A0A5K4FEQ4_SCHMA Loading...

C2H2-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FEQ4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 429 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	37.3	Very low	35.2	Very low	244 Å²	244	142.3 Å²	142.3	100%	1.202	76%	0.757	S	S	*	*				0	95.5	0	-73.2	145.2	108.1	0	0	107.4	S3	M1-S3 PolarHBondContact O-N 3.21Å
2	A	31.3	Very low	35.2	Very low	104 Å²	104	137.2 Å²	137.2	86%	0.86	74%	0.741	S	S	*	*			trans	-81	96.6	177.4	0	0	0	0	0	107.7	F4	A2-F4 PolarHBondContact O-N 2.79Å
3	S	31.5	Very low	35	Very low	104 Å²	104	130.9 Å²	130.9	73%	0.727	72%	0.72	S	S	*	*			trans	-65.1	117.1	171	-175.5	0	0	0	0	107.6	M1 V5	M1-S3 PolarHBondContact O-N 3.21Å; S3-V5 VanDerWaalsContact C-N 3.3Å; S3-V5 PolarHBondContact O-N 3.24Å
4	F	34.9	Very low	34.5	Very low	188 Å²	188	134.3 Å²	134.3	83%	0.825	72%	0.718	S	S	*	*			trans	-69.7	91	176.4	-127.9	-95.8	0	0	0	107.5	A2 M6	A2-F4 PolarHBondContact O-N 2.79Å; F4-M6 VanDerWaalsContact C-N 3.29Å; F4-M6 PolarHBondContact O-N 3.25Å
5	V	36.5	Very low	34.3	Very low	127 Å²	127	130.9 Å²	130.9	77%	0.77	71%	0.708	S	S	*	*			trans	-70.7	93.9	169	-178.6	0	0	0	0	105.8	S3 D7	S3-V5 VanDerWaalsContact C-N 3.3Å; S3-V5 PolarHBondContact O-N 3.24Å; V5-D7 PolarHBondContact O-N 2.88Å
6	M	31.8	Very low	34.3	Very low	115 Å²	115	129.9 Å²	129.9	57%	0.567	70%	0.702	S	S	*	*			trans	-58	123.4	170.5	-78.4	-84.4	-77.5	0	0	108.5	F4 N8 L10	F4-M6 VanDerWaalsContact C-N 3.29Å; F4-M6 PolarHBondContact O-N 3.25Å; M6-N8 PolarHBondContact O-N 3.24Å; M6-L10 HydrophobicContact CE-CB 4.01Å; M6-L10 HydrophobicContact CE-CD1 4.28Å; M6-L10 HydrophobicContact SD-CD1 4.42Å
7	D	35.8	Very low	34.1	Very low	127 Å²	127	132.4 Å²	132.4	68%	0.679	70%	0.704	S	S	*	*			trans	-52.3	129.9	173.2	-98.7	-34.6	0	0	0	109.8	V5 Q9 L10	V5-D7 PolarHBondContact O-N 2.88Å; D7-Q9 PolarHBondContact O-N 3.23Å; D7-L10 PolarHBondContact O-N 3.3Å
8	N	39.1	Very low	33.8	Very low	138 Å²	138	130.7 Å²	130.7	74%	0.738	70%	0.696	S	S	*	*	H	α-helix	trans	-54.5	-18	-177.9	-79.9	-30.6	0	0	0	113.5	M6 K11	M6-N8 PolarHBondContact O-N 3.24Å; N8-K11 PolarHBondContact O-N 2.69Å
9	Q	36	Very low	33.7	Very low	165 Å²	165	130.6 Å²	130.6	77%	0.771	69%	0.691	S	S	*	*	H	α-helix	trans	-71.6	-30.5	175.7	-61.9	-162.5	3.1	0	0	113.8	D7 K11 S12	D7-Q9 PolarHBondContact O-N 3.23Å; Q9-K11 VanDerWaalsContact C-N 3.32Å; Q9-S12 PolarHBondContact O-OG 3.32Å; Q9-S12 VanDerWaalsContact O-OG 3.05Å
10	L	36.6	Very low	33.5	Very low	103 Å²	103	131.1 Å²	131.1	54%	0.539	69%	0.692	S	S	.	*	H	α-helix	trans	-75.3	-25.8	175	-84	161.8	0	0	0	111.8	M6 D7 A13 Y14	M6-L10 HydrophobicContact CE-CB 4.01Å; M6-L10 HydrophobicContact CE-CD1 4.28Å; M6-L10 HydrophobicContact SD-CD1 4.42Å; D7-L10 PolarHBondContact O-N 3.3Å; L10-A13 PolarHBondContact O-N 3.25Å; L10-Y14 PolarHBondContact O-N 2.81Å; L10-Y14 VanDerWaalsContact O-N 3.16Å
11	K	36.8	Very low	33.4	Very low	150 Å²	150	128.6 Å²	128.6	65%	0.652	69%	0.691	S	S	*	*	H	α-helix	trans	-68.7	-36.3	178.6	-142.5	171	-172.3	177.3	0	112	N8 Q9 Y14 C15	N8-K11 PolarHBondContact O-N 2.69Å; Q9-K11 VanDerWaalsContact C-N 3.32Å; K11-Y14 PolarHBondContact O-N 2.89Å; K11-C15 PolarHBondContact O-N 3.36Å
12	S	35.4	Very low	33.1	Very low	81 Å²	81	122 Å²	122	57%	0.566	66%	0.664	S	S	*	*	H	α-helix	trans	-69.2	-36.3	176.2	65.4	0	0	0	0	112.4	Q9 Y14 C15 L16	Q9-S12 PolarHBondContact O-OG 3.32Å; Q9-S12 VanDerWaalsContact O-OG 3.05Å; S12-Y14 VanDerWaalsContact C-N 3.34Å; S12-C15 PolarHBondContact O-N 2.8Å; S12-L16 PolarHBondContact O-N 2.89Å; S12-L16 VanDerWaalsContact O-N 3.14Å
13	A	31.7	Very low	33.1	Very low	56 Å²	56	122.8 Å²	122.8	46%	0.463	65%	0.654	S	S	.	*	H	α-helix	trans	-65.7	-37.6	175.7	0	0	0	0	0	112	L10 L16 F17	L10-A13 PolarHBondContact O-N 3.25Å; A13-L16 PolarHBondContact O-N 2.93Å; A13-F17 PolarHBondContact O-N 2.91Å
14	Y	28	Very low	33.1	Very low	178 Å²	178	125.3 Å²	125.3	70%	0.698	66%	0.659	S	S	*	*	H	α-helix	trans	-70.8	-32.6	178.6	-140.2	-89.6	0	0	0	112.9	L10 K11 S12	L10-Y14 PolarHBondContact O-N 2.81Å; L10-Y14 VanDerWaalsContact O-N 3.16Å; K11-Y14 PolarHBondContact O-N 2.89Å; S12-Y14 VanDerWaalsContact C-N 3.34Å
15	C	32.6	Very low	33.1	Very low	84 Å²	84	123.3 Å²	123.3	57%	0.568	66%	0.657	S	S	*	*	H	α-helix	trans	-71.8	-34.4	173.7	-75.3	0	0	0	0	112.7	K11 S12 F17 N18 Q19	K11-C15 PolarHBondContact O-N 3.36Å; S12-C15 PolarHBondContact O-N 2.8Å; C15-F17 VanDerWaalsContact C-N 3.3Å; C15-F17 PolarHBondContact O-N 3.22Å; C15-N18 PolarHBondContact O-N 3.48Å; C15-Q19 PolarHBondContact O-N 3.33Å
16	L	33.4	Very low	32.8	Very low	115 Å²	115	125.5 Å²	125.5	60%	0.602	66%	0.664	S	S	*	*	H	α-helix	trans	-67.2	-33.2	-179.7	-156.4	74.6	0	0	0	112.2	S12 A13	S12-L16 PolarHBondContact O-N 2.89Å; S12-L16 VanDerWaalsContact O-N 3.14Å; A13-L16 PolarHBondContact O-N 2.93Å
17	F	30.7	Very low	32.7	Very low	171 Å²	171	125.7 Å²	125.7	75%	0.75	67%	0.672	S	S	*	*	H	α-helix	trans	-74.7	-30	-177.9	-127	-89.1	0	0	0	113.7	A13 C15	A13-F17 PolarHBondContact O-N 2.91Å; C15-F17 VanDerWaalsContact C-N 3.3Å; C15-F17 PolarHBondContact O-N 3.22Å
18	N	29.7	Very low	32.3	Very low	103 Å²	103	125.5 Å²	125.5	55%	0.551	68%	0.677	S	S	*	*	H	α-helix	trans	-87.5	-18.2	179.5	-73.3	-16.3	0	0	0	113.7	C15	C15-N18 PolarHBondContact O-N 3.48Å
19	Q	30.7	Very low	31.8	Very low	129 Å²	129	127 Å²	127	60%	0.603	68%	0.682	S	S	*	*	H	α-helix	trans	-77.1	-23.4	176.2	-117.9	172	8.3	0	0	113.4	C15 A21	C15-Q19 PolarHBondContact O-N 3.33Å; Q19-A21 VanDerWaalsContact C-N 3.29Å
20	I	30.8	Very low	31.4	Very low	139 Å²	139	125.8 Å²	125.8	71%	0.713	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-19.7	177.7	-60.8	171	0	0	0	111
21	A	30.7	Very low	31.1	Very low	80 Å²	80	128.9 Å²	128.9	66%	0.661	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-10.6	-173.7	0	0	0	0	0	115.3	Q19	Q19-A21 VanDerWaalsContact C-N 3.29Å
22	T	32.1	Very low	30.6	Very low	105 Å²	105	125.7 Å²	125.7	64%	0.644	69%	0.694	S	S	*	*	S	Bend	trans	-132.1	5.6	-170.9	63.3	0	0	0	0	116.8
23	N	30.2	Very low	30.1	Very low	121 Å²	121	132.7 Å²	132.7	65%	0.647	71%	0.708	S	S	*	*			trans	-113.9	57.1	-179.9	-63.9	-5.5	0	0	0	111.5	D25	N23-D25 PolarHBondContact O-N 3.41Å
24	D	30.9	Very low	29.7	Very low	156 Å²	156	138 Å²	138	83%	0.834	73%	0.728	S	S	*	*			trans	-66.8	93.4	141.6	-78.2	-33	0	0	0	105.9
25	D	35.2	Very low	29.6	Very low	147 Å²	147	133.2 Å²	133.2	79%	0.786	72%	0.721	S	S	*	*			trans	175.6	120.2	144	-85.6	-26.3	0	0	0	110.8	N23 V27	N23-D25 PolarHBondContact O-N 3.41Å; D25-V27 VanDerWaalsContact C-N 3.28Å; D25-V27 PolarHBondContact O-N 3.08Å
26	N	30.2	Very low	29.2	Very low	172 Å²	172	135 Å²	135	92%	0.92	73%	0.734	S	S	*	*			trans	-65.8	71.4	177.3	-74.6	-53.7	0	0	0	112.7
27	V	30	Very low	29	Very low	119 Å²	119	137.5 Å²	137.5	72%	0.721	75%	0.747	S	S	*	*			trans	-118.9	111.7	165.5	-173.4	0	0	0	0	109.5	D25 M29	D25-V27 VanDerWaalsContact C-N 3.28Å; D25-V27 PolarHBondContact O-N 3.08Å; V27-M29 PolarHBondContact O-N 3.46Å
28	P	27.5	Very low	28.8	Very low	123 Å²	123	135 Å²	135	80%	0.799	75%	0.746	S	S	*	*			trans	-68.2	106.9	176.5	26.9	-30.4	0	0	0	108.8	D30	P28-D30 PolarHBondContact O-N 3.17Å
29	M	28.7	Very low	28.4	Very low	171 Å²	171	135.7 Å²	135.7	84%	0.842	76%	0.759	S	S	*	*			trans	-76.5	111.6	176.6	-143.1	-163.2	-60.1	0	0	108.9	V27 L31	V27-M29 PolarHBondContact O-N 3.46Å; M29-L31 PolarHBondContact O-N 3Å
30	D	27.3	Very low	28.1	Very low	138 Å²	138	134.6 Å²	134.6	74%	0.738	77%	0.766	S	S	*	*			trans	-62.9	109.3	-179.9	-155.9	-26.1	0	0	0	110.4	P28 S32	P28-D30 PolarHBondContact O-N 3.17Å; D30-S32 PolarHBondContact O-N 3.4Å; D30-S32 PolarHBondContact OD1-OG 3.05Å
31	L	29.9	Very low	27.9	Very low	168 Å²	168	133.6 Å²	133.6	88%	0.88	77%	0.771	S	S	*	*			trans	-79	35	-175	-75	168.4	0	0	0	113.3	M29	M29-L31 PolarHBondContact O-N 3Å
32	S	26.3	Very low	27.5	Very low	83 Å²	83	137.2 Å²	137.2	58%	0.58	78%	0.778	S	S	*	*			trans	-110.5	45.3	-173.7	61.1	0	0	0	0	113.7	D30	D30-S32 PolarHBondContact O-N 3.4Å; D30-S32 PolarHBondContact OD1-OG 3.05Å
33	R	24.8	Very low	27.2	Very low	228 Å²	228	138.9 Å²	138.9	86%	0.86	78%	0.784	S	S	*	*			trans	-137.4	73.4	160.1	-75.4	-168.7	-174.5	163.9	3.4	112.2	S35	R33-S35 VanDerWaalsContact C-N 3.35Å; R33-S35 PolarHBondContact O-N 3.48Å
34	N	23.6	Very low	27.1	Very low	167 Å²	167	141.1 Å²	141.1	89%	0.893	79%	0.79	S	S	*	*			trans	-73.9	92.7	151.7	-72.9	-21.6	0	0	0	107.9
35	S	26.6	Very low	26.8	Very low	79 Å²	79	144.5 Å²	144.5	55%	0.552	79%	0.793	S	S	*	*			trans	-141.2	90.4	165.4	60.3	0	0	0	0	109.6	R33 L37	R33-S35 VanDerWaalsContact C-N 3.35Å; R33-S35 PolarHBondContact O-N 3.48Å; S35-L37 PolarHBondContact O-N 2.9Å
36	S	24.8	Very low	26.4	Very low	120 Å²	120	143.3 Å²	143.3	84%	0.839	79%	0.786	S	S	*	*				31.4	79.2	128.1	-37.2	0	0	0	0	115.9
37	L	29	Very low	26.3	Very low	168 Å²	168	143.6 Å²	143.6	88%	0.88	78%	0.782	S	S	*	*			trans	-120.4	109.8	156.8	-82.6	164.6	0	0	0	108.9	S35	S35-L37 PolarHBondContact O-N 2.9Å
38	T	25.2	Very low	26.2	Very low	119 Å²	119	145.5 Å²	145.5	73%	0.73	79%	0.787	S	S	*	*			trans	-56.3	142.9	178.1	44.2	0	0	0	0	112.6	S40	T38-S40 PolarHBondContact O-N 3.28Å
39	S	22.3	Very low	26.1	Very low	117 Å²	117	146.3 Å²	146.3	82%	0.818	79%	0.785	S	S	*	*			trans	-39.3	117.4	162.1	50.2	0	0	0	0	114.4
40	S	23.5	Very low	26.1	Very low	107 Å²	107	144.3 Å²	144.3	75%	0.748	78%	0.783	S	S	*	*			trans	-179.7	98.8	149.2	44.1	0	0	0	0	110.8	T38	T38-S40 PolarHBondContact O-N 3.28Å
41	S	26.8	Very low	26.1	Very low	117 Å²	117	143.4 Å²	143.4	82%	0.818	78%	0.782	S	S	*	*			trans	164.7	81.4	137.2	61.6	0	0	0	0	109.2
42	L	23.8	Very low	26.1	Very low	156 Å²	156	143.1 Å²	143.1	82%	0.817	78%	0.776	S	S	*	*			trans	-55	142	150.2	-156	75.9	0	0	0	107.4
43	N	25.5	Very low	26	Very low	141 Å²	141	146.5 Å²	146.5	75%	0.754	79%	0.788	S	S	*	*			trans	100.4	77.7	172.5	-46	-28.7	0	0	0	116.6
