.4
200	I	29.5	Very low	31.6	Very low	142 Å²	142	136.9 Å²	136.9	73%	0.728	80%	0.795	S	S	*	*			trans	6.2	125.8	144.8	-51.9	169.2	0	0	0	117.5
201	I	33.7	Very low	31.3	Very low	173 Å²	173	138.8 Å²	138.8	89%	0.887	79%	0.793	S	S	*	*			trans	-153.6	129.9	130.9	-87.6	145.2	0	0	0	108.6
202	T	28.8	Very low	31.4	Very low	116 Å²	116	139.3 Å²	139.3	71%	0.712	79%	0.788	S	S	*	*			trans	-85.7	136.7	-175.7	-56.4	0	0	0	0	111.9
203	A	32.3	Very low	31.1	Very low	101 Å²	101	141.8 Å²	141.8	84%	0.835	80%	0.796	S	S	*	*			trans	-152.3	98.7	152.5	0	0	0	0	0	111.5
204	V	30.4	Very low	30.7	Very low	144 Å²	144	141.6 Å²	141.6	87%	0.873	80%	0.795	S	S	*	*			trans	-6.1	130	155	-169.8	0	0	0	0	118
205	G	30.2	Very low	30.7	Very low	70 Å²	70	141 Å²	141	72%	0.722	79%	0.792	S	S	*	*			trans	172	59.3	165.8	0	0	0	0	0	118.3
206	R	30.2	Very low	30.6	Very low	232 Å²	232	143.7 Å²	143.7	88%	0.875	79%	0.791	S	S	*	*			trans	64.3	109.9	155	-63.5	-178.9	179.3	163.3	0.4	120.4
207	N	34.1	Very low	30.4	Very low	157 Å²	157	147.2 Å²	147.2	84%	0.84	79%	0.794	S	S	*	*			trans	69.1	106.1	131.6	-54.1	-25	0	0	0	120.8
208	V	28.7	Very low	30.2	Very low	136 Å²	136	146.6 Å²	146.6	82%	0.824	79%	0.792	S	S	*	*			trans	-92.4	168.5	157.2	173.7	0	0	0	0	107.3
209	P	32.4	Very low	30.3	Very low	103 Å²	103	147.6 Å²	147.6	67%	0.669	79%	0.788	S	S	*	*			cis	-136	175.7	2.3	17.2	10.2	0	0	0	116.9
210	N	27.7	Very low	30.3	Very low	142 Å²	142	149.7 Å²	149.7	76%	0.759	79%	0.789	S	S	*	*			trans	77.1	131.6	143.8	-84.1	1.6	0	0	0	121.7
211	D	28.5	Very low	30.3	Very low	129 Å²	129	149.7 Å²	149.7	69%	0.69	79%	0.786	S	S	*	*			trans	97.6	129.1	131.7	-89.9	1.2	0	0	0	120.9
212	K	32.6	Very low	30.3	Very low	157 Å²	157	147.5 Å²	147.5	68%	0.683	78%	0.776	S	S	*	*			trans	90.4	90.4	153	-65.6	161.8	-171.8	-177.7	0	116.4	H214	K212-H214 VanDerWaalsContact C-N 3.27Å; K212-H214 PolarHBondContact O-N 3.13Å
213	L	29.9	Very low	30.6	Very low	180 Å²	180	146.6 Å²	146.6	94%	0.942	77%	0.769	S	S	*	*			trans	-46.9	89.9	148.9	-69.4	168.1	0	0	0	110.4	R215	L213-R215 PolarHBondContact O-N 3.48Å
214	H	26.7	Very low	30.4	Very low	167 Å²	167	148.7 Å²	148.7	77%	0.773	77%	0.767	S	S	*	*			trans	-78.5	96.7	160.9	-82.6	-84.9	0	0	0	108.3	K212	K212-H214 VanDerWaalsContact C-N 3.27Å; K212-H214 PolarHBondContact O-N 3.13Å
215	R	28.3	Very low	30.7	Very low	231 Å²	231	145.7 Å²	145.7	87%	0.872	75%	0.752	S	S	*	*			trans	-119	100.3	157.8	-135	177.5	-169.8	176.5	3	108.3	L213 F217	L213-R215 PolarHBondContact O-N 3.48Å; R215-F217 PolarHBondContact O-N 3.11Å
216	I	29.4	Very low	30.8	Very low	156 Å²	156	151.5 Å²	151.5	80%	0.8	76%	0.757	S	S	*	*			trans	-54.1	115.3	-180	-62.7	161.2	0	0	0	109.1
217	F	26.9	Very low	30.9	Very low	177 Å²	177	148.3 Å²	148.3	78%	0.776	76%	0.758	S	S	*	*			trans	-76.4	132.4	163.5	-73.5	-87.1	0	0	0	108.5	R215 I219	R215-F217 PolarHBondContact O-N 3.11Å; F217-I219 VanDerWaalsContact C-N 3.32Å; F217-I219 HydrophobicContact CB-CG1 4.39Å; F217-I219 PolarHBondContact O-N 3.11Å
218	P	31.4	Very low	30.7	Very low	129 Å²	129	151 Å²	151	84%	0.838	76%	0.756	S	S	*	*			trans	-74.2	95.6	158.6	7.4	9	0	0	0	107	H220	P218-H220 PolarHBondContact O-N 3.17Å
219	I	30.6	Very low	30.7	Very low	130 Å²	130	154.6 Å²	154.6	67%	0.667	76%	0.761	S	S	*	*			trans	-70.2	103.6	164.5	-49.2	174.5	0	0	0	105.5	F217 E221	F217-I219 VanDerWaalsContact C-N 3.32Å; F217-I219 HydrophobicContact CB-CG1 4.39Å; F217-I219 PolarHBondContact O-N 3.11Å; I219-E221 HydrophobicContact CB-CG 4.3Å; I219-E221 HydrophobicContact CG2-CG 3.37Å; I219-E221 PolarHBondContact O-N 3.13Å
220	H	33.3	Very low	30.9	Very low	172 Å²	172	158.2 Å²	158.2	80%	0.796	77%	0.767	S	S	*	*			trans	-80.6	80.8	164.2	-160.4	-72.5	0	0	0	107.3	P218 N222	P218-H220 PolarHBondContact O-N 3.17Å; H220-N222 VanDerWaalsContact C-N 3.31Å; H220-N222 PolarHBondContact O-N 3.48Å
221	E	31	Very low	31	Very low	142 Å²	142	156.6 Å²	156.6	66%	0.664	76%	0.762	S	S	*	*			trans	-64.4	94.5	166.2	-63	-171.2	160.7	0	0	107.8	I219 V223	I219-E221 HydrophobicContact CB-CG 4.3Å; I219-E221 HydrophobicContact CG2-CG 3.37Å; I219-E221 PolarHBondContact O-N 3.13Å; E221-V223 HydrophobicContact CB-CG2 4.1Å; E221-V223 PolarHBondContact O-N 3.38Å; E221-V223 VanDerWaalsContact O-N 3.09Å
222	N	32.1	Very low	31.2	Very low	127 Å²	127	159.7 Å²	159.7	68%	0.679	77%	0.772	S	S	*	*			trans	-78.9	84	156.8	-172.6	9.5	0	0	0	106.9	H220 N224	H220-N222 VanDerWaalsContact C-N 3.31Å; H220-N222 PolarHBondContact O-N 3.48Å; N222-N224 PolarHBondContact O-N 2.81Å
223	V	35.3	Very low	31	Very low	96 Å²	96	162.1 Å²	162.1	58%	0.582	78%	0.777	S	S	*	*			trans	-64.2	87.1	163.2	-175.9	0	0	0	0	106.8	E221 S225	E221-V223 HydrophobicContact CB-CG2 4.1Å; E221-V223 PolarHBondContact O-N 3.38Å; E221-V223 VanDerWaalsContact O-N 3.09Å; V223-S225 VanDerWaalsContact CG1-OG 3.26Å; V223-S225 WeakPolarHBondContact CG1-OG 3.39Å; V223-S225 PolarHBondContact O-N 3.5Å
224	N	29.4	Very low	31.2	Very low	146 Å²	146	160.1 Å²	160.1	78%	0.781	77%	0.768	S	S	*	*			trans	-74.9	74.5	164	-162.5	16.1	0	0	0	107.4	N222	N222-N224 PolarHBondContact O-N 2.81Å
225	S	35.9	Very low	31.7	Very low	81 Å²	81	158 Å²	158	57%	0.566	77%	0.766	S	S	*	*			trans	-129.1	99.2	169.2	79.5	0	0	0	0	110.2	V223	V223-S225 VanDerWaalsContact CG1-OG 3.26Å; V223-S225 WeakPolarHBondContact CG1-OG 3.39Å; V223-S225 PolarHBondContact O-N 3.5Å
226	K	33	Very low	32.1	Very low	191 Å²	191	153.4 Å²	153.4	83%	0.83	76%	0.758	S	S	*	*			trans	35.6	94.6	138	-61.2	174	179.2	175.5	0	115.9
227	N	31.4	Very low	32.4	Very low	166 Å²	166	153.1 Å²	153.1	89%	0.888	76%	0.758	S	S	*	*			trans	160.2	103.7	136.3	-87.7	-24.4	0	0	0	111.9
228	W	30.4	Very low	32.8	Very low	213 Å²	213	147.6 Å²	147.6	81%	0.807	75%	0.751	S	S	*	*			trans	-156	47.3	159.3	167.8	-103.6	0	0	0	111.6
229	F	28.5	Very low	32.9	Very low	211 Å²	211	149.1 Å²	149.1	93%	0.925	75%	0.752	S	S	*	*			trans	-107.7	89.4	159.9	-96	-81.1	0	0	0	108.5
230	K	35.7	Very low	33.4	Very low	180 Å²	180	147.8 Å²	147.8	78%	0.783	75%	0.754	S	S	*	*			trans	175.9	128	142	-112.8	170.8	173.8	174.7	0	113.3
231	T	29.8	Very low	33.5	Very low	108 Å²	108	145.4 Å²	145.4	66%	0.663	75%	0.752	S	S	*	*			trans	83.3	83.9	143.6	-35.9	0	0	0	0	117.6
232	Q	33.4	Very low	33.9	Very low	194 Å²	194	144.2 Å²	144.2	91%	0.907	75%	0.754	S	S	*	*				-127	95.4	128.4	-81	-146.4	-36.9	0	0	108.5
233	R	29.3	Very low	33.9	Very low	208 Å²	208	146.5 Å²	146.5	79%	0.785	76%	0.761	S	S	*	*			trans	-106.2	140.2	159.8	-145.1	-171.6	-78.2	161.7	-6.9	104.2
234	D	34	Very low	33.7	Very low	138 Å²	138	147.2 Å²	147.2	74%	0.738	77%	0.77	S	S	*	*			trans	76.6	113.5	170.4	-38.2	-38.3	0	0	0	112.3
235	V	36.2	Very low	33.9	Very low	122 Å²	122	144.6 Å²	144.6	74%	0.739	77%	0.768	S	S	*	*				-169.9	119	63.6	154.5	0	0	0	0	109.1
236	L	37.1	Very low	33.6	Very low	134 Å²	134	145.9 Å²	145.9	70%	0.702	78%	0.777	S	S	*	*			trans	55.8	116.6	132.8	-62.8	158.1	0	0	0	120.7
237	N	35.1	Very low	33.6	Very low	150 Å²	150	142 Å²	142	80%	0.802	77%	0.77	S	S	*	*				67.5	132.9	126.5	-54.3	-10.3	0	0	0	118.7
238	G	35.4	Very low	33.6	Very low	61 Å²	61	139.8 Å²	139.8	63%	0.629	76%	0.758	S	S	*	*			cis	-175.3	163.9	4.1	0	0	0	0	0	109.7
239	D	34.2	Very low	33.7	Very low	161 Å²	161	136.7 Å²	136.7	86%	0.861	76%	0.757	S	S	*	*			trans	50.5	119.2	144.7	-55.7	-17.8	0	0	0	117.5
240	S	39.8	Very low	33.8	Very low	102 Å²	102	132.1 Å²	132.1	71%	0.713	75%	0.752	S	S	*	*			cis	178.2	137.4	43.5	43.3	0	0	0	0	110.9
241	V	37.2	Very low	33.9	Very low	123 Å²	123	128.9 Å²	128.9	75%	0.745	75%	0.749	S	S	*	*				77.7	111.3	124	172.7	0	0	0	0	120.2
242	V	38.9	Very low	34	Very low	116 Å²	116	132.7 Å²	132.7	70%	0.703	76%	0.759	S	S	*	*				63.9	130.1	127.3	-178.1	0	0	0	0	116.3
243	E	32	Very low	33.9	Very low	176 Å²	176	129.3 Å²	129.3	82%	0.822	75%	0.752	S	S	*	*			cis	-163.1	155.2	28.1	-145.1	155.7	177.8	0	0	111
244	S	31.1	Very low	34	Very low	111 Å²	111	126.7 Å²	126.7	78%	0.776	75%	0.751	S	S	*	*			trans	-33.2	163.4	166.9	-49.3	0	0	0	0	121.3
245	A	32.6	Very low	33.7	Very low	90 Å²	90	123 Å²	123	74%	0.744	75%	0.745	S	S	*	*			trans	98.8	97.8	151.3	0	0	0	0	0	115.5
246	S	29.6	Very low	33.6	Very low	109 Å²	109	125.9 Å²	125.9	76%	0.762	75%	0.748	S	S	*	*				51.8	100.9	85.4	164.6	0	0	0	0	112
247	T	33.6	Very low	33.4	Very low	110 Å²	110	130.1 Å²	130.1	68%	0.675	76%	0.756	S	S	*	*				-172.7	127.8	113.5	55.3	0	0	0	0	106.1
248	N	31.4	Very low	33	Very low	119 Å²	119	134.1 Å²	134.1	64%	0.636	76%	0.76	S	S	*	*				94.8	124.8	100.7	73.8	-19.2	0	0	0	115.3
249	N	33.8	Very low	32.8	Very low	147 Å²	147	139.3 Å²	139.3	79%	0.786	77%	0.768	S	S	*	*			trans	87.7	110.2	145	-49	-30	0	0	0	120.1
250	S	29.5	Very low	32.7	Very low	116 Å²	116	138.1 Å²	138.1	81%	0.811	76%	0.762	S	S	*	*			trans	-50	-172.5	163.1	-54.2	0	0	0	0	115.7
251	P	38.3	Very low	32.4	Very low	111 Å²	111	140.2 Å²	140.2	72%	0.721	76%	0.764	S	S	*	*				-135.1	148.8	-60.9	36.6	-20.8	0	0	0	111.7