44	H	26.6	Very low	26.1	Very low	167 Å²	167	141.1 Å²	141.1	77%	0.773	78%	0.775	S	S	*	*				-163.8	94.1	121.3	-123.6	8.6	0	0	0	107.5	D46	H44-D46 PolarHBondContact O-N 3.45Å; H44-D46 VanDerWaalsContact O-N 3.12Å
45	Y	25.1	Very low	26.2	Very low	228 Å²	228	143.1 Å²	143.1	89%	0.894	77%	0.772	S	S	*	*			trans	-73.5	93.9	157.7	-82.7	-85.4	0	0	0	105.3	E47	Y45-E47 PolarHBondContact O-N 3.33Å; Y45-E47 VanDerWaalsContact O-N 3.08Å
46	D	27.1	Very low	26.1	Very low	122 Å²	122	147.9 Å²	147.9	65%	0.652	78%	0.778	S	S	*	*			trans	-60.8	110	155.8	-76	-34.8	0	0	0	105.4	H44 L48	H44-D46 PolarHBondContact O-N 3.45Å; H44-D46 VanDerWaalsContact O-N 3.12Å; D46-L48 PolarHBondContact O-N 3.38Å
47	E	28.8	Very low	26.2	Very low	177 Å²	177	149.5 Å²	149.5	83%	0.827	78%	0.778	S	S	*	*			trans	-53.5	93	163.3	-77.8	177.4	150	0	0	106.3	Y45 N49	Y45-E47 PolarHBondContact O-N 3.33Å; Y45-E47 VanDerWaalsContact O-N 3.08Å; E47-N49 PolarHBondContact O-N 3.41Å
48	L	27.9	Very low	26.1	Very low	159 Å²	159	149.8 Å²	149.8	83%	0.832	77%	0.772	S	S	*	*			trans	-59.5	95.1	160.2	-73.9	172.5	0	0	0	104.3	D46 T50	D46-L48 PolarHBondContact O-N 3.38Å; L48-T50 PolarHBondContact O-N 3.38Å
49	N	25.3	Very low	26.1	Very low	140 Å²	140	149.7 Å²	149.7	75%	0.749	78%	0.775	S	S	*	*			trans	-42	98.6	158.8	-86	-36.9	0	0	0	105.4	E47 T51	E47-N49 PolarHBondContact O-N 3.41Å; N49-T51 PolarHBondContact O-N 3.36Å; N49-T51 PolarHBondContact O-OG1 2.78Å
50	T	28.4	Very low	26.3	Very low	130 Å²	130	151.5 Å²	151.5	80%	0.798	77%	0.774	S	S	*	*			trans	-65.5	79	157.5	45.9	0	0	0	0	103.7	L48 E52	L48-T50 PolarHBondContact O-N 3.38Å; T50-E52 PolarHBondContact O-N 2.97Å
51	T	26.9	Very low	26.3	Very low	119 Å²	119	153.1 Å²	153.1	73%	0.73	77%	0.774	S	S	*	*			trans	-49.6	100.6	151.4	6.7	0	0	0	0	103	N49 N53	N49-T51 PolarHBondContact O-N 3.36Å; N49-T51 PolarHBondContact O-OG1 2.78Å; T51-N53 VanDerWaalsContact C-N 3.3Å; T51-N53 PolarHBondContact O-N 2.85Å
52	E	29.2	Very low	26.5	Very low	162 Å²	162	153 Å²	153	76%	0.757	77%	0.773	S	S	*	*			trans	-42.1	110.4	161.5	-75	178.1	146.9	0	0	104	T50 I54	T50-E52 PolarHBondContact O-N 2.97Å; E52-I54 HydrophobicContact CB-CG1 4.35Å; E52-I54 PolarHBondContact O-N 3.18Å
53	N	25.8	Very low	26.9	Very low	153 Å²	153	154.4 Å²	154.4	82%	0.818	78%	0.776	S	S	*	*			trans	-63	86	164.2	-96.2	-29.6	0	0	0	103.6	T51 Y55	T51-N53 VanDerWaalsContact C-N 3.3Å; T51-N53 PolarHBondContact O-N 2.85Å; N53-Y55 PolarHBondContact O-N 2.93Å
54	I	25.9	Very low	27	Very low	116 Å²	116	157.2 Å²	157.2	60%	0.595	78%	0.781	S	S	*	*			trans	-60.6	84.8	159.4	-60.1	169.3	0	0	0	102.1	E52 Y56	E52-I54 HydrophobicContact CB-CG1 4.35Å; E52-I54 PolarHBondContact O-N 3.18Å; I54-Y56 VanDerWaalsContact O-CD2 3.31Å; I54-Y56 WeakPolarHBondContact O-CD2 3.31Å; I54-Y56 PolarHBondContact O-N 3.36Å
55	Y	25.7	Very low	27.1	Very low	209 Å²	209	153.3 Å²	153.3	82%	0.82	77%	0.773	S	S	*	*			trans	-66.5	95.3	173.7	-159.4	-94.3	0	0	0	103.5	N53 D57	N53-Y55 PolarHBondContact O-N 2.93Å; Y55-D57 PolarHBondContact O-N 3.48Å
56	Y	25.7	Very low	27.3	Very low	178 Å²	178	148.8 Å²	148.8	70%	0.698	76%	0.764	S	S	*	*			trans	-50.9	113.5	173.9	-75.7	-88.7	0	0	0	106.5	I54 K58	I54-Y56 VanDerWaalsContact O-CD2 3.31Å; I54-Y56 WeakPolarHBondContact O-CD2 3.31Å; I54-Y56 PolarHBondContact O-N 3.36Å; Y56-K58 PolarHBondContact O-N 2.99Å
57	D	25	Very low	27.6	Very low	154 Å²	154	150.6 Å²	150.6	82%	0.824	77%	0.768	S	S	*	*			trans	-57	78.2	156.5	-81.3	-33.5	0	0	0	106.5	Y55 C59	Y55-D57 PolarHBondContact O-N 3.48Å; D57-C59 PolarHBondContact O-N 3.06Å
58	K	27.7	Very low	27.5	Very low	174 Å²	174	151.4 Å²	151.4	76%	0.757	77%	0.765	S	S	*	*			trans	-65.6	98.8	158.6	-75.1	-173.8	178.6	-178.8	0	103.2	Y56 I60	Y56-K58 PolarHBondContact O-N 2.99Å; K58-I60 WeakPolarHBondContact O-CG1 3.41Å; K58-I60 PolarHBondContact O-N 3.25Å
59	C	25.5	Very low	27.6	Very low	117 Å²	117	152.4 Å²	152.4	79%	0.791	76%	0.763	S	S	*	*			trans	-46	97.9	160.7	-62.3	0	0	0	0	106.5	D57 D61	D57-C59 PolarHBondContact O-N 3.06Å; C59-D61 PolarHBondContact O-N 3.01Å; C59-D61 VanDerWaalsContact O-N 3.16Å
60	I	25.3	Very low	27.7	Very low	156 Å²	156	149.8 Å²	149.8	80%	0.8	76%	0.755	S	S	*	*			trans	-71.9	110.6	173.8	-66.1	175.3	0	0	0	104.1	K58 S62	K58-I60 WeakPolarHBondContact O-CG1 3.41Å; K58-I60 PolarHBondContact O-N 3.25Å; I60-S62 PolarHBondContact O-N 3.37Å
61	D	25	Very low	27.8	Very low	141 Å²	141	148.8 Å²	148.8	75%	0.754	74%	0.743	S	S	*	*			trans	-45.7	125.7	174.2	-80.1	-43.4	0	0	0	109.9	C59 Q63	C59-D61 PolarHBondContact O-N 3.01Å; C59-D61 VanDerWaalsContact O-N 3.16Å; D61-Q63 PolarHBondContact O-N 3Å
62	S	29.8	Very low	28	Very low	115 Å²	115	147.5 Å²	147.5	80%	0.804	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	26.8	-167.9	-162.1	0	0	0	0	114.5	I60	I60-S62 PolarHBondContact O-N 3.37Å
63	Q	32.9	Very low	28	Very low	185 Å²	185	144.7 Å²	144.7	86%	0.864	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.3	9	-171	-76.5	-167.7	-11.2	0	0	116.2	D61	D61-Q63 PolarHBondContact O-N 3Å
64	K	27.2	Very low	28.1	Very low	199 Å²	199	143.7 Å²	143.7	87%	0.865	72%	0.716	S	S	*	*	S	Bend	trans	-138.5	30.3	178.4	-69.5	-170.5	177.4	179.6	0	115.7
65	S	29.4	Very low	28.3	Very low	85 Å²	85	141.4 Å²	141.4	59%	0.594	71%	0.71	S	S	*	*			trans	-83.8	-12.4	-165.8	56.7	0	0	0	0	118.3
66	D	29.4	Very low	28.4	Very low	134 Å²	134	135.9 Å²	135.9	72%	0.717	69%	0.694	S	S	*	*	S	Bend	trans	-104.8	-14.9	-157.3	-66.7	1.1	0	0	0	117.1
67	E	33.1	Very low	28.7	Very low	159 Å²	159	131.6 Å²	131.6	74%	0.743	68%	0.682	S	S	*	*	S	Bend	trans	-106.8	-35	-176.4	-77.2	-176.7	162.4	0	0	115.5	K69	E67-K69 PolarHBondContact O-N 3.3Å
68	Y	27.2	Very low	28.8	Very low	195 Å²	195	130.6 Å²	130.6	77%	0.765	67%	0.674	S	S	*	*	H	α-helix	trans	-83.4	-13.4	-170.9	-79.9	-84.9	0	0	0	115.1
69	K	29.1	Very low	29	Very low	179 Å²	179	127.9 Å²	127.9	78%	0.778	67%	0.668	S	S	*	*	H	α-helix	trans	-84.6	-18.2	-177.3	-134.8	176.1	-173.6	176.8	0	113.9	E67	E67-K69 PolarHBondContact O-N 3.3Å
70	C	27.5	Very low	29.3	Very low	86 Å²	86	129.6 Å²	129.6	58%	0.581	66%	0.662	S	S	*	*	H	α-helix	trans	-78	-33.4	179.1	-72.8	0	0	0	0	112.9	V72 N73 E74	C70-V72 PolarHBondContact O-N 3.15Å; C70-N73 PolarHBondContact O-N 2.92Å; C70-E74 PolarHBondContact O-N 3.39Å
71	I	30.6	Very low	29.6	Very low	108 Å²	108	127.7 Å²	127.7	55%	0.554	65%	0.645	S	S	*	*	H	α-helix	trans	-71.4	-35.1	-171.9	-56.9	174.8	0	0	0	112.1	N73 E74	I71-N73 VanDerWaalsContact C-N 3.33Å; I71-N73 PolarHBondContact O-N 2.83Å; I71-E74 PolarHBondContact O-N 2.84Å
72	V	30.8	Very low	30	Very low	92 Å²	92	124.4 Å²	124.4	56%	0.558	63%	0.633	S	S	*	*	H	α-helix	trans	-71.8	-28.3	-177	-177.1	0	0	0	0	112.1	C70 S75 I76	C70-V72 PolarHBondContact O-N 3.15Å; V72-S75 PolarHBondContact O-OG 2.98Å; V72-I76 HydrophobicContact CG1-CD1 4.47Å; V72-I76 WeakPolarHBondContact O-CG1 3.46Å
73	N	30	Very low	30.3	Very low	104 Å²	104	125.8 Å²	125.8	56%	0.556	63%	0.627	S	S	*	*	H	α-helix	trans	-78.9	-33	177.9	-97.2	13.4	0	0	0	112.7	C70 I71 I76 I77	C70-N73 PolarHBondContact O-N 2.92Å; I71-N73 VanDerWaalsContact C-N 3.33Å; I71-N73 PolarHBondContact O-N 2.83Å; N73-I76 PolarHBondContact O-N 2.85Å; N73-I77 WeakPolarHBondContact O-CB 3.37Å; N73-I77 WeakPolarHBondContact O-CD1 3.46Å; N73-I77 WeakPolarHBondContact O-CG1 3.08Å; N73-I77 PolarHBondContact O-N 3.38Å; N73-I77 VanDerWaalsContact O-N 3.09Å
74	E	26.6	Very low	30.3	Very low	132 Å²	132	121.9 Å²	121.9	62%	0.617	61%	0.612	S	S	*	*	H	α-helix	trans	-66.2	-38	179.1	-78.3	-177.6	157.8	0	0	112.5	C70 I71 I76 I77 M78	C70-E74 PolarHBondContact O-N 3.39Å; I71-E74 PolarHBondContact O-N 2.84Å; E74-I76 PolarHBondContact O-N 2.88Å; E74-I77 PolarHBondContact O-N 3.24Å; E74-M78 WeakPolarHBondContact O-CB 3.41Å; E74-M78 WeakPolarHBondContact O-CG 3.38Å; E74-M78 PolarHBondContact O-N 3.24Å
75	S	30.6	Very low	30.6	Very low	68 Å²	68	117.3 Å²	117.3	48%	0.476	60%	0.597	S	S	.	*	H	α-helix	trans	-66.8	-39	179.1	67.7	0	0	0	0	112.5	V72 M78 N79	V72-S75 PolarHBondContact O-OG 2.98Å; S75-M78 PolarHBondContact O-N 3.4Å; S75-N79 PolarHBondContact O-N 3.21Å; S75-N79 VanDerWaalsContact O-N 3.1Å
76	I	28.8	Very low	30.8	Very low	93 Å²	93	122.1 Å²	122.1	48%	0.477	60%	0.602	S	S	.	*	H	α-helix	trans	-68.1	-38.9	177.4	-62.5	172.5	0	0	0	110.6	V72 N73 E74 K80	V72-I76 HydrophobicContact CG1-CD1 4.47Å; V72-I76 WeakPolarHBondContact O-CG1 3.46Å; N73-I76 PolarHBondContact O-N 2.85Å; E74-I76 PolarHBondContact O-N 2.88Å; I76-K80 PolarHBondContact O-N 2.79Å
77	I	30.4	Very low	31.4	Very low	88 Å²	88	118.9 Å²	118.9	45%	0.451	59%	0.59	S	S	.	*	H	α-helix	trans	-69.1	-43.8	177.9	-67.2	168.5	0	0	0	110.3	N73 E74 N79 K80 Y81	N73-I77 WeakPolarHBondContact O-CB 3.37Å; N73-I77 WeakPolarHBondContact O-CD1 3.46Å; N73-I77 WeakPolarHBondContact O-CG1 3.08Å; N73-I77 PolarHBondContact O-N 3.38Å; N73-I77 VanDerWaalsContact O-N 3.09Å; E74-I77 PolarHBondContact O-N 3.24Å; I77-N79 PolarHBondContact O-N 3.38Å; I77-K80 PolarHBondContact O-N 2.76Å; I77-Y81 HydrophobicContact CG2-CD2 3.82Å; I77-Y81 HydrophobicContact CG2-CE2 3.54Å; I77-Y81 VanDerWaalsContact O-CD2 3.25Å; I77-Y81 WeakPolarHBondContact O-CD2 3.33Å; I77-Y81 PolarHBondContact O-N 3.41Å
78	M	29.2	Very low	31.5	Very low	132 Å²	132	115.4 Å²	115.4	65%	0.65	58%	0.577	S	S	*	*	H	α-helix	trans	-64.2	-37.6	-179.9	-77.6	-69.9	-82.4	0	0	112.8	E74 S75 K80 Y81 S82	E74-M78 WeakPolarHBondContact O-CB 3.41Å; E74-M78 WeakPolarHBondContact O-CG 3.38Å; E74-M78 PolarHBondContact O-N 3.24Å; S75-M78 PolarHBondContact O-N 3.4Å; M78-K80 VanDerWaalsContact C-N 3.32Å; M78-K80 PolarHBondContact O-N 2.96Å; M78-Y81 PolarHBondContact O-N 3.05Å; M78-S82 PolarHBondContact O-N 2.94Å; M78-S82 PolarHBondContact O-OG 3.35Å
79	N	31.1	Very low	32.2	Very low	118 Å²	118	112.8 Å²	112.8	63%	0.631	57%	0.572	S	S	*	*	H	α-helix	trans	-66.6	-31.5	175.2	-85	-2.4	0	0	0	113.1	S75 I77 S82 E83	S75-N79 PolarHBondContact O-N 3.21Å; S75-N79 VanDerWaalsContact O-N 3.1Å; I77-N79 PolarHBondContact O-N 3.38Å; N79-S82 PolarHBondContact O-OG 3.1Å; N79-E83 PolarHBondContact O-N 2.84Å
80	K	32.1	Very low	32.8	Very low	152 Å²	152	111.3 Å²	111.3	66%	0.661	57%	0.565	S	S	*	*	H	α-helix	trans	-70.6	-31.6	174.7	-79	-173.7	175.1	-177.7	0	113	I76 I77 M78 N84	I76-K80 PolarHBondContact O-N 2.79Å; I77-K80 PolarHBondContact O-N 2.76Å; M78-K80 VanDerWaalsContact C-N 3.32Å; M78-K80 PolarHBondContact O-N 2.96Å; K80-N84 PolarHBondContact O-N 3.47Å
81	Y	32	Very low	33.2	Very low	117 Å²	117	112.4 Å²	112.4	46%	0.459	56%	0.564	S	S	.	*	H	α-helix	trans	-73.2	-35.3	176.9	-81.3	-73	0	0	0	112.8	I77 M78 N84 N85 Y299	I77-Y81 HydrophobicContact CG2-CD2 3.82Å; I77-Y81 HydrophobicContact CG2-CE2 3.54Å; I77-Y81 VanDerWaalsContact O-CD2 3.25Å; I77-Y81 WeakPolarHBondContact O-CD2 3.33Å; I77-Y81 PolarHBondContact O-N 3.41Å; M78-Y81 PolarHBondContact O-N 3.05Å; Y81-N84 PolarHBondContact O-N 2.95Å; Y81-N85 PolarHBondContact O-N 2.89Å; Y81-Y299 PolarHBondContact OH-OH 2.98Å
82	S	33.1	Very low	33.5	Very low	71 Å²	71	112 Å²	112	50%	0.497	56%	0.562	S	S	.	*	H	α-helix	trans	-68.4	-34.9	178	50.8	0	0	0	0	112.7	M78 N79	M78-S82 PolarHBondContact O-N 2.94Å; M78-S82 PolarHBondContact O-OG 3.35Å; N79-S82 PolarHBondContact O-OG 3.1Å
83	E	35.4	Very low	33.8	Very low	144 Å²	144	113.9 Å²	113.9	67%	0.673	57%	0.565	S	S	*	*	H	α-helix	trans	-69.5	-39.7	172.9	-75.4	-171.6	152.7	0	0	113	N79 N85 R86 S87	N79-E83 PolarHBondContact O-N 2.84Å; E83-N85 PolarHBondContact O-N 2.76Å; E83-R86 PolarHBondContact O-N 3.13Å; E83-S87 PolarHBondContact O-N 3.18Å; E83-S87 PolarHBondContact O-OG 2.95Å; E83-S87 VanDerWaalsContact O-OG 3.1Å
84	N	33.5	Very low	34	Very low	104 Å²	104	116.4 Å²	116.4	56%	0.556	57%	0.571	S	S	*	*	H	α-helix	trans	-70.2	-33.7	-176.6	-123.1	-0.5	0	0	0	113	K80 Y81 R86 S87 N88	K80-N84 PolarHBondContact O-N 3.47Å; Y81-N84 PolarHBondContact O-N 2.95Å; N84-R86 VanDerWaalsContact C-N 3.33Å; N84-R86 PolarHBondContact O-N 2.83Å; N84-S87 WeakPolarHBondContact O-CB 3.41Å; N84-S87 PolarHBondContact O-N 3.41Å; N84-N88 PolarHBondContact O-N 3.26Å; N84-N88 VanDerWaalsContact O-N 3.1Å
85	N	32.8	Very low	34.3	Very low	102 Å²	102	116.9 Å²	116.9	55%	0.545	58%	0.575	S	S	.	*	H	α-helix	trans	-68.2	-34	175.5	-76	-16.8	0	0	0	112.2	Y81 E83 S87 N88 E89	Y81-N85 PolarHBondContact O-N 2.89Å; E83-N85 PolarHBondContact O-N 2.76Å; N85-S87 VanDerWaalsContact C-N 3.3Å; N85-S87 PolarHBondContact O-N 3.38Å; N85-N88 PolarHBondContact O-N 3.3Å; N85-E89 PolarHBondContact O-N 2.76Å
86	R	34.4	Very low	34.5	Very low	186 Å²	186	119.4 Å²	119.4	70%	0.702	58%	0.584	S	S	*	*	H	α-helix	trans	-68	-31.5	176.1	-152.1	176	-171.5	-176.2	2.7	112.3	E83 N84 K90	E83-R86 PolarHBondContact O-N 3.13Å; N84-R86 VanDerWaalsContact C-N 3.33Å; N84-R86 PolarHBondContact O-N 2.83Å; R86-K90 PolarHBondContact O-N 3.38Å
87	S	40.7	Very low	34.6	Very low	66 Å²	66	119.9 Å²	119.9	46%	0.462	59%	0.591	S	S	.	*	H	α-helix	trans	-69.5	-41.3	172.9	-50.2	0	0	0	0	111.9	E83 N84 N85 K90 L91	E83-S87 PolarHBondContact O-N 3.18Å; E83-S87 PolarHBondContact O-OG 2.95Å; E83-S87 VanDerWaalsContact O-OG 3.1Å; N84-S87 WeakPolarHBondContact O-CB 3.41Å; N84-S87 PolarHBondContact O-N 3.41Å; N85-S87 VanDerWaalsContact C-N 3.3Å; N85-S87 PolarHBondContact O-N 3.38Å; S87-K90 PolarHBondContact O-N 3.5Å; S87-L91 PolarHBondContact O-N 3.2Å; S87-L91 VanDerWaalsContact O-N 3.09Å
88	N	36.7	Very low	34.6	Very low	86 Å²	86	119.5 Å²	119.5	46%	0.46	59%	0.593	S	S	.	*	H	α-helix	trans	-69.4	-38.4	178.6	-90.4	-16.8	0	0	0	112.8	N84 N85 K90 L91 I92	N84-N88 PolarHBondContact O-N 3.26Å; N84-N88 VanDerWaalsContact O-N 3.1Å; N85-N88 PolarHBondContact O-N 3.3Å; N88-K90 VanDerWaalsContact C-N 3.31Å; N88-K90 PolarHBondContact O-N 2.98Å; N88-L91 WeakPolarHBondContact O-CB 2.95Å; N88-L91 PolarHBondContact O-N 3.08Å; N88-L91 VanDerWaalsContact O-N 3.12Å; N88-I92 WeakPolarHBondContact O-CG1 3.31Å; N88-I92 PolarHBondContact O-N 3.29Å
89	E	40.1	Very low	34.8	Very low	141 Å²	141	120.9 Å²	120.9	66%	0.659	60%	0.603	S	S	*	*	H	α-helix	trans	-61.1	-40.6	173.6	-81.7	-172.6	159.5	0	0	111.8	N85 L91 I92 Q93	N85-E89 PolarHBondContact O-N 2.76Å; E89-L91 VanDerWaalsContact C-N 3.31Å; E89-L91 PolarHBondContact O-N 3.18Å; E89-I92 PolarHBondContact O-N 3.33Å; E89-Q93 VanDerWaalsContact O-CB 3.28Å; E89-Q93 WeakPolarHBondContact O-CB 3.4Å; E89-Q93 PolarHBondContact O-N 3.27Å
90	K	42.7	Very low	34.6	Very low	147 Å²	147	120.7 Å²	120.7	64%	0.639	60%	0.602	S	S	*	*	H	α-helix	trans	-63.3	-36.6	173.5	-75.5	-176.9	178.4	-179.5	0	112.4	R86 S87 N88 F94	R86-K90 PolarHBondContact O-N 3.38Å; S87-K90 PolarHBondContact O-N 3.5Å; N88-K90 VanDerWaalsContact C-N 3.31Å; N88-K90 PolarHBondContact O-N 2.98Å; K90-F94 WeakPolarHBondContact O-CB 3.25Å; K90-F94 PolarHBondContact O-N 3.43Å
91	L	35.6	Very low	34.3	Very low	109 Å²	109	118.8 Å²	118.8	57%	0.571	61%	0.605	S	S	*	*	H	α-helix	trans	-69.2	-42.2	177.5	-160	84.2	0	0	0	111.7	S87 N88 E89 F94 M95	S87-L91 PolarHBondContact O-N 3.2Å; S87-L91 VanDerWaalsContact O-N 3.09Å; N88-L91 WeakPolarHBondContact O-CB 2.95Å; N88-L91 PolarHBondContact O-N 3.08Å; N88-L91 VanDerWaalsContact O-N 3.12Å; E89-L91 VanDerWaalsContact C-N 3.31Å; E89-L91 PolarHBondContact O-N 3.18Å; L91-F94 WeakPolarHBondContact O-CB 3.32Å; L91-F94 PolarHBondContact O-N 2.94Å; L91-M95 WeakPolarHBondContact O-CG 3.12Å; L91-M95 PolarHBondContact O-N 2.91Å
92	I	36.7	Very low	34.1	Very low	99 Å²	99	120.1 Å²	120.1	51%	0.508	62%	0.619	S	S	.	*	H	α-helix	trans	-68.2	-39.4	177.7	-65	167.6	0	0	0	110.3	N88 E89 F94 M95 N96	N88-I92 WeakPolarHBondContact O-CG1 3.31Å; N88-I92 PolarHBondContact O-N 3.29Å; E89-I92 PolarHBondContact O-N 3.33Å; I92-F94 VanDerWaalsContact C-N 3.28Å; I92-F94 PolarHBondContact O-N 3.05Å; I92-M95 PolarHBondContact O-N 2.88Å; I92-N96 WeakPolarHBondContact O-CB 3.49Å; I92-N96 PolarHBondContact O-N 2.71Å
93	Q	37.7	Very low	33.7	Very low	132 Å²	132	123.8 Å²	123.8	62%	0.617	63%	0.631	S	S	*	*	H	α-helix	trans	-65.6	-33.7	175.2	-159.4	171.3	23.7	0	0	111.9	E89 N96 T97	E89-Q93 VanDerWaalsContact O-CB 3.28Å; E89-Q93 WeakPolarHBondContact O-CB 3.4Å; E89-Q93 PolarHBondContact O-N 3.27Å; Q93-N96 PolarHBondContact O-N 3.13Å; Q93-T97 PolarHBondContact O-N 3.41Å; Q93-T97 PolarHBondContact O-OG1 3.4Å
94	F	34.2	Very low	33.2	Very low	157 Å²	157	122.1 Å²	122.1	69%	0.689	64%	0.635	S	S	*	*	H	α-helix	trans	-68	-37.4	173	-158.6	-92	0	0	0	112.3	K90 L91 I92	K90-F94 WeakPolarHBondContact O-CB 3.25Å; K90-F94 PolarHBondContact O-N 3.43Å; L91-F94 WeakPolarHBondContact O-CB 3.32Å; L91-F94 PolarHBondContact O-N 2.94Å; I92-F94 VanDerWaalsContact C-N 3.28Å; I92-F94 PolarHBondContact O-N 3.05Å
95	M	33.3	Very low	32.8	Very low	142 Å²	142	122.1 Å²	122.1	70%	0.7	64%	0.643	S	S	*	*	H	α-helix	trans	-69.9	-34.6	176.1	-70.7	-71.5	-139.3	0	0	112.6	L91 I92	L91-M95 WeakPolarHBondContact O-CG 3.12Å; L91-M95 PolarHBondContact O-N 2.91Å; I92-M95 PolarHBondContact O-N 2.88Å
96	N	33.8	Very low	32.4	Very low	122 Å²	122	123.9 Å²	123.9	65%	0.652	65%	0.648	S	S	*	*	H	α-helix	trans	-88.4	-6.3	-173	-69.5	-14.1	0	0	0	114.8	I92 Q93	I92-N96 WeakPolarHBondContact O-CB 3.49Å; I92-N96 PolarHBondContact O-N 2.71Å; Q93-N96 PolarHBondContact O-N 3.13Å
97	T	30.4	Very low	32	Very low	103 Å²	103	125.5 Å²	125.5	63%	0.632	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105	8.8	-177.2	43	0	0	0	0	115.2	Q93	Q93-T97 PolarHBondContact O-N 3.41Å; Q93-T97 PolarHBondContact O-OG1 3.4Å
98	T	31.8	Very low	31.2	Very low	80 Å²	80	129 Å²	129	49%	0.491	67%	0.669	S	S	.	*			trans	-116	71.9	176.7	44.3	0	0	0	0	112.8	N100	T98-N100 PolarHBondContact O-N 3.08Å
99	D	31.8	Very low	30.6	Very low	161 Å²	161	130.4 Å²	130.4	86%	0.861	69%	0.686	S	S	*	*			trans	-70	42.6	152.8	-74.6	-36.9	0	0	0	111.2	P101	D99-P101 WeakPolarHBondContact O-CD 3.47Å
100	N	27.1	Very low	29.8	Very low	113 Å²	113	131.5 Å²	131.5	60%	0.604	70%	0.696	S	S	*	*			trans	-100.8	110.4	177.6	-84.5	-35.1	0	0	0	109.5	T98 I102	T98-N100 PolarHBondContact O-N 3.08Å; N100-I102 PolarHBondContact O-N 3.22Å
101	P	27.4	Very low	28.8	Very low	112 Å²	112	129.9 Å²	129.9	73%	0.727	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-74.5	21.7	-171.4	28.8	-34	0	0	0	115	D99	D99-P101 WeakPolarHBondContact O-CD 3.47Å
102	I	27.2	Very low	28.2	Very low	146 Å²	146	134 Å²	134	75%	0.749	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-86.6	-9.8	-173.3	-61.9	179.3	0	0	0	113.1	N100 S104	N100-I102 PolarHBondContact O-N 3.22Å; I102-S104 PolarHBondContact O-N 3.2Å
103	I	25.4	Very low	27.5	Very low	148 Å²	148	133.8 Å²	133.8	76%	0.759	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-87.4	21.3	-177	-47.2	172.4	0	0	0	113	S105	I103-S105 PolarHBondContact O-N 3.22Å
104	S	24.8	Very low	27	Very low	109 Å²	109	136.1 Å²	136.1	76%	0.762	73%	0.734	S	S	*	*	S	Bend	trans	-81.7	3.3	-176.6	71.2	0	0	0	0	116.3	I102	I102-S104 PolarHBondContact O-N 3.2Å
105	S	24.6	Very low	26.5	Very low	103 Å²	103	136.7 Å²	136.7	72%	0.72	74%	0.744	S	S	*	*	S	Bend	trans	-142.4	3.1	-174.8	56.8	0	0	0	0	118.5	I103	I103-S105 PolarHBondContact O-N 3.22Å
106	Q	24.6	Very low	26.1	Very low	139 Å²	139	132.7 Å²	132.7	65%	0.65	73%	0.73	S	S	*	*			trans	-117.2	69.5	175.1	-81	176.6	-13.5	0	0	112.1	Q108	Q106-Q108 HydrophobicContact CB-CG 4.43Å; Q106-Q108 HydrophobicContact CG-CG 4.21Å; Q106-Q108 PolarHBondContact O-N 2.83Å
107	K	25.7	Very low	26	Very low	221 Å²	221	135.9 Å²	135.9	96%	0.961	74%	0.741	S	S	*	*			trans	-71	54.7	146.5	-73.1	-178.5	177.6	176.4	0	108.9	S109	K107-S109 PolarHBondContact O-N 2.85Å
108	Q	24.2	Very low	26	Very low	138 Å²	138	139.3 Å²	139.3	65%	0.645	76%	0.755	S	S	*	*			trans	-83.6	113.7	166.3	-76.1	-176.8	-9.4	0	0	105.6	Q106 L110	Q106-Q108 HydrophobicContact CB-CG 4.43Å; Q106-Q108 HydrophobicContact CG-CG 4.21Å; Q106-Q108 PolarHBondContact O-N 2.83Å; Q108-L110 PolarHBondContact O-N 2.89Å