252	E	31	Very low	31.9	Very low	188 Å²	188	141.1 Å²	141.1	88%	0.879	77%	0.765	S	S	*	*			trans	-167.9	118.4	159.7	-113.2	157.4	-152.4	0	0	114.1
253	V	31.9	Very low	31.6	Very low	124 Å²	124	143.2 Å²	143.2	75%	0.752	77%	0.772	S	S	*	*				70.4	138.9	126.8	-177.7	0	0	0	0	119.5
254	I	31.9	Very low	31.6	Very low	153 Å²	153	139.5 Å²	139.5	79%	0.785	77%	0.772	S	S	*	*			trans	89.4	103.5	167.7	-49	161.6	0	0	0	112.6
255	G	27.8	Very low	31.6	Very low	59 Å²	59	141.5 Å²	141.5	61%	0.608	77%	0.774	S	S	*	*			cis	89.7	96.5	46.3	0	0	0	0	0	109.1
256	K	33.7	Very low	31.5	Very low	184 Å²	184	144.6 Å²	144.6	80%	0.8	78%	0.778	S	S	*	*			trans	159.4	154.8	149.7	-85.7	157.6	-170.1	-171.3	0	111.2
257	Y	32.1	Very low	31.5	Very low	223 Å²	223	148.1 Å²	148.1	88%	0.875	78%	0.782	S	S	*	*			trans	94.6	79.4	171.4	-58.2	-78.1	0	0	0	117.5
258	R	27.1	Very low	31.2	Very low	234 Å²	234	153.2 Å²	153.2	88%	0.883	80%	0.795	S	S	*	*			trans	-72	135.3	131.3	-88	-179.2	170.1	163.2	-2.8	107.4
259	E	31.8	Very low	31.2	Very low	170 Å²	170	152.7 Å²	152.7	79%	0.794	80%	0.796	S	S	*	*				169.9	153.2	127.2	-94.5	170.1	-162.8	0	0	110.3
260	N	31.2	Very low	30.9	Very low	136 Å²	136	151.7 Å²	151.7	73%	0.727	80%	0.798	S	S	*	*			trans	87.9	131.8	168.1	-55.9	-39.9	0	0	0	116.6
261	L	33.1	Very low	31	Very low	146 Å²	146	155.8 Å²	155.8	76%	0.764	80%	0.801	S	S	*	*			cis	-165.8	143.5	-5.1	-118.4	154.6	0	0	0	104.8
262	N	28.3	Very low	30.6	Very low	142 Å²	142	158.8 Å²	158.8	76%	0.759	81%	0.806	S	S	*	*			trans	-57.4	142.2	164.3	-61.8	-41.3	0	0	0	109.1
263	D	31	Very low	30.4	Very low	159 Å²	159	159.3 Å²	159.3	85%	0.85	81%	0.808	S	S	*	*			trans	164.5	105.4	136.3	-82.9	-19.2	0	0	0	109.5
264	A	33.4	Very low	30.3	Very low	99 Å²	99	158.7 Å²	158.7	82%	0.818	81%	0.807	S	S	*	*			trans	-179.6	100.2	140.1	0	0	0	0	0	108.8
265	N	29.9	Very low	30.1	Very low	153 Å²	153	159.2 Å²	159.2	82%	0.818	81%	0.81	S	S	*	*			trans	-38.7	139.8	151.6	-70	-37.6	0	0	0	110.4
266	N	31.8	Very low	30.1	Very low	155 Å²	155	164.6 Å²	164.6	83%	0.829	82%	0.824	S	S	*	*			trans	-172	108	132.7	-85.2	-23.5	0	0	0	111.8
267	Q	29.9	Very low	30	Very low	182 Å²	182	163.3 Å²	163.3	85%	0.85	83%	0.825	S	S	*	*			trans	29.8	113.2	142.9	-80.7	165.6	-7.6	0	0	119.9
268	F	25.8	Very low	30.1	Very low	218 Å²	218	159.1 Å²	159.1	96%	0.956	82%	0.822	S	S	*	*			trans	-70.9	131.8	157.9	-85.3	-94.7	0	0	0	111.3
269	T	31.2	Very low	30.4	Very low	107 Å²	107	151.5 Å²	151.5	66%	0.656	80%	0.801	S	S	*	*			trans	-118.7	133	157.6	51.3	0	0	0	0	108.8	F271	T269-F271 PolarHBondContact O-N 2.87Å
270	P	28.8	Very low	30.3	Very low	127 Å²	127	146 Å²	146	83%	0.825	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-77.5	123.3	-174.6	30	-30.4	0	0	0	110.8
271	F	31.2	Very low	30.5	Very low	201 Å²	201	145 Å²	145	88%	0.882	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-82.7	126.3	175.3	-103.7	-89.4	0	0	0	111.2	T269	T269-F271 PolarHBondContact O-N 2.87Å
272	Q	29.9	Very low	30.7	Very low	175 Å²	175	145.1 Å²	145.1	82%	0.818	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-69.1	138.3	167.6	-74	159.3	-58.5	0	0	110.4	P274	Q272-P274 WeakPolarHBondContact O-CD 3.42Å
273	E	26.5	Very low	31	Very low	198 Å²	198	143.8 Å²	143.8	93%	0.925	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-53.4	136.8	173	-85.7	177.4	144.8	0	0	112.6
274	P	29.5	Very low	31.2	Very low	111 Å²	111	141.3 Å²	141.3	72%	0.721	76%	0.756	S	S	*	*			trans	-123.7	117	155.3	16.3	5.7	0	0	0	112.9	Q272	Q272-P274 WeakPolarHBondContact O-CD 3.42Å
275	L	28.2	Very low	31.5	Very low	164 Å²	164	144.1 Å²	144.1	86%	0.859	75%	0.746	S	S	*	*			trans	62.8	112.4	138.1	-54.8	179.6	0	0	0	119.7	I277	L275-I277 PolarHBondContact O-N 2.72Å
276	L	28.5	Very low	31.6	Very low	172 Å²	172	142.5 Å²	142.5	90%	0.901	74%	0.743	S	S	*	*			trans	-45.3	119.5	172.5	-59.9	171.8	0	0	0	113.4	V278	L276-V278 PolarHBondContact O-N 3.32Å
277	I	31	Very low	31.8	Very low	158 Å²	158	142.3 Å²	142.3	81%	0.81	74%	0.741	S	S	*	*			trans	-81.1	112.5	164.3	-63	173.4	0	0	0	107.7	L275 V279	L275-I277 PolarHBondContact O-N 2.72Å; I277-V279 PolarHBondContact O-N 3.32Å
278	V	33.6	Very low	32	Very low	134 Å²	134	139.9 Å²	139.9	81%	0.812	73%	0.734	S	S	*	*			trans	-71.5	108.4	174	178.7	0	0	0	0	108.9	L276	L276-V278 PolarHBondContact O-N 3.32Å
279	V	33.5	Very low	32.2	Very low	74 Å²	74	135.6 Å²	135.6	45%	0.448	73%	0.726	S	S	.	*			trans	-83.1	130.3	174.2	179.1	0	0	0	0	109.4	I277 L283 L284	I277-V279 PolarHBondContact O-N 3.32Å; V279-L283 HydrophobicContact CG1-CB 4.05Å; V279-L284 HydrophobicContact CG1-CD2 4.37Å