109	S	22.8	Very low	25.8	Very low	117 Å²	117	140.8 Å²	140.8	82%	0.818	76%	0.758	S	S	*	*			trans	-32.5	102.9	167.3	50.1	0	0	0	0	110.9	K107 S111	K107-S109 PolarHBondContact O-N 2.85Å; S109-S111 PolarHBondContact O-N 2.87Å
110	L	23.2	Very low	25.7	Very low	164 Å²	164	138.3 Å²	138.3	86%	0.859	75%	0.745	S	S	*	*			trans	-55.3	112	167.6	-88.7	155.6	0	0	0	106.9	Q108 F112	Q108-L110 PolarHBondContact O-N 2.89Å; L110-F112 VanDerWaalsContact C-N 3.25Å; L110-F112 PolarHBondContact O-N 2.76Å
111	S	22.7	Very low	26.1	Very low	112 Å²	112	141.8 Å²	141.8	78%	0.783	75%	0.754	S	S	*	*			trans	-66.3	85.5	176.9	52.1	0	0	0	0	108.9	S109 C113	S109-S111 PolarHBondContact O-N 2.87Å; S111-C113 PolarHBondContact O-N 3.27Å
112	F	23.5	Very low	26.5	Very low	196 Å²	196	143.5 Å²	143.5	86%	0.86	75%	0.753	S	S	*	*			trans	-77.2	64.3	178.3	-143.1	-84.3	0	0	0	109.9	L110	L110-F112 VanDerWaalsContact C-N 3.25Å; L110-F112 PolarHBondContact O-N 2.76Å
113	C	21.2	Very low	26.7	Very low	95 Å²	95	141.9 Å²	141.9	64%	0.642	75%	0.745	S	S	*	*			trans	-158.7	85.3	177.6	-93.1	0	0	0	0	111	S111	S111-C113 PolarHBondContact O-N 3.27Å
114	Q	26.9	Very low	26.9	Very low	180 Å²	180	138.2 Å²	138.2	84%	0.841	73%	0.732	S	S	*	*	S	Bend	trans	-130.9	-9.5	153.9	-82.4	-168.2	-18	0	0	115.1
115	N	24.4	Very low	27.2	Very low	169 Å²	169	138.4 Å²	138.4	90%	0.904	72%	0.721	S	S	*	*	S	Bend	trans	-112.1	14.1	-175.8	-71.4	-8.4	0	0	0	115.9
116	S	25.5	Very low	27.5	Very low	58 Å²	58	137.9 Å²	137.9	41%	0.406	71%	0.713	S	S	.	*			trans	-109.2	48.8	-179.3	47.2	0	0	0	0	113	L118	S116-L118 PolarHBondContact O-N 3Å
117	Q	30.7	Very low	27.6	Very low	190 Å²	190	139.4 Å²	139.4	89%	0.888	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	1.2	174.6	-78	-172.1	-0.5	0	0	114.7
118	L	29.9	Very low	28.1	Very low	175 Å²	175	135.4 Å²	135.4	92%	0.916	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.4	6.9	-177.4	-82	159.1	0	0	0	115	S116 N120	S116-L118 PolarHBondContact O-N 3Å; L118-N120 PolarHBondContact O-N 3.43Å
119	I	29	Very low	28.8	Very low	111 Å²	111	133.2 Å²	133.2	57%	0.569	69%	0.69	S	S	*	*	S	Bend	trans	-88.5	110.5	176.4	-59.8	176.2	0	0	0	108.3	K121	I119-K121 PolarHBondContact O-N 3.29Å
120	N	29.5	Very low	29.1	Very low	108 Å²	108	135.3 Å²	135.3	58%	0.578	68%	0.681	S	S	*	*			trans	-41.3	120.7	177.5	-163.8	-8.7	0	0	0	111.2	L118 E122 L123	L118-N120 PolarHBondContact O-N 3.43Å; N120-E122 PolarHBondContact O-N 3Å; N120-L123 PolarHBondContact O-N 3.43Å
121	K	34.7	Very low	29.6	Very low	186 Å²	186	133.5 Å²	133.5	81%	0.809	67%	0.668	S	S	*	*	H	α-helix	trans	-53.1	-29.7	-171.4	-85.6	179.8	174.8	176.6	0	113.5	I119 Q125	I119-K121 PolarHBondContact O-N 3.29Å; K121-Q125 PolarHBondContact O-N 2.87Å
122	E	36.2	Very low	30.3	Very low	149 Å²	149	134.8 Å²	134.8	70%	0.696	66%	0.661	S	S	*	*	H	α-helix	trans	-66	-38.5	179	-73	-178.1	155.4	0	0	112.8	N120 C124 Q125 T126	N120-E122 PolarHBondContact O-N 3Å; E122-C124 VanDerWaalsContact C-N 3.31Å; E122-C124 PolarHBondContact O-N 2.69Å; E122-Q125 PolarHBondContact O-N 2.93Å; E122-T126 PolarHBondContact O-N 3.12Å; E122-T126 PolarHBondContact O-OG1 3.09Å
123	L	30.8	Very low	30.9	Very low	111 Å²	111	132.6 Å²	132.6	58%	0.581	65%	0.654	S	S	*	*	H	α-helix	trans	-69.4	-31.7	-176.9	-126.9	118.6	0	0	0	112.3	N120 Q125 Y127	N120-L123 PolarHBondContact O-N 3.43Å; L123-Q125 VanDerWaalsContact C-N 3.33Å; L123-Y127 PolarHBondContact O-N 2.87Å
124	C	29.2	Very low	31.6	Very low	71 Å²	71	133 Å²	133	48%	0.48	65%	0.646	S	S	.	*	H	α-helix	trans	-74.4	-26.1	178.1	-154	0	0	0	0	112.3	E122 K128	E122-C124 VanDerWaalsContact C-N 3.31Å; E122-C124 PolarHBondContact O-N 2.69Å; C124-K128 PolarHBondContact O-N 3.11Å
125	Q	32.1	Very low	31.8	Very low	113 Å²	113	133.6 Å²	133.6	53%	0.528	64%	0.64	S	S	.	*	H	α-helix	trans	-74.2	-40.3	176.8	-151.2	72.2	27.8	0	0	111.1	K121 E122 L123 Y127 K128 N129	K121-Q125 PolarHBondContact O-N 2.87Å; E122-Q125 PolarHBondContact O-N 2.93Å; L123-Q125 VanDerWaalsContact C-N 3.33Å; Q125-Y127 VanDerWaalsContact C-N 3.3Å; Q125-Y127 PolarHBondContact O-N 3.09Å; Q125-K128 PolarHBondContact O-N 3.37Å; Q125-N129 PolarHBondContact O-N 3.22Å; Q125-N129 VanDerWaalsContact O-N 3.08Å
126	T	30	Very low	32.3	Very low	92 Å²	92	132.5 Å²	132.5	56%	0.564	63%	0.634	S	S	*	*	H	α-helix	trans	-61.5	-40.2	176.6	-39.7	0	0	0	0	111.5	E122 K128 N129 Y130	E122-T126 PolarHBondContact O-N 3.12Å; E122-T126 PolarHBondContact O-OG1 3.09Å; T126-K128 PolarHBondContact O-N 3.38Å; T126-N129 PolarHBondContact O-N 2.97Å; T126-Y130 WeakPolarHBondContact O-CB 3.47Å; T126-Y130 PolarHBondContact O-N 3.33Å
127	Y	27	Very low	32.5	Very low	172 Å²	172	134.6 Å²	134.6	68%	0.675	65%	0.645	S	S	*	*	H	α-helix	trans	-66.5	-33.4	176.4	-108.6	-84.8	0	0	0	113.5	L123 Q125 H131	L123-Y127 PolarHBondContact O-N 2.87Å; Q125-Y127 VanDerWaalsContact C-N 3.3Å; Q125-Y127 PolarHBondContact O-N 3.09Å; Y127-H131 PolarHBondContact O-N 3.19Å
128	K	36.1	Very low	32.4	Very low	137 Å²	137	132 Å²	132	60%	0.596	64%	0.636	S	S	*	*	H	α-helix	trans	-68.7	-45	175	-80.3	-175.6	175.9	-178.6	0	111.5	C124 Q125 T126 H131 E132	C124-K128 PolarHBondContact O-N 3.11Å; Q125-K128 PolarHBondContact O-N 3.37Å; T126-K128 PolarHBondContact O-N 3.38Å; K128-H131 PolarHBondContact O-N 3.41Å; K128-E132 PolarHBondContact O-N 3.42Å
129	N	39.1	Very low	32.3	Very low	92 Å²	92	129 Å²	129	49%	0.492	63%	0.628	S	S	.	*	H	α-helix	trans	-69.1	-38.2	-178	-67	-2.9	0	0	0	112	Q125 T126 H131 E132 E133	Q125-N129 PolarHBondContact O-N 3.22Å; Q125-N129 VanDerWaalsContact O-N 3.08Å; T126-N129 PolarHBondContact O-N 2.97Å; N129-H131 VanDerWaalsContact C-N 3.26Å; N129-H131 PolarHBondContact O-N 3.16Å; N129-E132 PolarHBondContact O-N 2.97Å; N129-E133 PolarHBondContact O-N 3.28Å
130	Y	30	Very low	32.3	Very low	160 Å²	160	132 Å²	132	63%	0.627	64%	0.644	S	S	*	*	H	α-helix	trans	-65.7	-30.6	179.3	-153	-93	0	0	0	112.6	T126 H134	T126-Y130 WeakPolarHBondContact O-CB 3.47Å; T126-Y130 PolarHBondContact O-N 3.33Å; Y130-H134 AromaticContact CE1-CD2 3.87Å; Y130-H134 AromaticContact CE1-NE2 3.89Å; Y130-H134 AromaticContact CZ-NE2 3.89Å; Y130-H134 PolarHBondContact O-CD2 3.21Å
131	H	33.3	Very low	32.1	Very low	127 Å²	127	131.8 Å²	131.8	59%	0.588	65%	0.651	S	S	*	*	H	α-helix	trans	-81.7	-16.3	-178.9	-138.4	-53.5	0	0	0	113.7	Y127 K128 N129	Y127-H131 PolarHBondContact O-N 3.19Å; K128-H131 PolarHBondContact O-N 3.41Å; N129-H131 VanDerWaalsContact C-N 3.26Å; N129-H131 PolarHBondContact O-N 3.16Å
132	E	36.8	Very low	31.8	Very low	138 Å²	138	132.5 Å²	132.5	65%	0.645	65%	0.654	S	S	*	*	H	α-helix	trans	-93.5	-38.4	-175.9	-150.6	150.1	-147	0	0	111.9	K128 N129 H134 R135	K128-E132 PolarHBondContact O-N 3.42Å; N129-E132 PolarHBondContact O-N 2.97Å; E132-H134 VanDerWaalsContact C-N 3.28Å; E132-H134 PolarHBondContact O-N 2.99Å; E132-R135 PolarHBondContact O-N 3.21Å
133	E	37.7	Very low	31.2	Very low	150 Å²	150	132.5 Å²	132.5	70%	0.701	66%	0.657	S	S	*	*	H	α-helix	trans	-63.2	-32.4	175.5	-77.5	-170.8	154.6	0	0	113	N129	N129-E133 PolarHBondContact O-N 3.28Å
134	H	35.2	Very low	31	Very low	103 Å²	103	131.3 Å²	131.3	48%	0.477	66%	0.658	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.5	-4	179.3	-67.6	-58.5	0	0	0	114.9	Y130 E132	Y130-H134 AromaticContact CE1-CD2 3.87Å; Y130-H134 AromaticContact CE1-NE2 3.89Å; Y130-H134 AromaticContact CZ-NE2 3.89Å; Y130-H134 PolarHBondContact O-CD2 3.21Å; E132-H134 VanDerWaalsContact C-N 3.28Å; E132-H134 PolarHBondContact O-N 2.99Å
135	R	30.4	Very low	30.6	Very low	193 Å²	193	134.2 Å²	134.2	73%	0.728	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-26.7	171.2	-86.9	-164.8	177.3	-162.5	2.4	113.2	E132	E132-R135 PolarHBondContact O-N 3.21Å
136	N	34.2	Very low	30.2	Very low	146 Å²	146	135.5 Å²	135.5	78%	0.781	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-4.4	-176.1	-67.8	-20.7	0	0	0	114.1
137	T	31.6	Very low	29.9	Very low	102 Å²	102	142.5 Å²	142.5	63%	0.626	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	-3.6	178.9	30.4	0	0	0	0	114.5	P139	T137-P139 VanDerWaalsContact O-CD 3.31Å; T137-P139 WeakPolarHBondContact O-CD 3.48Å
138	L	28	Very low	29.7	Very low	135 Å²	135	137.7 Å²	137.7	71%	0.707	70%	0.7	S	S	*	*	S	Bend	trans	-88.1	112.6	167.3	-111.3	82.2	0	0	0	109.5	L140	L138-L140 PolarHBondContact O-N 3.39Å
139	P	27.4	Very low	29.1	Very low	114 Å²	114	138.3 Å²	138.3	74%	0.74	71%	0.708	S	S	*	*			trans	-57.5	130.5	172.8	22.3	-29.9	0	0	0	108.7	T137 S141	T137-P139 VanDerWaalsContact O-CD 3.31Å; T137-P139 WeakPolarHBondContact O-CD 3.48Å; P139-S141 PolarHBondContact O-N 3.14Å
140	L	28.7	Very low	28.3	Very low	174 Å²	174	141.4 Å²	141.4	91%	0.911	73%	0.725	S	S	*	*			trans	-55.8	86.5	171.1	-92	79.4	0	0	0	108.6	L138 K142	L138-L140 PolarHBondContact O-N 3.39Å; L140-K142 PolarHBondContact O-N 3.43Å
141	S	26.2	Very low	28.1	Very low	102 Å²	102	138 Å²	138	71%	0.713	72%	0.724	S	S	*	*			trans	-67.8	120	165.1	57.1	0	0	0	0	106.1	P139 I143	P139-S141 PolarHBondContact O-N 3.14Å; S141-I143 PolarHBondContact O-N 3.4Å
142	K	27.5	Very low	27.9	Very low	202 Å²	202	138.9 Å²	138.9	88%	0.878	74%	0.739	S	S	*	*			trans	-44.7	107	179	-70.7	170.7	176.4	174.6	0	109.2	L140 S144	L140-K142 PolarHBondContact O-N 3.43Å; K142-S144 VanDerWaalsContact C-N 3.29Å; K142-S144 PolarHBondContact O-N 2.98Å
143	I	25	Very low	27.3	Very low	148 Å²	148	137.4 Å²	137.4	76%	0.759	74%	0.735	S	S	*	*			trans	-67.7	95.1	171.5	-61	171.3	0	0	0	106	S141 N145	S141-I143 PolarHBondContact O-N 3.4Å; I143-N145 PolarHBondContact O-N 2.91Å
144	S	25.1	Very low	26.8	Very low	86 Å²	86	137.9 Å²	137.9	60%	0.601	74%	0.743	S	S	*	*			trans	-75.1	109.5	167.8	172.1	0	0	0	0	107.5	K142 N146	K142-S144 VanDerWaalsContact C-N 3.29Å; K142-S144 PolarHBondContact O-N 2.98Å; S144-N146 VanDerWaalsContact C-N 3.26Å; S144-N146 PolarHBondContact O-N 2.95Å
145	N	21.5	Very low	26.3	Very low	132 Å²	132	139.4 Å²	139.4	71%	0.706	75%	0.75	S	S	*	*			trans	-72.1	75.9	178	-69.1	-32	0	0	0	110.5	I143	I143-N145 PolarHBondContact O-N 2.91Å
146	N	23.8	Very low	26.3	Very low	141 Å²	141	139.2 Å²	139.2	75%	0.754	75%	0.754	S	S	*	*			trans	-99.7	99.2	166.6	-76.9	-14.1	0	0	0	109.1	S144 G148	S144-N146 VanDerWaalsContact C-N 3.26Å; S144-N146 PolarHBondContact O-N 2.95Å; N146-G148 PolarHBondContact O-N 3Å
147	Y	23.3	Very low	25.9	Very low	238 Å²	238	137.8 Å²	137.8	93%	0.933	75%	0.754	S	S	*	*			trans	-47.1	106.8	160.4	-88.2	-105.8	0	0	0	108.8
148	G	22.5	Very low	25.5	Very low	71 Å²	71	143.5 Å²	143.5	73%	0.732	76%	0.764	S	S	*	*			trans	-145.6	88.1	-172.4	0	0	0	0	0	110.4	N146	N146-G148 PolarHBondContact O-N 3Å
149	I	23.6	Very low	25.5	Very low	151 Å²	151	145.6 Å²	145.6	77%	0.774	77%	0.768	S	S	*	*			trans	-42.6	133.5	172.1	-67.7	157.9	0	0	0	112.7
150	N	23.5	Very low	25.5	Very low	157 Å²	157	146.2 Å²	146.2	84%	0.84	76%	0.763	S	S	*	*			trans	41.9	93.1	152.4	-56	-14	0	0	0	118.5
151	S	25.6	Very low	25.5	Very low	87 Å²	87	144.1 Å²	144.1	61%	0.608	75%	0.751	S	S	*	*			trans	-148.7	111.3	152.1	167.5	0	0	0	0	108	N153	S151-N153 PolarHBondContact O-N 3.29Å; S151-N153 VanDerWaalsContact OG-CG 3.25Å; S151-N153 PolarHBondContact OG-ND2 3.21Å
152	T	28.4	Very low	25.7	Very low	146 Å²	146	146 Å²	146	90%	0.896	75%	0.748	S	S	*	*			trans	-68.8	45	175.3	46.3	0	0	0	0	112	D154	T152-D154 PolarHBondContact O-N 2.88Å; T152-D154 VanDerWaalsContact O-N 3.08Å
153	N	24.7	Very low	25.8	Very low	107 Å²	107	141.3 Å²	141.3	57%	0.572	73%	0.733	S	S	*	*			trans	-81.6	98	-179.3	-87.5	-10.9	0	0	0	110.2	S151 H155	S151-N153 PolarHBondContact O-N 3.29Å; S151-N153 VanDerWaalsContact OG-CG 3.25Å; S151-N153 PolarHBondContact OG-ND2 3.21Å; N153-H155 PolarHBondContact O-N 3.3Å
154	D	26.4	Very low	26	Very low	160 Å²	160	140.6 Å²	140.6	86%	0.856	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.9	38.6	166.7	-132.2	-0.3	0	0	0	114.2	T152	T152-D154 PolarHBondContact O-N 2.88Å; T152-D154 VanDerWaalsContact O-N 3.08Å
155	H	25.7	Very low	26.2	Very low	136 Å²	136	143.4 Å²	143.4	63%	0.63	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.6	3.6	-171.8	-66.4	-23.5	0	0	0	114	N153 C157	N153-H155 PolarHBondContact O-N 3.3Å; H155-C157 PolarHBondContact O-N 3.29Å
156	K	29.7	Very low	26.7	Very low	188 Å²	188	145.3 Å²	145.3	82%	0.817	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-1.1	-178.8	-100.3	-178.5	177.6	177.7	0	116.5
157	C	24.9	Very low	27	Very low	116 Å²	116	142.6 Å²	142.6	78%	0.784	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.3	24.1	179.8	-68.7	0	0	0	0	115.5	H155 F159	H155-C157 PolarHBondContact O-N 3.29Å; C157-F159 PolarHBondContact O-N 2.96Å
158	R	24	Very low	27.2	Very low	223 Å²	223	141.9 Å²	141.9	84%	0.842	73%	0.726	S	S	*	*			trans	-81.1	62.4	159	-79.8	-170.6	173	-157.7	-0.1	109.6	M160	R158-M160 PolarHBondContact O-N 3.3Å; R158-M160 VanDerWaalsContact O-N 3.13Å
159	F	27.2	Very low	27.7	Very low	179 Å²	179	145.6 Å²	145.6	79%	0.785	73%	0.729	S	S	*	*			trans	-69	108.9	161.4	-82.1	-82.6	0	0	0	106.6	C157 I161	C157-F159 PolarHBondContact O-N 2.96Å; F159-I161 PolarHBondContact O-N 3.22Å
160	M	28	Very low	27.9	Very low	127 Å²	127	146.7 Å²	146.7	63%	0.626	73%	0.731	S	S	*	*			trans	-62.8	103.2	178.2	-69.9	178.4	-79.1	0	0	108.2	R158 Q162 D163	R158-M160 PolarHBondContact O-N 3.3Å; R158-M160 VanDerWaalsContact O-N 3.13Å; M160-Q162 PolarHBondContact O-N 3.47Å; M160-D163 PolarHBondContact O-N 3.49Å; M160-D163 VanDerWaalsContact O-N 3.1Å
161	I	28.7	Very low	28.3	Very low	130 Å²	130	144.9 Å²	144.9	67%	0.667	73%	0.728	S	S	*	*	H	α-helix	trans	-51.8	-17.9	168.3	-67.3	172.6	0	0	0	111.2	F159 D163 I164	F159-I161 PolarHBondContact O-N 3.22Å; I161-D163 VanDerWaalsContact C-N 3.29Å; I161-D163 PolarHBondContact O-N 3.29Å; I161-I164 PolarHBondContact O-N 3.35Å
162	Q	30.8	Very low	28.4	Very low	140 Å²	140	146.2 Å²	146.2	65%	0.654	74%	0.737	S	S	*	*	H	α-helix	trans	-66.7	-22.3	177.9	-132.5	167.7	11.2	0	0	114.6	M160	M160-Q162 PolarHBondContact O-N 3.47Å
163	D	29.5	Very low	28.6	Very low	104 Å²	104	145.1 Å²	145.1	56%	0.556	74%	0.736	S	S	*	*	H	α-helix	trans	-81.2	-30.5	177.3	-69.4	-22.9	0	0	0	112.1	M160 I161 L165 K166	M160-D163 PolarHBondContact O-N 3.49Å; M160-D163 VanDerWaalsContact O-N 3.1Å; I161-D163 VanDerWaalsContact C-N 3.29Å; I161-D163 PolarHBondContact O-N 3.29Å; D163-L165 VanDerWaalsContact C-N 3.26Å; D163-L165 PolarHBondContact O-N 3.32Å; D163-K166 PolarHBondContact O-N 3.1Å
164	I	28.7	Very low	28.8	Very low	134 Å²	134	143.4 Å²	143.4	69%	0.687	74%	0.736	S	S	*	*	H	α-helix	trans	-69.9	-27.4	177	-59.4	177	0	0	0	111.1	I161	I161-I164 PolarHBondContact O-N 3.35Å
165	L	30.8	Very low	28.9	Very low	144 Å²	144	142.9 Å²	142.9	75%	0.754	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-10.6	176.7	-68	176.1	0	0	0	114	D163	D163-L165 VanDerWaalsContact C-N 3.26Å; D163-L165 PolarHBondContact O-N 3.32Å
166	K	31.3	Very low	29.4	Very low	173 Å²	173	142.9 Å²	142.9	75%	0.752	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	-15.4	177.9	-81.6	-174.3	177	179.9	0	114.7	D163 R168	D163-K166 PolarHBondContact O-N 3.1Å; K166-R168 PolarHBondContact O-N 3.01Å
167	S	28.9	Very low	29.5	Very low	83 Å²	83	142.9 Å²	142.9	58%	0.58	74%	0.739	S	S	*	*			trans	-101.3	61.7	175.4	64.9	0	0	0	0	111.2
168	R	29.2	Very low	30.1	Very low	223 Å²	223	144.3 Å²	144.3	84%	0.842	74%	0.739	S	S	*	*			trans	-127.9	84.6	156.9	-140.3	169.8	-172.6	155.4	0.5	106.6	K166 H170	K166-R168 PolarHBondContact O-N 3.01Å; R168-H170 PolarHBondContact O-N 3.29Å
169	D	31.6	Very low	30.6	Very low	149 Å²	149	141.6 Å²	141.6	80%	0.797	74%	0.741	S	S	*	*			trans	-47.4	109.3	172.3	-60.2	-56.3	0	0	0	108.1	P171	D169-P171 WeakPolarHBondContact O-CD 3.21Å
170	H	29.1	Very low	30.9	Very low	174 Å²	174	140.5 Å²	140.5	81%	0.806	74%	0.744	S	S	*	*			trans	-60.1	125.1	160.6	-73	-68.5	0	0	0	105.7	R168 S172	R168-H170 PolarHBondContact O-N 3.29Å; H170-S172 VanDerWaalsContact C-N 3.33Å; H170-S172 PolarHBondContact O-N 3.2Å
171	P	30.5	Very low	31	Very low	120 Å²	120	141.9 Å²	141.9	78%	0.779	75%	0.751	S	S	*	*			trans	-62.1	102.6	175.4	25.3	-31.3	0	0	0	107	D169 S173	D169-P171 WeakPolarHBondContact O-CD 3.21Å; P171-S173 VanDerWaalsContact C-N 3.26Å; P171-S173 PolarHBondContact O-N 3.2Å
172	S	29.3	Very low	31	Very low	114 Å²	114	142.6 Å²	142.6	80%	0.797	76%	0.756	S	S	*	*			trans	-58.8	97.9	161.3	-83.2	0	0	0	0	106.4	H170 A174	H170-S172 VanDerWaalsContact C-N 3.33Å; H170-S172 PolarHBondContact O-N 3.2Å; S172-A174 PolarHBondContact O-N 3.41Å
173	S	31.8	Very low	30.9	Very low	124 Å²	124	141 Å²	141	87%	0.867	76%	0.76	S	S	*	*			trans	-67.7	88.5	163.2	54.4	0	0	0	0	106.9	P171	P171-S173 VanDerWaalsContact C-N 3.26Å; P171-S173 PolarHBondContact O-N 3.2Å
174	A	27.7	Very low	30.7	Very low	70 Å²	70	143 Å²	143	58%	0.579	78%	0.776	S	S	*	*			trans	-85.8	135.6	171.7	0	0	0	0	0	108.7	S172	S172-A174 PolarHBondContact O-N 3.41Å
175	I	29	Very low	30.8	Very low	149 Å²	149	140.2 Å²	140.2	76%	0.764	77%	0.769	S	S	*	*			trans	81.1	111.3	154.5	-43.2	149	0	0	0	115.2
176	N	36.3	Very low	30.7	Very low	137 Å²	137	138.3 Å²	138.3	73%	0.733	77%	0.774	S	S	*	*				-169	94.7	111.9	-80.5	-21.8	0	0	0	107.3	D178	N176-D178 PolarHBondContact O-N 3.43Å
177	E	32.6	Very low	30.5	Very low	188 Å²	188	137.2 Å²	137.2	88%	0.879	78%	0.775	S	S	*	*			trans	-68.3	98.7	156.9	-69.6	174.8	168.5	0	0	106.6
178	D	37.6	Very low	30.4	Very low	145 Å²	145	141.7 Å²	141.7	78%	0.775	79%	0.786	S	S	*	*			trans	-124.7	94.1	163	-81.7	-39.1	0	0	0	107.7	N176 N180	N176-D178 PolarHBondContact O-N 3.43Å; D178-N180 PolarHBondContact O-N 3.4Å
179	D	34.5	Very low	30.3	Very low	166 Å²	166	138.8 Å²	138.8	89%	0.888	79%	0.787	S	S	*	*			trans	-56.1	110.2	161.6	-71.4	-43.6	0	0	0	109.4
180	N	32.2	Very low	30.2	Very low	156 Å²	156	140.2 Å²	140.2	83%	0.834	79%	0.789	S	S	*	*			trans	-154.6	112.9	144.6	-154.7	-1.3	0	0	0	112.5	D178	D178-N180 PolarHBondContact O-N 3.4Å
181	M	30.2	Very low	30.2	Very low	157 Å²	157	141.1 Å²	141.1	77%	0.773	79%	0.79	S	S	*	*			trans	-54.4	150	168	-69.7	-82.1	-157.8	0	0	111.6
182	N	29.7	Very low	30	Very low	144 Å²	144	139.6 Å²	139.6	77%	0.77	78%	0.782	S	S	*	*			trans	75	88	159.6	-57.2	-24.3	0	0	0	117.5
183	S	27.9	Very low	30.1	Very low	107 Å²	107	139.9 Å²	139.9	75%	0.748	78%	0.779	S	S	*	*				-147.4	89.5	128.2	51.6	0	0	0	0	110.3	S185	S183-S185 PolarHBondContact O-N 2.98Å
184	T	26.3	Very low	30	Very low	147 Å²	147	144 Å²	144	90%	0.902	78%	0.777	S	S	*	*			trans	-62.7	78.4	161.5	-45.1	0	0	0	0	108.2
185	S	29.8	Very low	30.1	Very low	75 Å²	75	147.2 Å²	147.2	52%	0.524	79%	0.785	S	S	.	*			trans	-114.6	102.9	169.6	51.2	0	0	0	0	107.3	S183 I187	S183-S185 PolarHBondContact O-N 2.98Å; S185-I187 PolarHBondContact O-N 2.89Å
186	A	28.5	Very low	30.1	Very low	104 Å²	104	145.4 Å²	145.4	86%	0.86	79%	0.785	S	S	*	*			trans	-62.7	82.3	171.3	0	0	0	0	0	108.6	Q188	A186-Q188 PolarHBondContact O-N 3.27Å
187	I	27.5	Very low	29.8	Very low	150 Å²	150	148.2 Å²	148.2	77%	0.769	79%	0.791	S	S	*	*			trans	-75.3	116.2	170.3	-62.7	175.3	0	0	0	106.2	S185 L189	S185-I187 PolarHBondContact O-N 2.89Å; I187-L189 PolarHBondContact O-N 3.1Å
188	Q	27.3	Very low	29.6	Very low	176 Å²	176	144.3 Å²	144.3	82%	0.822	78%	0.784	S	S	*	*			trans	-44.9	123.2	178.3	-80.1	166.7	-25.3	0	0	110.6	A186 E190	A186-Q188 PolarHBondContact O-N 3.27Å; Q188-E190 VanDerWaalsContact C-N 3.25Å; Q188-E190 PolarHBondContact O-N 3.32Å
189	L	27.7	Very low	29.2	Very low	163 Å²	163	147.1 Å²	147.1	85%	0.853	79%	0.79	S	S	*	*			trans	-61.6	89.4	168.3	-128.3	145.4	0	0	0	107.3	I187 K191	I187-L189 PolarHBondContact O-N 3.1Å; L189-K191 PolarHBondContact O-N 3.43Å
190	E	28	Very low	29.1	Very low	179 Å²	179	148.3 Å²	148.3	84%	0.836	79%	0.787	S	S	*	*			trans	-59.6	106.8	162.3	-78.7	-168	161.5	0	0	106.4	Q188 S192	Q188-E190 VanDerWaalsContact C-N 3.25Å; Q188-E190 PolarHBondContact O-N 3.32Å; E190-S192 PolarHBondContact O-N 3.49Å