280	P	29.4	Very low	32.1	Very low	56 Å²	56	138.1 Å²	138.1	36%	0.364	74%	0.735	S	S	.	*			trans	-58.8	138.6	178.5	-25.4	33.9	0	0	0	113.3	H282 L283	P280-H282 WeakPolarHBondContact CB-CE1 3.29Å; P280-H282 WeakPolarHBondContact CB-ND1 3.42Å; P280-H282 PolarHBondContact O-N 3.22Å; P280-L283 PolarHBondContact O-N 3.05Å
281	P	36.8	Very low	32.3	Very low	114 Å²	114	139.5 Å²	139.5	74%	0.74	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-14.1	-172	3.5	-8.9	0	0	0	115.6
282	H	37.8	Very low	32.3	Very low	148 Å²	148	137.1 Å²	137.1	69%	0.685	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-7	176.9	61	-91	0	0	0	113.9	P280	P280-H282 WeakPolarHBondContact CB-CE1 3.29Å; P280-H282 WeakPolarHBondContact CB-ND1 3.42Å; P280-H282 PolarHBondContact O-N 3.22Å
283	L	33.9	Very low	32.3	Very low	114 Å²	114	137.9 Å²	137.9	60%	0.597	73%	0.734	S	S	*	*	S	Bend	trans	-104.8	-0.7	175.9	-61.7	-179.3	0	0	0	112.9	V279 P280	V279-L283 HydrophobicContact CG1-CB 4.05Å; P280-L283 PolarHBondContact O-N 3.05Å
284	L	35.6	Very low	32.4	Very low	107 Å²	107	131.9 Å²	131.9	56%	0.56	72%	0.724	S	S	*	*			trans	-86	118.1	175.8	-66.4	173.3	0	0	0	109.5	V279	V279-L284 HydrophobicContact CG1-CD2 4.37Å
285	R	38.6	Very low	32.3	Very low	159 Å²	159	135.6 Å²	135.6	60%	0.6	73%	0.732	S	S	*	*			trans	-82.6	147.6	172.1	-63.7	-173	-159.3	-177.2	8.6	109.4	L287 D288	R285-L287 PolarHBondContact O-N 3.42Å; R285-D288 PolarHBondContact O-N 2.97Å
286	P	31.3	Very low	32.5	Very low	119 Å²	119	138.4 Å²	138.4	77%	0.773	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	26	-178.6	-23.1	34.4	0	0	0	117.6
287	L	36.2	Very low	32.5	Very low	150 Å²	150	137.7 Å²	137.7	79%	0.785	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.2	2.9	178	-148.9	68.3	0	0	0	114.9	R285	R285-L287 PolarHBondContact O-N 3.42Å
288	D	34.6	Very low	32.7	Very low	132 Å²	132	139.5 Å²	139.5	71%	0.706	73%	0.731	S	S	*	*	S	Bend	trans	-103.4	19.1	-179.5	-67.9	-37.7	0	0	0	114.1	R285	R285-D288 PolarHBondContact O-N 2.97Å
289	T	30.4	Very low	32.7	Very low	127 Å²	127	136.5 Å²	136.5	78%	0.779	72%	0.716	S	S	*	*			trans	-114.2	55.7	180	-23.7	0	0	0	0	111.7
290	L	29.8	Very low	32.9	Very low	160 Å²	160	135.6 Å²	135.6	84%	0.838	72%	0.722	S	S	*	*			trans	-145.7	44.6	177.9	-83.8	180	0	0	0	114.2
291	I	31.5	Very low	33.3	Very low	157 Å²	157	139.3 Å²	139.3	81%	0.805	73%	0.734	S	S	*	*	S	Bend	trans	-146.2	85.6	150.8	-50.8	177.7	0	0	0	107.2
292	N	31.6	Very low	33.2	Very low	150 Å²	150	137.6 Å²	137.6	80%	0.802	73%	0.73	S	S	*	*	S	Bend	trans	172.5	105.2	146.8	-83.7	-19.3	0	0	0	108.4
293	E	30.3	Very low	33.1	Very low	192 Å²	192	136.8 Å²	136.8	90%	0.897	72%	0.722	S	S	*	*			trans	61.4	124.4	155.1	-56.1	-165.6	150.2	0	0	120.5
294	G	28.7	Very low	33.4	Very low	71 Å²	71	135.5 Å²	135.5	73%	0.732	72%	0.715	S	S	*	*			trans	84.8	95.8	139.2	0	0	0	0	0	117.5	R296	G294-R296 PolarHBondContact O-N 3.16Å
295	Q	27.9	Very low	33.5	Very low	189 Å²	189	138.9 Å²	138.9	88%	0.883	72%	0.722	S	S	*	*			trans	26.2	100.9	134.7	-71.8	-93.1	-43.8	0	0	116.7
296	R	31.7	Very low	33.4	Very low	224 Å²	224	140.6 Å²	140.6	85%	0.845	73%	0.728	S	S	*	*			trans	-177	117.6	135	-101.3	166.9	-150	-159.3	7.9	112.1	G294 F298	G294-R296 PolarHBondContact O-N 3.16Å; R296-F298 PolarHBondContact O-N 3.48Å
297	N	29.2	Very low	33.9	Very low	156 Å²	156	139.7 Å²	139.7	83%	0.834	72%	0.716	S	S	*	*			trans	-24.7	107.9	158	-52	-30.6	0	0	0	114.1
298	F	33.7	Very low	34.1	Very low	196 Å²	196	137.7 Å²	137.7	86%	0.86	71%	0.706	S	S	*	*			trans	-137	119.7	154.3	-85.7	-78.8	0	0	0	109.6	R296	R296-F298 PolarHBondContact O-N 3.48Å
299	S	34.5	Very low	34.4	Very low	72 Å²	72	135.7 Å²	135.7	50%	0.503	70%	0.699	S	S	.	*			trans	-59.2	151.7	-172.3	39.6	0	0	0	0	112.9	E301	S299-E301 WeakPolarHBondContact CB-OE1 3.4Å; S299-E301 PolarHBondContact O-N 3.19Å; S299-E301 PolarHBondContact OG-OE1 3.32Å
300	G	38	Very low	34.6	Very low	55 Å²	55	133 Å²	133	57%	0.567	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	41.8	176.4	0	0	0	0	0	115.4	N304	G300-N304 PolarHBondContact O-ND2 3.09Å
301	E	37.2	Very low	34.7	Very low	134 Å²	134	131.9 Å²	131.9	63%	0.626	70%	0.697	S	S	*	*	H	α-helix	trans	-75.9	-31.6	-177.5	-74.5	167.6	-155.6	0	0	112.4	S299 Y303 N304 Y305	S299-E301 WeakPolarHBondContact CB-OE1 3.4Å; S299-E301 PolarHBondContact O-N 3.19Å; S299-E301 PolarHBondContact OG-OE1 3.32Å; E301-Y303 PolarHBondContact O-N 3.4Å; E301-N304 PolarHBondContact O-N 3.33Å; E301-Y305 PolarHBondContact O-N 3.34Å; E301-Y305 VanDerWaalsContact O-N 3.09Å