191	K	30	Very low	29	Very low	192 Å²	192	149.8 Å²	149.8	84%	0.835	79%	0.789	S	S	*	*			trans	-60	88.5	168.7	-72.7	172.3	176.9	174.1	0	106.9	L189 V193	L189-K191 PolarHBondContact O-N 3.43Å; K191-V193 PolarHBondContact O-N 3.5Å
192	S	26.3	Very low	28.9	Very low	89 Å²	89	147 Å²	147	62%	0.622	78%	0.784	S	S	*	*			trans	-60	113.3	162.8	49.4	0	0	0	0	106.3	E190 Y194	E190-S192 PolarHBondContact O-N 3.49Å; S192-Y194 VanDerWaalsContact C-N 3.26Å; S192-Y194 PolarHBondContact O-N 2.83Å
193	V	32.1	Very low	28.8	Very low	120 Å²	120	145.4 Å²	145.4	73%	0.727	78%	0.784	S	S	*	*			trans	-59	97.7	169.7	175	0	0	0	0	105.1	K191 D195	K191-V193 PolarHBondContact O-N 3.5Å; V193-D195 PolarHBondContact O-N 3.28Å
194	Y	28.5	Very low	28.8	Very low	209 Å²	209	148.8 Å²	148.8	82%	0.82	79%	0.787	S	S	*	*			trans	-61.9	94.8	162.7	-88.8	-91.8	0	0	0	105.8	S192 S196	S192-Y194 VanDerWaalsContact C-N 3.26Å; S192-Y194 PolarHBondContact O-N 2.83Å; Y194-S196 PolarHBondContact O-N 3.37Å
195	D	29.1	Very low	28.9	Very low	139 Å²	139	146.1 Å²	146.1	74%	0.743	78%	0.775	S	S	*	*			trans	-59.6	88.1	156.1	-84.4	-23.4	0	0	0	106	V193 K197	V193-D195 PolarHBondContact O-N 3.28Å; D195-K197 PolarHBondContact O-N 3.21Å
196	S	29.7	Very low	28.8	Very low	110 Å²	110	149.5 Å²	149.5	77%	0.769	79%	0.787	S	S	*	*			trans	-59.7	90.6	163.4	33.7	0	0	0	0	105.7	Y194 S198	Y194-S196 PolarHBondContact O-N 3.37Å; S196-S198 PolarHBondContact O-N 3.15Å
197	K	29.7	Very low	28.7	Very low	197 Å²	197	150.9 Å²	150.9	86%	0.857	78%	0.779	S	S	*	*			trans	-50.5	110.3	165.8	-80	177.9	178.8	172.1	0	105.6	D195 F199	D195-K197 PolarHBondContact O-N 3.21Å; K197-F199 PolarHBondContact O-N 2.95Å
198	S	28.4	Very low	28.7	Very low	105 Å²	105	149.8 Å²	149.8	73%	0.734	77%	0.773	S	S	*	*			trans	-49.3	126.9	177.8	43.9	0	0	0	0	108.1	S196 K200	S196-S198 PolarHBondContact O-N 3.15Å; S198-K200 PolarHBondContact O-N 3.17Å
199	F	30.9	Very low	28.7	Very low	205 Å²	205	149.9 Å²	149.9	90%	0.899	77%	0.771	S	S	*	*			trans	-44	114.7	163	-111.1	-102.6	0	0	0	106.5	K197 E201	K197-F199 PolarHBondContact O-N 2.95Å; F199-E201 PolarHBondContact O-N 3.44Å
200	K	32.5	Very low	28.5	Very low	191 Å²	191	151.2 Å²	151.2	83%	0.83	77%	0.77	S	S	*	*			trans	-62.3	98.9	167.6	-83.8	-179.7	176	176.9	0	104.9	S198 C202	S198-K200 PolarHBondContact O-N 3.17Å; K200-C202 VanDerWaalsContact C-N 3.28Å; K200-C202 PolarHBondContact O-N 3.13Å
201	E	28.5	Very low	28.4	Very low	187 Å²	187	148.8 Å²	148.8	87%	0.874	76%	0.763	S	S	*	*			trans	-51.7	103.3	159.9	-94.1	178.9	151.6	0	0	105.7	F199 S203	F199-E201 PolarHBondContact O-N 3.44Å; E201-S203 PolarHBondContact O-N 3.27Å
202	C	28.9	Very low	28.4	Very low	98 Å²	98	149.4 Å²	149.4	66%	0.662	77%	0.766	S	S	*	*			trans	-61.9	103.4	176.1	-87.8	0	0	0	0	106.8	K200 H204	K200-C202 VanDerWaalsContact C-N 3.28Å; K200-C202 PolarHBondContact O-N 3.13Å; C202-H204 PolarHBondContact O-N 3.32Å
203	S	27.3	Very low	28.7	Very low	111 Å²	111	150.7 Å²	150.7	78%	0.776	77%	0.766	S	S	*	*			trans	-55.3	104.1	165.7	48.7	0	0	0	0	107.1	E201 S205	E201-S203 PolarHBondContact O-N 3.27Å; S203-S205 PolarHBondContact O-N 3.49Å
204	H	28.7	Very low	28.8	Very low	177 Å²	177	151.9 Å²	151.9	82%	0.819	77%	0.768	S	S	*	*			trans	-46.7	116.6	168.1	-65.4	-76.7	0	0	0	107	C202 N206	C202-H204 PolarHBondContact O-N 3.32Å; H204-N206 PolarHBondContact O-N 3.13Å
205	S	27.4	Very low	28.8	Very low	92 Å²	92	150.3 Å²	150.3	64%	0.643	77%	0.774	S	S	*	*			trans	-57.9	111.2	177	36.1	0	0	0	0	107.1	S203 I207	S203-S205 PolarHBondContact O-N 3.49Å; S205-I207 PolarHBondContact O-N 3.41Å
206	N	27.1	Very low	28.9	Very low	146 Å²	146	152.1 Å²	152.1	78%	0.781	78%	0.775	S	S	*	*			trans	-55.3	113.9	173.8	-77.5	-42.9	0	0	0	107.4	H204 I208	H204-N206 PolarHBondContact O-N 3.13Å; N206-I208 PolarHBondContact O-N 3.18Å
207	I	28.4	Very low	29	Very low	133 Å²	133	152.4 Å²	152.4	68%	0.682	78%	0.777	S	S	*	*			trans	-65.8	97.3	175.7	-57.8	171.5	0	0	0	106.7	S205 F209	S205-I207 PolarHBondContact O-N 3.41Å; I207-F209 HydrophobicContact CB-CE2 4.12Å; I207-F209 HydrophobicContact CG2-CD2 3.77Å; I207-F209 HydrophobicContact CG2-CE1 4.28Å; I207-F209 HydrophobicContact CG2-CE2 3.36Å; I207-F209 HydrophobicContact CG2-CG 4.39Å; I207-F209 HydrophobicContact CG2-CZ 3.65Å; I207-F209 PolarHBondContact O-N 3.08Å
208	I	27.2	Very low	29.3	Very low	127 Å²	127	149.5 Å²	149.5	65%	0.651	78%	0.775	S	S	*	*			trans	-81.2	96.3	174.2	-60	175.2	0	0	0	107	N206 F210	N206-I208 PolarHBondContact O-N 3.18Å; I208-F210 HydrophobicContact CG2-CD2 4.19Å; I208-F210 HydrophobicContact CG2-CE2 4.04Å; I208-F210 HydrophobicContact CG2-CZ 4.42Å; I208-F210 PolarHBondContact O-N 3.13Å; I208-F210 VanDerWaalsContact O-N 3.13Å
209	F	27.4	Very low	29.5	Very low	177 Å²	177	151.1 Å²	151.1	78%	0.776	78%	0.776	S	S	*	*			trans	-68.1	105.7	165.9	-70.2	-85.1	0	0	0	108.6	I207 N211	I207-F209 HydrophobicContact CB-CE2 4.12Å; I207-F209 HydrophobicContact CG2-CD2 3.77Å; I207-F209 HydrophobicContact CG2-CE1 4.28Å; I207-F209 HydrophobicContact CG2-CE2 3.36Å; I207-F209 HydrophobicContact CG2-CG 4.39Å; I207-F209 HydrophobicContact CG2-CZ 3.65Å; I207-F209 PolarHBondContact O-N 3.08Å; F209-N211 PolarHBondContact O-N 3.1Å
210	F	23.5	Very low	29.6	Very low	191 Å²	191	151.3 Å²	151.3	84%	0.838	78%	0.776	S	S	*	*			trans	-70.2	94.3	168	-80.9	-87.7	0	0	0	109	I208 K212	I208-F210 HydrophobicContact CG2-CD2 4.19Å; I208-F210 HydrophobicContact CG2-CE2 4.04Å; I208-F210 HydrophobicContact CG2-CZ 4.42Å; I208-F210 PolarHBondContact O-N 3.13Å; I208-F210 VanDerWaalsContact O-N 3.13Å; F210-K212 PolarHBondContact O-N 3.05Å
211	N	25.5	Very low	29.8	Very low	129 Å²	129	149.3 Å²	149.3	69%	0.69	77%	0.773	S	S	*	*			trans	-77.7	114.6	160.4	-167.7	-12.1	0	0	0	107.4	F209 N213	F209-N211 PolarHBondContact O-N 3.1Å; N211-N213 PolarHBondContact O-N 3.33Å
212	K	30.6	Very low	30	Very low	205 Å²	205	151.6 Å²	151.6	89%	0.891	77%	0.774	S	S	*	*	S	Bend	trans	-65.9	-0.4	-173.7	-145.4	174.6	-174.8	178.3	0	113.8	F210	F210-K212 PolarHBondContact O-N 3.05Å
213	N	32.2	Very low	30.3	Very low	115 Å²	115	153.9 Å²	153.9	62%	0.615	78%	0.779	S	S	*	*	S	Bend	trans	-118.7	99.6	-177.6	-60.9	-17.6	0	0	0	109.4	N211	N211-N213 PolarHBondContact O-N 3.33Å
214	N	33	Very low	30.5	Very low	145 Å²	145	157.3 Å²	157.3	78%	0.775	78%	0.78	S	S	*	*			trans	141.2	98.4	149	-68.7	-28.7	0	0	0	112	K216	N214-K216 PolarHBondContact O-N 3.24Å
215	N	29.4	Very low	30.8	Very low	176 Å²	176	154.9 Å²	154.9	94%	0.941	78%	0.78	S	S	*	*			trans	-68.7	65	166.9	-69.1	-28.4	0	0	0	111.7
216	K	31.1	Very low	31	Very low	178 Å²	178	156.1 Å²	156.1	77%	0.774	78%	0.784	S	S	*	*			trans	-120.1	107.5	168.7	-77.1	-177.4	178.4	174.8	0	109.2	N214 V218	N214-K216 PolarHBondContact O-N 3.24Å; K216-V218 PolarHBondContact O-N 3.01Å
217	S	31.8	Very low	31.2	Very low	115 Å²	115	154.3 Å²	154.3	80%	0.804	78%	0.783	S	S	*	*			trans	-48.9	115.9	176	52	0	0	0	0	111.4	N219	S217-N219 PolarHBondContact O-N 3.01Å
218	V	34.8	Very low	31.4	Very low	136 Å²	136	156.2 Å²	156.2	82%	0.824	79%	0.786	S	S	*	*			trans	-80.7	116.1	174.3	-175.4	0	0	0	0	108.1	K216 K220	K216-V218 PolarHBondContact O-N 3.01Å; V218-K220 PolarHBondContact O-N 2.88Å
219	N	32.5	Very low	31.3	Very low	139 Å²	139	161.3 Å²	161.3	74%	0.743	80%	0.798	S	S	*	*			trans	-58.9	128.4	173	-80.5	-25.8	0	0	0	109.9	S217 I221	S217-N219 PolarHBondContact O-N 3.01Å; N219-I221 PolarHBondContact O-N 3.2Å
220	K	34	Very low	31.3	Very low	209 Å²	209	161.9 Å²	161.9	91%	0.909	80%	0.8	S	S	*	*			trans	-61.2	98.1	178.7	-68.4	177.8	178.5	178	0	110.1	V218 R222	V218-K220 PolarHBondContact O-N 2.88Å; K220-R222 PolarHBondContact O-N 3.12Å; K220-R222 VanDerWaalsContact O-N 3.15Å
221	I	36.1	Very low	31.6	Very low	149 Å²	149	162.1 Å²	162.1	76%	0.764	80%	0.801	S	S	*	*			trans	-73	107.2	168.3	-60.4	174.8	0	0	0	106.6	N219 N223	N219-I221 PolarHBondContact O-N 3.2Å; I221-N223 PolarHBondContact O-N 3.46Å; I221-N223 VanDerWaalsContact O-N 3.17Å
222	R	32.9	Very low	31.7	Very low	236 Å²	236	162.5 Å²	162.5	89%	0.891	81%	0.808	S	S	*	*			trans	-69.6	106.7	177.8	-167.3	176	-176.1	171.5	0.6	108.2	K220 K224	K220-R222 PolarHBondContact O-N 3.12Å; K220-R222 VanDerWaalsContact O-N 3.15Å; R222-K224 PolarHBondContact O-N 2.93Å; R222-K224 VanDerWaalsContact O-N 3.13Å
223	N	35.6	Very low	31.6	Very low	145 Å²	145	157.9 Å²	157.9	78%	0.775	80%	0.801	S	S	*	*			trans	-57.5	116.2	174.1	-68.5	-21.4	0	0	0	109	I221	I221-N223 PolarHBondContact O-N 3.46Å; I221-N223 VanDerWaalsContact O-N 3.17Å
224	K	32.3	Very low	31.5	Very low	184 Å²	184	158.2 Å²	158.2	80%	0.8	81%	0.807	S	S	*	*			trans	-70	138.2	166.2	-79.3	-178.9	177.2	178.5	0	107.9	R222 T226	R222-K224 PolarHBondContact O-N 2.93Å; R222-K224 VanDerWaalsContact O-N 3.13Å; K224-T226 PolarHBondContact O-N 3.4Å; K224-T226 VanDerWaalsContact O-N 3.08Å
225	P	33.5	Very low	31.3	Very low	125 Å²	125	157.8 Å²	157.8	81%	0.812	81%	0.81	S	S	*	*			trans	-66	109.4	178.9	24.8	-30.8	0	0	0	109.5	S227	P225-S227 PolarHBondContact O-N 2.96Å; P225-S227 VanDerWaalsContact O-N 3.13Å
226	T	33.2	Very low	31.2	Very low	118 Å²	118	156.5 Å²	156.5	72%	0.724	80%	0.799	S	S	*	*			trans	-77	94.9	169	-52.1	0	0	0	0	107.2	K224 F228	K224-T226 PolarHBondContact O-N 3.4Å; K224-T226 VanDerWaalsContact O-N 3.08Å; T226-F228 HydrophobicContact CG2-CD2 4.14Å; T226-F228 HydrophobicContact CG2-CE2 4.09Å; T226-F228 PolarHBondContact O-N 3.44Å; T226-F228 VanDerWaalsContact O-N 3.1Å
227	S	30.8	Very low	31.1	Very low	108 Å²	108	153.5 Å²	153.5	76%	0.755	80%	0.8	S	S	*	*			trans	-69.5	104.1	174.9	64.2	0	0	0	0	109.5	P225 R229	P225-S227 PolarHBondContact O-N 2.96Å; P225-S227 VanDerWaalsContact O-N 3.13Å; S227-R229 PolarHBondContact O-N 2.96Å