302	A	34.8	Very low	35	Very low	78 Å²	78	128.5 Å²	128.5	65%	0.645	69%	0.692	S	S	*	*	H	α-helix	trans	-68.7	-33	-177.8	0	0	0	0	0	113.7
303	Y	34.9	Very low	35	Very low	131 Å²	131	130.7 Å²	130.7	51%	0.514	70%	0.698	S	S	.	*	H	α-helix	trans	-77.1	-31.6	176	-172.2	-100.1	0	0	0	112	E301 L307	E301-Y303 PolarHBondContact O-N 3.4Å; Y303-L307 HydrophobicContact CD1-CD1 4.09Å; Y303-L307 HydrophobicContact CE1-CD1 3.67Å
304	N	40.7	Very low	35.2	Very low	86 Å²	86	126.3 Å²	126.3	46%	0.46	69%	0.688	S	S	.	*	H	α-helix	trans	-75.1	-24.3	177.3	-74.2	-49.7	0	0	0	113.1	G300 E301 N308	G300-N304 PolarHBondContact O-ND2 3.09Å; E301-N304 PolarHBondContact O-N 3.33Å; N304-N308 WeakPolarHBondContact O-CB 3.43Å; N304-N308 PolarHBondContact O-N 3.41Å; N304-N308 PolarHBondContact O-ND2 3.23Å
305	Y	38.8	Very low	35.4	Very low	178 Å²	178	131.6 Å²	131.6	70%	0.698	69%	0.691	S	S	*	*	H	α-helix	trans	-67.6	-37.6	176.4	-163.3	-96.1	0	0	0	112.5	E301 N308 T309	E301-Y305 PolarHBondContact O-N 3.34Å; E301-Y305 VanDerWaalsContact O-N 3.09Å; Y305-N308 PolarHBondContact O-N 3.06Å; Y305-T309 HydrophobicContact CD1-CG2 4.46Å; Y305-T309 HydrophobicContact CE1-CG2 4.27Å; Y305-T309 WeakPolarHBondContact O-CG2 3.31Å
306	W	36.4	Very low	35.8	Very low	196 Å²	196	130.4 Å²	130.4	74%	0.742	69%	0.69	S	S	*	*	H	α-helix	trans	-70.3	-36.3	179.2	-171.2	66.5	0	0	0	112.7	N308 T309	W306-N308 VanDerWaalsContact C-N 3.31Å; W306-N308 PolarHBondContact O-N 3.1Å; W306-T309 PolarHBondContact O-OG1 3.46Å; W306-T309 VanDerWaalsContact O-OG1 3.05Å
307	L	42	Very low	36	Very low	100 Å²	100	126 Å²	126	52%	0.524	68%	0.682	S	S	.	*	H	α-helix	trans	-73.9	-18.6	176.6	-69.3	169.4	0	0	0	113.7	Y303	Y303-L307 HydrophobicContact CD1-CD1 4.09Å; Y303-L307 HydrophobicContact CE1-CD1 3.67Å
308	N	40.6	Very low	36.2	Very low	107 Å²	107	127.9 Å²	127.9	57%	0.572	69%	0.686	S	S	*	*	H	α-helix	trans	-92	-8	-179.3	-79.6	-33.8	0	0	0	114.8	N304 Y305 W306 G310 T311	N304-N308 WeakPolarHBondContact O-CB 3.43Å; N304-N308 PolarHBondContact O-N 3.41Å; N304-N308 PolarHBondContact O-ND2 3.23Å; Y305-N308 PolarHBondContact O-N 3.06Å; W306-N308 VanDerWaalsContact C-N 3.31Å; W306-N308 PolarHBondContact O-N 3.1Å; N308-G310 VanDerWaalsContact C-N 3.3Å; N308-G310 PolarHBondContact O-N 3.39Å; N308-T311 PolarHBondContact O-OG1 3.43Å
309	T	39.4	Very low	36.4	Very low	91 Å²	91	124.8 Å²	124.8	56%	0.558	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	8.4	-176.6	51.3	0	0	0	0	114.8	Y305 W306 T311	Y305-T309 HydrophobicContact CD1-CG2 4.46Å; Y305-T309 HydrophobicContact CE1-CG2 4.27Å; Y305-T309 WeakPolarHBondContact O-CG2 3.31Å; W306-T309 PolarHBondContact O-OG1 3.46Å; W306-T309 VanDerWaalsContact O-OG1 3.05Å; T309-T311 VanDerWaalsContact C-N 3.34Å; T309-T311 PolarHBondContact O-N 3.03Å
310	G	35	Very low	36.3	Very low	71 Å²	71	125.6 Å²	125.6	73%	0.732	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	8.6	174.6	0	0	0	0	0	115.7	N308 A312	N308-G310 VanDerWaalsContact C-N 3.3Å; N308-G310 PolarHBondContact O-N 3.39Å; G310-A312 VanDerWaalsContact C-N 3.26Å; G310-A312 PolarHBondContact O-N 2.89Å
311	T	32.8	Very low	36.1	Very low	136 Å²	136	129.6 Å²	129.6	83%	0.834	70%	0.698	S	S	*	*			trans	-81.5	67.1	179.1	41.7	0	0	0	0	111.7	N308 T309	N308-T311 PolarHBondContact O-OG1 3.43Å; T309-T311 VanDerWaalsContact C-N 3.34Å; T309-T311 PolarHBondContact O-N 3.03Å
312	A	36.6	Very low	35.9	Very low	85 Å²	85	126.4 Å²	126.4	70%	0.702	70%	0.7	S	S	*	*			trans	-115.3	118.8	164.5	0	0	0	0	0	108.8	G310 S314	G310-A312 VanDerWaalsContact C-N 3.26Å; G310-A312 PolarHBondContact O-N 2.89Å; A312-S314 PolarHBondContact O-N 2.91Å
313	Q	33	Very low	36	Very low	197 Å²	197	127.4 Å²	127.4	92%	0.921	69%	0.694	S	S	*	*			trans	-51.5	111.4	-172.2	-62.1	179.7	3.6	0	0	112.8
314	S	32.9	Very low	36.2	Very low	99 Å²	99	129.9 Å²	129.9	69%	0.692	71%	0.71	S	S	*	*			trans	-105.9	77.8	166	68.7	0	0	0	0	109.9	A312	A312-S314 PolarHBondContact O-N 2.91Å
315	K	33.9	Very low	36.2	Very low	183 Å²	183	133.7 Å²	133.7	80%	0.796	73%	0.726	S	S	*	*			trans	-84.1	135.6	146.5	-70.7	178	177.9	177.9	0	104.9
316	D	36.1	Very low	35.9	Very low	163 Å²	163	129.3 Å²	129.3	87%	0.872	71%	0.712	S	S	*	*	S	Bend	trans	91.9	38	174.6	-47.7	-28.3	0	0	0	119.1
317	I	35.9	Very low	36	Very low	132 Å²	132	123.9 Å²	123.9	68%	0.677	71%	0.705	S	S	*	*			trans	-126.5	102.5	156.8	-55.5	177.4	0	0	0	109.4	L319	I317-L319 PolarHBondContact O-N 3.31Å
318	Q	33.6	Very low	35.8	Very low	196 Å²	196	127.8 Å²	127.8	92%	0.916	71%	0.712	S	S	*	*			trans	-68.1	110	166.3	-77.4	-178.7	0.5	0	0	108.8
319	L	38.1	Very low	35.5	Very low	130 Å²	130	130.2 Å²	130.2	68%	0.681	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-74.6	137.4	168.4	-79.7	152.5	0	0	0	109.5	I317 L323	I317-L319 PolarHBondContact O-N 3.31Å; L319-L323 HydrophobicContact CD2-CD1 4.44Å
320	P	32.9	Very low	35.3	Very low	89 Å²	89	127.9 Å²	127.9	58%	0.578	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-64.7	143.4	177.8	25	-31.4	0	0	0	111.4	G322	P320-G322 PolarHBondContact O-N 3.04Å
321	P	31.8	Very low	35.4	Very low	140 Å²	140	127.4 Å²	127.4	91%	0.909	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	119	-178.2	26.9	-30.8	0	0	0	109.4
322	G	32.9	Very low	35.8	Very low	66 Å²	66	125.4 Å²	125.4	68%	0.68	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	144.4	-8.8	-176.1	0	0	0	0	0	114.9	P320	P320-G322 PolarHBondContact O-N 3.04Å
323	L	37.2	Very low	35.8	Very low	99 Å²	99	125.1 Å²	125.1	52%	0.518	66%	0.658	S	S	.	*			trans	-95.2	10.5	176.7	-112.6	143.3	0	0	0	113.8	L319 M326	L319-L323 HydrophobicContact CD2-CD1 4.44Å; L323-M326 HydrophobicContact CD2-CE 3.8Å; L323-M326 HydrophobicContact CD2-SD 3.94Å; L323-M326 HydrophobicContact CG-SD 4.5Å
324	E	40.5	Very low	36.2	Very low	183 Å²	183	117.4 Å²	117.4	86%	0.855	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-84	-12	-180	-119.3	173.2	176.5	0	0	113.5
325	E	40.5	Very low	36.7	Very low	167 Å²	167	119.4 Å²	119.4	78%	0.78	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-87.8	-0.8	-178.9	-90.9	-176.9	159	0	0	114.8	S327	E325-S327 VanDerWaalsContact C-N 3.29Å; E325-S327 PolarHBondContact O-N 3.18Å
326	M	33.1	Very low	37.3	Very low	85 Å²	85	113.7 Å²	113.7	42%	0.419	62%	0.615	S	S	.	*	G	3₁₀ helix	trans	-87.8	14.1	-178.9	-86.2	134	88.1	0	0	114.6	L323 W328 W329	L323-M326 HydrophobicContact CD2-CE 3.8Å; L323-M326 HydrophobicContact CD2-SD 3.94Å; L323-M326 HydrophobicContact CG-SD 4.5Å; M326-W328 PolarHBondContact O-N 2.99Å; M326-W329 HydrophobicContact CB-CD2 4.4Å; M326-W329 HydrophobicContact CB-CG 4.39Å; M326-W329 HydrophobicContact CE-CH2 3.82Å; M326-W329 HydrophobicContact CE-CZ2 4.11Å; M326-W329 HydrophobicContact CE-CZ3 4.06Å; M326-W329 HydrophobicContact CG-CD2 3.78Å; M326-W329 HydrophobicContact CG-CE3 4.37Å; M326-W329 HydrophobicContact CG-CG 4.17Å; M326-W329 HydrophobicContact CG-CH2 4.24Å; M326-W329 HydrophobicContact CG-CZ2 3.62Å; M326-W329 PolarHBondContact O-N 3.38Å; M326-W329 HydrophobicContact SD-CH2 4.44Å; M326-W329 HydrophobicContact SD-CZ2 4.13Å
327	S	38	Very low	37.6	Very low	83 Å²	83	112.2 Å²	112.2	58%	0.58	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-67.2	-21.6	173.5	70.2	0	0	0	0	113.5	E325	E325-S327 VanDerWaalsContact C-N 3.29Å; E325-S327 PolarHBondContact O-N 3.18Å
328	W	37.2	Very low	38	Very low	181 Å²	181	110.6 Å²	110.6	69%	0.686	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-83.3	-9.3	-178.3	-66.1	82.5	0	0	0	114.4	M326 A330 D331 T332	M326-W328 PolarHBondContact O-N 2.99Å; W328-A330 VanDerWaalsContact C-N 3.29Å; W328-A330 PolarHBondContact O-N 3.44Å; W328-D331 PolarHBondContact O-N 3.44Å; W328-T332 PolarHBondContact O-N 2.83Å; W328-T332 PolarHBondContact O-OG1 3.03Å
329	W	34.1	Very low	38.8	Very low	159 Å²	159	109.8 Å²	109.8	60%	0.602	59%	0.59	S	S	*	*	H	α-helix	trans	-72.3	-26.8	-173.9	-72.7	29.4	0	0	0	112.1	M326 I333	M326-W329 HydrophobicContact CB-CD2 4.4Å; M326-W329 HydrophobicContact CB-CG 4.39Å; M326-W329 HydrophobicContact CE-CH2 3.82Å; M326-W329 HydrophobicContact CE-CZ2 4.11Å; M326-W329 HydrophobicContact CE-CZ3 4.06Å; M326-W329 HydrophobicContact CG-CD2 3.78Å; M326-W329 HydrophobicContact CG-CE3 4.37Å; M326-W329 HydrophobicContact CG-CG 4.17Å; M326-W329 HydrophobicContact CG-CH2 4.24Å; M326-W329 HydrophobicContact CG-CZ2 3.62Å; M326-W329 PolarHBondContact O-N 3.38Å; M326-W329 HydrophobicContact SD-CH2 4.44Å; M326-W329 HydrophobicContact SD-CZ2 4.13Å; W329-I333 WeakPolarHBondContact O-CG1 3.23Å; W329-I333 PolarHBondContact O-N 3.26Å