228	F	31.6	Very low	30.8	Very low	173 Å²	173	155.6 Å²	155.6	76%	0.759	80%	0.795	S	S	*	*			trans	-76.6	109.4	166	-97.9	-95.8	0	0	0	108.5	T226 F230	T226-F228 HydrophobicContact CG2-CD2 4.14Å; T226-F228 HydrophobicContact CG2-CE2 4.09Å; T226-F228 PolarHBondContact O-N 3.44Å; T226-F228 VanDerWaalsContact O-N 3.1Å; F228-F230 PolarHBondContact O-N 3.38Å
229	R	26.1	Very low	30.4	Very low	235 Å²	235	157.4 Å²	157.4	89%	0.887	79%	0.794	S	S	*	*			trans	-74.5	108.5	167.5	-103.5	-173.7	177.6	179.8	-0.3	108	S227 K231	S227-R229 PolarHBondContact O-N 2.96Å; R229-K231 PolarHBondContact O-N 2.85Å; R229-K231 VanDerWaalsContact O-N 3.12Å
230	F	26.6	Very low	30.1	Very low	188 Å²	188	155 Å²	155	83%	0.825	79%	0.789	S	S	*	*			trans	-60.7	111.6	162.1	-71.7	-82.9	0	0	0	108.3	F228 T232	F228-F230 PolarHBondContact O-N 3.38Å; F230-T232 PolarHBondContact O-N 3.48Å
231	K	29.3	Very low	29.7	Very low	197 Å²	197	149.6 Å²	149.6	86%	0.857	78%	0.777	S	S	*	*			trans	-75.5	108.4	159.8	-73.7	-176.6	177.4	-179.1	0	105.7	R229 S233	R229-K231 PolarHBondContact O-N 2.85Å; R229-K231 VanDerWaalsContact O-N 3.12Å; K231-S233 VanDerWaalsContact C-N 3.25Å; K231-S233 PolarHBondContact O-N 3.4Å
232	T	28.5	Very low	29.3	Very low	137 Å²	137	149.2 Å²	149.2	84%	0.84	78%	0.775	S	S	*	*			trans	-63.9	87.5	167.8	49.5	0	0	0	0	108.1	F230 T234	F230-T232 PolarHBondContact O-N 3.48Å; T232-T234 PolarHBondContact O-N 3.31Å
233	S	28.7	Very low	29	Very low	108 Å²	108	142.4 Å²	142.4	76%	0.755	76%	0.764	S	S	*	*			trans	-80	111.3	164	53.7	0	0	0	0	107.5	K231	K231-S233 VanDerWaalsContact C-N 3.25Å; K231-S233 PolarHBondContact O-N 3.4Å
234	T	29.2	Very low	28.7	Very low	121 Å²	121	143.1 Å²	143.1	74%	0.742	77%	0.767	S	S	*	*			trans	3.8	126.8	154.1	-26.6	0	0	0	0	116.3	T232 E236	T232-T234 PolarHBondContact O-N 3.31Å; T234-E236 PolarHBondContact O-N 3.29Å
235	T	28.3	Very low	28.5	Very low	136 Å²	136	139.8 Å²	139.8	83%	0.834	76%	0.762	S	S	*	*			trans	-37.6	97.4	165.1	49.2	0	0	0	0	113
236	E	29	Very low	28.3	Very low	150 Å²	150	139.5 Å²	139.5	70%	0.701	76%	0.763	S	S	*	*			trans	-103.7	99.2	156.2	-76.2	-175.6	177.5	0	0	106.8	T234 F238	T234-E236 PolarHBondContact O-N 3.29Å; E236-F238 VanDerWaalsContact C-N 3.26Å; E236-F238 HydrophobicContact CB-CD2 4.1Å; E236-F238 HydrophobicContact CB-CE2 3.97Å; E236-F238 PolarHBondContact O-N 3.47Å; E236-F238 WeakPolarHBondContact OE2-CE2 3.39Å
237	S	28.4	Very low	28.2	Very low	115 Å²	115	142.5 Å²	142.5	80%	0.804	77%	0.766	S	S	*	*			trans	-61.9	88.5	167	42.1	0	0	0	0	108.9	E239	S237-E239 VanDerWaalsContact C-N 3.28Å; S237-E239 PolarHBondContact O-N 3.26Å
238	F	26.4	Very low	28.1	Very low	158 Å²	158	145 Å²	145	69%	0.693	77%	0.771	S	S	*	*			trans	-74.7	87	166	-86.1	-86.4	0	0	0	108.5	E236 S240	E236-F238 VanDerWaalsContact C-N 3.26Å; E236-F238 HydrophobicContact CB-CD2 4.1Å; E236-F238 HydrophobicContact CB-CE2 3.97Å; E236-F238 PolarHBondContact O-N 3.47Å; E236-F238 WeakPolarHBondContact OE2-CE2 3.39Å; F238-S240 PolarHBondContact O-N 2.9Å
239	E	26.2	Very low	27.9	Very low	174 Å²	174	145.4 Å²	145.4	81%	0.813	78%	0.778	S	S	*	*			trans	-60.1	87.4	152.1	-76.2	-174.8	166.2	0	0	107.4	S237 S241	S237-E239 VanDerWaalsContact C-N 3.28Å; S237-E239 PolarHBondContact O-N 3.26Å; E239-S241 PolarHBondContact O-N 2.99Å
240	S	25.2	Very low	27.9	Very low	89 Å²	89	145.6 Å²	145.6	62%	0.622	78%	0.778	S	S	*	*			trans	-74.5	74.6	169.7	-61.5	0	0	0	0	107.7	F238 I242	F238-S240 PolarHBondContact O-N 2.9Å; S240-I242 PolarHBondContact O-N 3.42Å
241	S	26.7	Very low	28.1	Very low	96 Å²	96	141.8 Å²	141.8	67%	0.671	78%	0.775	S	S	*	*			trans	-68.7	82.5	161.1	39.6	0	0	0	0	107	E239 S243	E239-S241 PolarHBondContact O-N 2.99Å; S241-S243 PolarHBondContact O-N 3.39Å; S241-S243 PolarHBondContact O-OG 3.2Å
242	I	27.4	Very low	28.1	Very low	141 Å²	141	139 Å²	139	72%	0.723	77%	0.768	S	S	*	*			trans	-68.4	82	168.2	-56.1	173	0	0	0	106	S240 L244	S240-I242 PolarHBondContact O-N 3.42Å; I242-L244 VanDerWaalsContact C-N 3.31Å; I242-L244 HydrophobicContact CG2-CD2 4.39Å; I242-L244 PolarHBondContact O-N 2.96Å
243	S	26.3	Very low	28.2	Very low	93 Å²	93	137.6 Å²	137.6	65%	0.65	76%	0.761	S	S	*	*			trans	-66.1	98.2	164.3	28	0	0	0	0	105.7	S241 T245	S241-S243 PolarHBondContact O-N 3.39Å; S241-S243 PolarHBondContact O-OG 3.2Å; S243-T245 PolarHBondContact O-N 3.47Å
244	L	29.5	Very low	28.1	Very low	159 Å²	159	141 Å²	141	83%	0.832	76%	0.764	S	S	*	*			trans	-60.4	85.9	167.6	-71.4	167.8	0	0	0	107	I242 S246	I242-L244 VanDerWaalsContact C-N 3.31Å; I242-L244 HydrophobicContact CG2-CD2 4.39Å; I242-L244 PolarHBondContact O-N 2.96Å; L244-S246 VanDerWaalsContact C-N 3.33Å; L244-S246 PolarHBondContact O-N 3.48Å
245	T	27.1	Very low	28.2	Very low	115 Å²	115	141.1 Å²	141.1	71%	0.706	77%	0.765	S	S	*	*			trans	-65.6	101.3	170.5	45.9	0	0	0	0	106.3	S243 K247	S243-T245 PolarHBondContact O-N 3.47Å; T245-K247 PolarHBondContact O-N 3.49Å
246	S	30	Very low	28.1	Very low	119 Å²	119	138.8 Å²	138.8	83%	0.832	76%	0.76	S	S	*	*			trans	-63.8	77.2	176.6	56.1	0	0	0	0	109.7	L244	L244-S246 VanDerWaalsContact C-N 3.33Å; L244-S246 PolarHBondContact O-N 3.48Å
247	K	31.7	Very low	28	Very low	180 Å²	180	138.5 Å²	138.5	78%	0.783	76%	0.762	S	S	*	*			trans	-125.2	5.9	-179.1	-90.6	-170.8	176.4	178.4	0	116.3	T245	T245-K247 PolarHBondContact O-N 3.49Å
248	N	28.6	Very low	28	Very low	160 Å²	160	140.1 Å²	140.1	86%	0.856	76%	0.761	S	S	*	*			trans	-149.1	26.8	175.5	-95.1	-28.4	0	0	0	116.5	R250	N248-R250 VanDerWaalsContact C-N 3.3Å; N248-R250 PolarHBondContact O-N 2.9Å
249	M	27.1	Very low	28.2	Very low	183 Å²	183	137.6 Å²	137.6	90%	0.901	76%	0.759	S	S	*	*			trans	-76.9	91.4	161.7	-75	-70.7	150.8	0	0	107.8	S251	M249-S251 VanDerWaalsContact C-N 3.34Å; M249-S251 PolarHBondContact O-N 3.1Å
250	R	26.7	Very low	28.4	Very low	239 Å²	239	135.7 Å²	135.7	90%	0.902	75%	0.754	S	S	*	*			trans	-58.5	97.2	171.9	-163.8	175.4	-169.4	171.3	2	107.2	N248 I252	N248-R250 VanDerWaalsContact C-N 3.3Å; N248-R250 PolarHBondContact O-N 2.9Å; R250-I252 PolarHBondContact O-N 3.41Å
251	S	29.6	Very low	28.5	Very low	107 Å²	107	138.3 Å²	138.3	75%	0.748	76%	0.761	S	S	*	*			trans	-62	119.4	178.5	43.6	0	0	0	0	108.8	M249 P253	M249-S251 VanDerWaalsContact C-N 3.34Å; M249-S251 PolarHBondContact O-N 3.1Å; S251-P253 WeakPolarHBondContact O-CD 3.49Å
252	I	30.3	Very low	28.6	Very low	139 Å²	139	140 Å²	140	71%	0.713	76%	0.763	S	S	*	*			trans	-68.3	120.5	165	-61	172.8	0	0	0	105.2	R250 H254	R250-I252 PolarHBondContact O-N 3.41Å; I252-H254 PolarHBondContact O-N 2.9Å
253	P	29.4	Very low	28.6	Very low	108 Å²	108	140 Å²	140	70%	0.701	76%	0.764	S	S	*	*			trans	-65.1	106.7	178.6	24.9	-30.8	0	0	0	108.4	S251 V255	S251-P253 WeakPolarHBondContact O-CD 3.49Å; P253-V255 PolarHBondContact O-N 2.83Å
254	H	27.6	Very low	28.8	Very low	178 Å²	178	143.1 Å²	143.1	82%	0.824	77%	0.773	S	S	*	*			trans	-65.2	103.9	162.1	-72.1	-81.8	0	0	0	106.5	I252 A256	I252-H254 PolarHBondContact O-N 2.9Å; H254-A256 PolarHBondContact O-N 2.84Å
255	V	29.8	Very low	28.7	Very low	124 Å²	124	143.3 Å²	143.3	75%	0.752	78%	0.775	S	S	*	*			trans	-64.7	92.6	166.6	177.8	0	0	0	0	106.1	P253 I257	P253-V255 PolarHBondContact O-N 2.83Å; V255-I257 PolarHBondContact O-N 3.02Å
256	A	28.2	Very low	28.8	Very low	88 Å²	88	142.6 Å²	142.6	73%	0.727	78%	0.775	S	S	*	*			trans	-66.7	102.6	168	0	0	0	0	0	106.5	H254 N258	H254-A256 PolarHBondContact O-N 2.84Å; A256-N258 PolarHBondContact O-N 2.99Å
257	I	26.9	Very low	28.8	Very low	144 Å²	144	143.6 Å²	143.6	74%	0.738	77%	0.769	S	S	*	*			trans	-65.8	95.5	168.7	-60.9	171.6	0	0	0	105.3	V255 V259	V255-I257 PolarHBondContact O-N 3.02Å; I257-V259 PolarHBondContact O-N 3.08Å
258	N	27.2	Very low	28.6	Very low	148 Å²	148	141 Å²	141	79%	0.791	77%	0.769	S	S	*	*			trans	-71.6	101.2	176.4	-156.6	0.8	0	0	0	106.6	A256 N260	A256-N258 PolarHBondContact O-N 2.99Å; N258-N260 PolarHBondContact O-N 2.84Å
259	V	31.6	Very low	28.6	Very low	106 Å²	106	140.2 Å²	140.2	64%	0.642	76%	0.764	S	S	*	*			trans	-67.3	84	173.6	-176.6	0	0	0	0	106.7	I257 N261	I257-V259 PolarHBondContact O-N 3.08Å; V259-N261 VanDerWaalsContact C-N 3.3Å; V259-N261 PolarHBondContact O-N 3.12Å
260	N	29.2	Very low	28.6	Very low	134 Å²	134	139.7 Å²	139.7	72%	0.717	76%	0.759	S	S	*	*			trans	-74.3	92.2	172.8	-167	5.2	0	0	0	107.6	N258 N262	N258-N260 PolarHBondContact O-N 2.84Å; N260-N262 VanDerWaalsContact C-N 3.26Å; N260-N262 PolarHBondContact O-N 3.46Å
261	N	27.5	Very low	28.7	Very low	144 Å²	144	136.1 Å²	136.1	77%	0.77	76%	0.757	S	S	*	*			trans	-63.6	88.6	166	-76.9	-22.2	0	0	0	108.3	V259	V259-N261 VanDerWaalsContact C-N 3.3Å; V259-N261 PolarHBondContact O-N 3.12Å
262	N	28.8	Very low	28.7	Very low	132 Å²	132	139.9 Å²	139.9	71%	0.706	76%	0.763	S	S	*	*			trans	-136.4	107.7	162.4	-135.9	-4.7	0	0	0	110.7	N260 N264	N260-N262 VanDerWaalsContact C-N 3.26Å; N260-N262 PolarHBondContact O-N 3.46Å; N262-N264 PolarHBondContact O-N 2.94Å
263	N	28.4	Very low	28.7	Very low	139 Å²	139	142.4 Å²	142.4	74%	0.743	77%	0.768	S	S	*	*			trans	-26.5	121.5	162.5	-89.1	-27.3	0	0	0	112.8
264	N	30.2	Very low	28.6	Very low	160 Å²	160	144.9 Å²	144.9	86%	0.856	78%	0.776	S	S	*	*			trans	-152.9	95.8	145.4	-85.6	-35.6	0	0	0	108.7	N262 S266	N262-N264 PolarHBondContact O-N 2.94Å; N264-S266 PolarHBondContact O-N 2.99Å; N264-S266 VanDerWaalsContact O-N 3.16Å
265	N	26	Very low	28.7	Very low	162 Å²	162	145.9 Å²	145.9	87%	0.866	78%	0.781	S	S	*	*			trans	-59.5	106.2	163.2	-72.3	-26.8	0	0	0	109.4
266	S	29.7	Very low	28.5	Very low	100 Å²	100	145.1 Å²	145.1	70%	0.699	78%	0.781	S	S	*	*			trans	169.3	97.4	159.9	179.4	0	0	0	0	104.7	N264	N264-S266 PolarHBondContact O-N 2.99Å; N264-S266 VanDerWaalsContact O-N 3.16Å
267	I	30	Very low	28.3	Very low	140 Å²	140	150.8 Å²	150.8	72%	0.718	79%	0.785	S	S	*	*				-161.7	78.9	85.7	-68.5	137.8	0	0	0	105.8	N269	I267-N269 VanDerWaalsContact C-N 3.27Å
268	V	27.5	Very low	28.6	Very low	127 Å²	127	150.9 Å²	150.9	77%	0.77	79%	0.786	S	S	*	*			trans	-82.9	-2.4	174.3	168.9	0	0	0	0	111.9