330	A	34.5	Very low	38.8	Very low	41 Å²	41	107.7 Å²	107.7	34%	0.339	58%	0.579	S	S	.	*	H	α-helix	trans	-69.2	-42.1	176.7	0	0	0	0	0	111.9	W328 S334	W328-A330 VanDerWaalsContact C-N 3.29Å; W328-A330 PolarHBondContact O-N 3.44Å; A330-S334 WeakPolarHBondContact O-CB 3.48Å; A330-S334 PolarHBondContact O-N 3.12Å; A330-S334 VanDerWaalsContact O-N 3.1Å
331	D	39.2	Very low	39.1	Very low	61 Å²	61	109.1 Å²	109.1	33%	0.326	58%	0.582	S	S	.	*	H	α-helix	trans	-73.9	-40.4	-175.9	-63.1	-26.6	0	0	0	111.4	W328 I333 S334 D335 R342	W328-D331 PolarHBondContact O-N 3.44Å; D331-I333 PolarHBondContact O-N 3.26Å; D331-S334 PolarHBondContact O-N 3.46Å; D331-D335 PolarHBondContact O-N 2.98Å; D331-D335 VanDerWaalsContact O-N 3.09Å; D331-R342 IonicContact OD1-CZ 3.78Å; D331-R342 IonicContact OD1-NE 3.74Å; D331-R342 IonicContact OD1-NH2 2.69Å; D331-R342 PolarHBondContact OD1-NH2 3.47Å
332	T	41	Very low	39.6	Very low	94 Å²	94	109.9 Å²	109.9	58%	0.577	57%	0.566	S	S	*	*	H	α-helix	trans	-67.2	-35	-177.9	-45.5	0	0	0	0	112.8	W328 A336	W328-T332 PolarHBondContact O-N 2.83Å; W328-T332 PolarHBondContact O-OG1 3.03Å; T332-A336 PolarHBondContact O-N 3.09Å
333	I	36.4	Very low	39.7	Very low	80 Å²	80	111.6 Å²	111.6	41%	0.41	57%	0.566	S	S	.	*	H	α-helix	trans	-82.1	-36.6	178.9	-65.4	176.2	0	0	0	110.6	W329 D331 D335 A336 Y337 I340	W329-I333 WeakPolarHBondContact O-CG1 3.23Å; W329-I333 PolarHBondContact O-N 3.26Å; D331-I333 PolarHBondContact O-N 3.26Å; I333-D335 VanDerWaalsContact C-N 3.3Å; I333-D335 PolarHBondContact O-N 2.94Å; I333-A336 PolarHBondContact O-N 2.84Å; I333-Y337 HydrophobicContact CG2-CD2 4.16Å; I333-Y337 PolarHBondContact O-N 2.94Å; I333-I340 HydrophobicContact CG2-CD1 3.81Å; I333-I340 HydrophobicContact CG2-CG2 4.38Å
334	S	40.1	Very low	39.7	Very low	34 Å²	34	112.6 Å²	112.6	24%	0.238	58%	0.579	C	S	.	*	H	α-helix	trans	-65.2	-33.3	178.1	-163.5	0	0	0	0	112.4	A330 D331 Y337	A330-S334 WeakPolarHBondContact O-CB 3.48Å; A330-S334 PolarHBondContact O-N 3.12Å; A330-S334 VanDerWaalsContact O-N 3.1Å; D331-S334 PolarHBondContact O-N 3.46Å; S334-Y337 CarbonylContact O-C 3.07Å
335	D	44.5	Very low	39.5	Very low	142 Å²	142	112.2 Å²	112.2	76%	0.759	58%	0.577	S	S	*	*	H	α-helix	trans	-76.5	-31.2	175.6	-76.1	-14.1	0	0	0	113.2	D331 I333	D331-D335 PolarHBondContact O-N 2.98Å; D331-D335 VanDerWaalsContact O-N 3.09Å; I333-D335 VanDerWaalsContact C-N 3.3Å; I333-D335 PolarHBondContact O-N 2.94Å
336	A	46.4	Very low	39.1	Very low	63 Å²	63	110.6 Å²	110.6	52%	0.521	57%	0.574	S	S	.	*	H	α-helix	trans	-81.5	-23.9	178.2	0	0	0	0	0	112.9	T332 I333	T332-A336 PolarHBondContact O-N 3.09Å; I333-A336 PolarHBondContact O-N 2.84Å
337	Y	42.3	Very low	39.1	Very low	132 Å²	132	113.4 Å²	113.4	52%	0.518	59%	0.59	S	S	.	*			trans	-141.9	84.9	-175.2	-58.1	-84.5	0	0	0	110.5	I333 S334 F339 I340	I333-Y337 HydrophobicContact CG2-CD2 4.16Å; I333-Y337 PolarHBondContact O-N 2.94Å; S334-Y337 CarbonylContact O-C 3.07Å; Y337-F339 PolarHBondContact O-N 3.09Å; Y337-I340 VanDerWaalsContact CB-CD1 3.41Å; Y337-I340 HydrophobicContact CD1-CD1 4.45Å; Y337-I340 HydrophobicContact CD2-CD1 4.01Å; Y337-I340 HydrophobicContact CG-CD1 3.72Å; Y337-I340 HydrophobicContact CG-CG1 4.41Å; Y337-I340 PolarHBondContact O-N 2.96Å
338	P	45.1	Very low	38.9	Very low	97 Å²	97	117.5 Å²	117.5	63%	0.63	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-7.2	-178.5	24.6	-33.4	0	0	0	114.1
339	F	49.7	Very low	38.7	Very low	180 Å²	180	114.4 Å²	114.4	79%	0.789	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-9	176.3	-29.2	-75	0	0	0	112.9	Y337	Y337-F339 PolarHBondContact O-N 3.09Å
340	I	38	Very low	38.7	Very low	86 Å²	86	117.6 Å²	117.6	44%	0.441	61%	0.613	S	S	.	*	S	Bend	trans	-90.6	107	176.2	-61.8	-179.2	0	0	0	107.1	I333 Y337 R342	I333-I340 HydrophobicContact CG2-CD1 3.81Å; I333-I340 HydrophobicContact CG2-CG2 4.38Å; Y337-I340 VanDerWaalsContact CB-CD1 3.41Å; Y337-I340 HydrophobicContact CD1-CD1 4.45Å; Y337-I340 HydrophobicContact CD2-CD1 4.01Å; Y337-I340 HydrophobicContact CG-CD1 3.72Å; Y337-I340 HydrophobicContact CG-CG1 4.41Å; Y337-I340 PolarHBondContact O-N 2.96Å; I340-R342 PolarHBondContact O-N 2.72Å
341	N	39.5	Very low	38.5	Very low	119 Å²	119	120.2 Å²	120.2	64%	0.636	63%	0.627	S	S	*	*			trans	-58.7	128.7	177.9	-76.1	-36.6	0	0	0	110.9
342	R	41.6	Very low	38.3	Very low	156 Å²	156	125 Å²	125	59%	0.589	65%	0.652	S	S	*	*			trans	-59	133.3	174	-158	178.4	-160.4	-170.9	5.1	109.6	D331 I340 C344	D331-R342 IonicContact OD1-CZ 3.78Å; D331-R342 IonicContact OD1-NE 3.74Å; D331-R342 IonicContact OD1-NH2 2.69Å; D331-R342 PolarHBondContact OD1-NH2 3.47Å; I340-R342 PolarHBondContact O-N 2.72Å; R342-C344 PolarHBondContact O-N 3.07Å
343	P	35.5	Very low	38.1	Very low	102 Å²	102	125.1 Å²	125.1	66%	0.662	66%	0.664	S	S	*	*			trans	-65.3	108.1	168.4	-12.3	25.9	0	0	0	108.3	Q345	P343-Q345 PolarHBondContact O-N 3.17Å
344	C	36.6	Very low	38	Very low	119 Å²	119	127.3 Å²	127.3	80%	0.804	68%	0.681	S	S	*	*			trans	-64.2	108	171	-72.3	0	0	0	0	108.5	R342 N346	R342-C344 PolarHBondContact O-N 3.07Å; C344-N346 PolarHBondContact O-N 3.06Å
345	Q	37.3	Very low	37.9	Very low	175 Å²	175	134 Å²	134	82%	0.818	71%	0.708	S	S	*	*			trans	-63.4	105.2	163	-75.1	-172.4	-11.4	0	0	107.6	P343 I347	P343-Q345 PolarHBondContact O-N 3.17Å; Q345-I347 PolarHBondContact O-N 3.28Å
346	N	31.9	Very low	37.5	Very low	133 Å²	133	131.8 Å²	131.8	71%	0.711	70%	0.704	S	S	*	*			trans	-74.4	81.9	177.3	-139	-24.2	0	0	0	107.6	C344 K348	C344-N346 PolarHBondContact O-N 3.06Å; N346-K348 PolarHBondContact O-N 3.28Å
347	I	31.7	Very low	37.1	Very low	145 Å²	145	134.1 Å²	134.1	74%	0.744	71%	0.711	S	S	*	*			trans	-69.5	89.4	166.4	-58.6	173.3	0	0	0	105.8	Q345 P349	Q345-I347 PolarHBondContact O-N 3.28Å; I347-P349 WeakPolarHBondContact O-CD 3.26Å
348	K	33.7	Very low	36.8	Very low	169 Å²	169	134.5 Å²	134.5	74%	0.735	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-70	121.1	165.3	-80.7	-175	176.1	-179.6	0	107.7	N346 Y350	N346-K348 PolarHBondContact O-N 3.28Å; K348-Y350 PolarHBondContact O-N 3.48Å
349	P	33.7	Very low	36.4	Very low	116 Å²	116	137.9 Å²	137.9	75%	0.753	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-68.1	123.4	173.8	27.4	-29.4	0	0	0	108.3	I347 P351	I347-P349 WeakPolarHBondContact O-CD 3.26Å; P349-P351 WeakPolarHBondContact O-CD 3.38Å
350	Y	33.4	Very low	35.8	Very low	225 Å²	225	138.1 Å²	138.1	88%	0.882	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-63.5	124.5	168	-104.9	-92.4	0	0	0	108.3	K348	K348-Y350 PolarHBondContact O-N 3.48Å
351	P	32.1	Very low	35.5	Very low	96 Å²	96	139.5 Å²	139.5	62%	0.623	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-73.2	150	162.5	33.7	-29.3	0	0	0	107.4	P349	P349-P351 WeakPolarHBondContact O-CD 3.38Å
352	N	33.6	Very low	35.3	Very low	161 Å²	161	139.6 Å²	139.6	86%	0.861	76%	0.758	S	S	*	*			trans	105.1	70.4	172.4	-48	-17	0	0	0	115.1
353	A	36.2	Very low	34.7	Very low	98 Å²	98	137.4 Å²	137.4	81%	0.81	77%	0.766	S	S	*	*			trans	-153.3	102.5	140.9	0	0	0	0	0	108.8	H355	A353-H355 PolarHBondContact O-N 2.85Å
354	T	35.6	Very low	34.9	Very low	126 Å²	126	139.3 Å²	139.3	77%	0.773	78%	0.776	S	S	*	*			trans	-43.2	122.2	160.9	41.5	0	0	0	0	111.8
355	H	37.3	Very low	34.6	Very low	175 Å²	175	141.5 Å²	141.5	81%	0.81	78%	0.779	S	S	*	*				155.9	120.7	127.4	-93	-89.1	0	0	0	112.4	A353	A353-H355 PolarHBondContact O-N 2.85Å
356	S	36.6	Very low	34.8	Very low	95 Å²	95	143 Å²	143	66%	0.664	81%	0.807	S	S	*	*			trans	76.3	96.4	137.3	-139.6	0	0	0	0	121.1
357	T	38.3	Very low	34.9	Very low	111 Å²	111	143.5 Å²	143.5	68%	0.681	81%	0.812	S	S	*	*				66.9	124.2	121.2	59.1	0	0	0	0	122.1
358	N	35.9	Very low	35.1	Very low	140 Å²	140	143.4 Å²	143.4	75%	0.749	82%	0.815	S	S	*	*			trans	85.8	97.3	146.4	-59.2	-6.1	0	0	0	116.3
359	E	36.2	Very low	35.2	Very low	169 Å²	169	142 Å²	142	79%	0.79	82%	0.82	S	S	*	*				57.8	107.2	80	-67.2	-160.7	173.7	0	0	113.1
360	Q	37.5	Very low	35.2	Very low	184 Å²	184	143.5 Å²	143.5	86%	0.86	82%	0.824	S	S	*	*				177.1	138.8	104	-102.2	165.5	-13.5	0	0	113.1
361	C	31.3	Very low	35.4	Very low	115 Å²	115	138.4 Å²	138.4	78%	0.777	82%	0.82	S	S	*	*			trans	-47.6	154.1	170.8	-61	0	0	0	0	115
362	C	35.8	Very low	35.6	Very low	122 Å²	122	141.3 Å²	141.3	82%	0.824	83%	0.833	S	S	*	*				167.9	131.8	102.5	-92	0	0	0	0	112.2
363	S	28.4	Very low	35.7	Very low	109 Å²	109	139.9 Å²	139.9	76%	0.762	83%	0.831	S	S	*	*			trans	-39.4	147.1	155.7	-26.3	0	0	0	0	112.8
364	T	39.4	Very low	35.7	Very low	142 Å²	142	143.1 Å²	143.1	87%	0.871	83%	0.833	S	S	*	*			trans	-173.6	138	131.4	-68.3	0	0	0	0	110.6
365	L	29.8	Very low	35.7	Very low	165 Å²	165	144.5 Å²	144.5	86%	0.864	84%	0.838	S	S	*	*			trans	-54.6	146.1	173.2	-69.8	130.8	0	0	0	114.7
366	C	41.7	Very low	35.5	Very low	207 Å²	207	141.7 Å²	141.7	100%	1.399	84%	0.84	S	S	*	*			trans	-142.7	0	139.7	-98.7	0	0	0	0	109.2

Retrieved 366 of 366 residues in 347 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).