269	N	28	Very low	28.5	Very low	143 Å²	143	147.1 Å²	147.1	77%	0.765	78%	0.783	S	S	*	*	S	Bend	trans	-113.1	23	-164.7	-75.8	1.6	0	0	0	117.6	I267	I267-N269 VanDerWaalsContact C-N 3.27Å
270	Q	27.9	Very low	28.4	Very low	171 Å²	171	151.2 Å²	151.2	80%	0.799	80%	0.795	S	S	*	*	S	Bend	trans	-135.3	13.1	-177.3	-71.6	-161.3	1.1	0	0	119.3
271	I	28.5	Very low	28.4	Very low	165 Å²	165	153.9 Å²	153.9	85%	0.846	80%	0.803	S	S	*	*	S	Bend	trans	-121.4	-4.7	173.7	-54.2	-179.6	0	0	0	114.3	K273	I271-K273 PolarHBondContact O-N 2.85Å
272	E	29	Very low	28.4	Very low	186 Å²	186	156.5 Å²	156.5	87%	0.869	81%	0.81	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	39.7	179.5	-76.6	-172.1	162.1	0	0	115.8
273	K	30.6	Very low	28.4	Very low	192 Å²	192	158.9 Å²	158.9	84%	0.835	82%	0.818	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.3	16.6	-178.8	-128.5	179.6	-175	178.5	0	119.8	I271	I271-K273 PolarHBondContact O-N 2.85Å
274	N	29.1	Very low	28.4	Very low	160 Å²	160	159.4 Å²	159.4	86%	0.856	82%	0.82	S	S	*	*			trans	-121.3	14.3	174.9	-70.5	-4.6	0	0	0	114.9	S276	N274-S276 VanDerWaalsContact C-N 3.35Å; N274-S276 PolarHBondContact O-N 3.19Å; N274-S276 VanDerWaalsContact O-N 3.15Å
275	E	29.5	Very low	28.3	Very low	198 Å²	198	163.2 Å²	163.2	93%	0.925	82%	0.823	S	S	*	*			trans	-85.8	69.6	172.2	-65.8	-170	170	0	0	111.4
276	S	24.3	Very low	28.5	Very low	109 Å²	109	164.9 Å²	164.9	76%	0.762	82%	0.822	S	S	*	*			trans	-167.4	58.8	170.9	171.5	0	0	0	0	112.1	N274	N274-S276 VanDerWaalsContact C-N 3.35Å; N274-S276 PolarHBondContact O-N 3.19Å; N274-S276 VanDerWaalsContact O-N 3.15Å
277	Y	25.4	Very low	28.8	Very low	206 Å²	206	169 Å²	169	81%	0.808	83%	0.83	S	S	*	*	S	Bend	trans	-167.3	128.8	151.6	-145.9	-127.2	0	0	0	112.7
278	L	32.4	Very low	29.1	Very low	146 Å²	146	170 Å²	170	76%	0.764	84%	0.837	S	S	*	*			trans	71.3	95.9	166.9	-63.6	164.2	0	0	0	116.8
279	G	25.2	Very low	29.7	Very low	70 Å²	70	169 Å²	169	72%	0.722	84%	0.836	S	S	*	*			trans	-73.8	176.9	154.1	0	0	0	0	0	112.8
280	E	28.8	Very low	30.1	Very low	192 Å²	192	170.1 Å²	170.1	90%	0.897	84%	0.836	S	S	*	*			trans	85.5	66	162.8	-56	-176.9	-172.7	0	0	118.7
281	E	29	Very low	30.3	Very low	189 Å²	189	168 Å²	168	88%	0.883	83%	0.83	S	S	*	*			trans	-144.7	71	143.6	-71.3	-166.2	169.8	0	0	110
282	Q	28.9	Very low	30.6	Very low	199 Å²	199	163.5 Å²	163.5	93%	0.93	82%	0.818	S	S	*	*			trans	-104.7	87	170.2	-82.8	-166.2	-5.1	0	0	110.4
283	E	27.9	Very low	30.8	Very low	183 Å²	183	161.8 Å²	161.8	86%	0.855	81%	0.81	S	S	*	*			trans	-147.2	60.1	161.7	-144.9	-179.3	-153.1	0	0	110.2
284	N	28.4	Very low	30.9	Very low	150 Å²	150	158.2 Å²	158.2	80%	0.802	80%	0.8	S	S	*	*			trans	-108.3	90	179.1	-94.7	-39.8	0	0	0	112.3	K286	N284-K286 PolarHBondContact O-N 3.25Å
285	R	29	Very low	31	Very low	239 Å²	239	153.9 Å²	153.9	90%	0.902	78%	0.78	S	S	*	*			trans	-1.5	102.2	142	-56.2	176.8	-167.7	-145.3	0.2	115.7
286	K	30.1	Very low	31.2	Very low	198 Å²	198	150.8 Å²	150.8	86%	0.861	77%	0.769	S	S	*	*			trans	-155.8	83.5	156.9	-72.1	-166.7	-178.3	175.4	0	111.4	N284	N284-K286 PolarHBondContact O-N 3.25Å
287	E	35.1	Very low	31.6	Very low	186 Å²	186	149.7 Å²	149.7	87%	0.869	76%	0.755	S	S	*	*			trans	-131.2	-1.9	164.1	-75.7	-167.6	167.1	0	0	115.6	S289	E287-S289 PolarHBondContact O-N 3.24Å
288	D	37.7	Very low	31.7	Very low	160 Å²	160	147.9 Å²	147.9	86%	0.856	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	8.6	-170.8	-66	-28.4	0	0	0	116.7
289	S	39.6	Very low	31.5	Very low	106 Å²	106	147.6 Å²	147.6	74%	0.741	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-10.1	-174.6	70.2	0	0	0	0	116.1	E287	E287-S289 PolarHBondContact O-N 3.24Å
290	E	35.2	Very low	31.9	Very low	167 Å²	167	147.9 Å²	147.9	78%	0.78	73%	0.728	S	S	*	*	S	Bend	trans	-88.1	-16.6	-174.7	-67.1	-166.8	167.4	0	0	114.5
291	N	33.9	Very low	32	Very low	126 Å²	126	148.3 Å²	148.3	67%	0.674	72%	0.722	S	S	*	*	H	α-helix	trans	-87.5	-23	-172	-154.1	3.7	0	0	0	114.7	T295	N291-T295 PolarHBondContact O-OG1 3.41Å
292	A	33.1	Very low	32.3	Very low	72 Å²	72	146.3 Å²	146.3	60%	0.595	71%	0.712	S	S	*	*	H	α-helix	trans	-74.6	-30.1	-176.7	0	0	0	0	0	113.6	T295	A292-T295 PolarHBondContact O-OG1 3.41Å
293	Q	34.5	Very low	32.7	Very low	150 Å²	150	143 Å²	143	70%	0.701	70%	0.696	S	S	*	*	H	α-helix	trans	-76.9	-28.3	-179.8	-66.6	-156.4	-7.2	0	0	112.8	N297	Q293-N297 PolarHBondContact O-N 3.19Å; Q293-N297 PolarHBondContact O-ND2 3.4Å
294	N	32.1	Very low	33.1	Very low	116 Å²	116	144.2 Å²	144.2	62%	0.62	69%	0.693	S	S	*	*	H	α-helix	trans	-74.2	-31.7	177	-81.8	-24.9	0	0	0	112.6	Y298	N294-Y298 PolarHBondContact O-N 2.97Å; N294-Y298 VanDerWaalsContact O-N 3.1Å
295	T	31	Very low	33.8	Very low	70 Å²	70	139.9 Å²	139.9	43%	0.429	67%	0.669	S	S	.	*	H	α-helix	trans	-70	-40.2	176.9	15	0	0	0	0	112.4	N291 A292 N297 Y298 Y299	N291-T295 PolarHBondContact O-OG1 3.41Å; A292-T295 PolarHBondContact O-OG1 3.41Å; T295-N297 VanDerWaalsContact C-N 3.29Å; T295-N297 PolarHBondContact O-N 3.28Å; T295-Y298 PolarHBondContact O-N 3.26Å; T295-Y299 WeakPolarHBondContact O-CD2 3.41Å; T295-Y299 PolarHBondContact O-N 3.06Å
296	L	33.7	Very low	34.3	Very low	132 Å²	132	133.6 Å²	133.6	69%	0.691	65%	0.653	S	S	*	*	H	α-helix	trans	-66.4	-33.3	178.2	-163.1	70.5	0	0	0	112.4	S300	L296-S300 PolarHBondContact O-OG 3.44Å; L296-S300 VanDerWaalsContact O-OG 3.08Å
297	N	32.3	Very low	34.6	Very low	87 Å²	87	129 Å²	129	47%	0.465	63%	0.632	S	S	.	*	H	α-helix	trans	-76.6	-22.5	175.7	-80.2	-29.9	0	0	0	113.6	Q293 T295 R301	Q293-N297 PolarHBondContact O-N 3.19Å; Q293-N297 PolarHBondContact O-ND2 3.4Å; T295-N297 VanDerWaalsContact C-N 3.29Å; T295-N297 PolarHBondContact O-N 3.28Å; N297-R301 PolarHBondContact O-N 3.29Å
298	Y	28.2	Very low	34.8	Very low	167 Å²	167	126.4 Å²	126.4	66%	0.655	62%	0.624	S	S	*	*	H	α-helix	trans	-71.5	-42.1	177.6	-157.7	-98	0	0	0	111.9	N294 T295 S300 R301	N294-Y298 PolarHBondContact O-N 2.97Å; N294-Y298 VanDerWaalsContact O-N 3.1Å; T295-Y298 PolarHBondContact O-N 3.26Å; Y298-S300 VanDerWaalsContact C-N 3.3Å; Y298-S300 PolarHBondContact O-N 3.22Å; Y298-R301 PolarHBondContact O-N 3.44Å
299	Y	28.4	Very low	34.9	Very low	141 Å²	141	127.8 Å²	127.8	55%	0.553	62%	0.617	S	S	*	*	H	α-helix	trans	-71.2	-24.6	178.1	-67.3	-71.1	0	0	0	113.7	Y81 T295	Y81-Y299 PolarHBondContact OH-OH 2.98Å; T295-Y299 WeakPolarHBondContact O-CD2 3.41Å; T295-Y299 PolarHBondContact O-N 3.06Å
300	S	32.9	Very low	35	Very low	76 Å²	76	125.2 Å²	125.2	53%	0.531	59%	0.592	S	S	.	*	H	α-helix	trans	-78.1	-27.3	180	-59.6	0	0	0	0	113.1	L296 Y298	L296-S300 PolarHBondContact O-OG 3.44Å; L296-S300 VanDerWaalsContact O-OG 3.08Å; Y298-S300 VanDerWaalsContact C-N 3.3Å; Y298-S300 PolarHBondContact O-N 3.22Å
301	R	31.7	Very low	35.4	Very low	201 Å²	201	121.8 Å²	121.8	76%	0.758	58%	0.583	S	S	*	*	H	α-helix	trans	-80.1	-35.8	-178.8	-71.5	-172.2	-162.9	-165	6.3	113.2	N297 Y298 H303 R304	N297-R301 PolarHBondContact O-N 3.29Å; Y298-R301 PolarHBondContact O-N 3.44Å; R301-H303 VanDerWaalsContact C-N 3.27Å; R301-H303 PolarHBondContact O-N 3.18Å; R301-R304 PolarHBondContact O-N 3.08Å
302	Q	33.9	Very low	36	Very low	146 Å²	146	123.5 Å²	123.5	68%	0.682	59%	0.587	S	S	*	*	H	α-helix	trans	-72.1	-18.3	-173.9	-149.8	66.1	27.9	0	0	113.9
303	H	38	Very low	36.6	Very low	130 Å²	130	124.8 Å²	124.8	60%	0.602	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	5.8	-178.9	-76.5	-67.2	0	0	0	115.4	R301 I305	R301-H303 VanDerWaalsContact C-N 3.27Å; R301-H303 PolarHBondContact O-N 3.18Å; H303-I305 PolarHBondContact O-N 3.39Å
304	R	36.8	Very low	37.4	Very low	209 Å²	209	127.9 Å²	127.9	79%	0.789	60%	0.598	S	S	*	*			trans	-72.7	75.8	154.9	-78.8	-171.8	171.8	-169.1	-1.9	107.4	R301 D306	R301-R304 PolarHBondContact O-N 3.08Å; R304-D306 VanDerWaalsContact C-N 3.31Å; R304-D306 PolarHBondContact O-N 2.98Å
305	I	42.9	Very low	38.7	Very low	59 Å²	59	129.4 Å²	129.4	30%	0.303	60%	0.601	S	S	.	*			trans	-47.9	109.8	151.9	-66.5	172.8	0	0	0	103.6	H303 Y307 F310 V333 Q337	H303-I305 PolarHBondContact O-N 3.39Å; I305-Y307 VanDerWaalsContact C-N 3.29Å; I305-Y307 PolarHBondContact O-N 2.73Å; I305-F310 HydrophobicContact CG2-CD2 4.34Å; I305-F310 HydrophobicContact CG2-CE2 3.41Å; I305-F310 VanDerWaalsContact CG2-CE2 3.41Å; I305-F310 HydrophobicContact CG2-CZ 4.05Å; I305-V333 HydrophobicContact CD1-CG1 4.38Å; I305-Q337 HydrophobicContact CD1-CG 4.4Å
306	D	39	Very low	40.5	Very low	106 Å²	106	131 Å²	131	57%	0.567	60%	0.604	S	S	*	*			trans	-51.2	96.6	-172.3	-80.2	-45.1	0	0	0	108.5	R304 N308 R309 F310	R304-D306 VanDerWaalsContact C-N 3.31Å; R304-D306 PolarHBondContact O-N 2.98Å; D306-N308 PolarHBondContact O-N 3.3Å; D306-N308 VanDerWaalsContact O-N 3.11Å; D306-R309 HydrophobicContact CB-CB 3.8Å; D306-R309 WeakPolarHBondContact O-CB 3.49Å; D306-R309 PolarHBondContact O-N 3.48Å; D306-F310 WeakPolarHBondContact O-CD2 3.42Å; D306-F310 WeakPolarHBondContact O-CE2 3.39Å
307	Y	36.7	Very low	42.3	Very low	102 Å²	102	126.6 Å²	126.6	40%	0.4	58%	0.58	S	S	.	*	G	3₁₀ helix	trans	-53.6	-37.6	178.7	-126.4	-93.1	0	0	0	108.9	I305 R309 F310 V311 I330	I305-Y307 VanDerWaalsContact C-N 3.29Å; I305-Y307 PolarHBondContact O-N 2.73Å; Y307-R309 VanDerWaalsContact C-N 3.28Å; Y307-R309 PolarHBondContact O-N 2.91Å; Y307-F310 PolarHBondContact O-N 2.75Å; Y307-F310 VanDerWaalsContact O-N 3.09Å; Y307-V311 WeakPolarHBondContact O-CG2 3.28Å; Y307-I330 HydrophobicContact CE1-CD1 4.38Å; Y307-I330 HydrophobicContact CE1-CG1 3.94Å; Y307-I330 WeakPolarHBondContact OH-CA 3.33Å; Y307-I330 WeakPolarHBondContact OH-CB 3.31Å; Y307-I330 WeakPolarHBondContact OH-CD1 3.45Å; Y307-I330 WeakPolarHBondContact OH-CG1 3.48Å; Y307-I330 VanDerWaalsContact OH-CG2 3.31Å; Y307-I330 WeakPolarHBondContact OH-CG2 3.33Å
308	N	39.6	Very low	44.7	Very low	131 Å²	131	126.9 Å²	126.9	70%	0.701	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-63	-28.1	178.1	-67.2	4.3	0	0	0	113.7	D306 F310 V311	D306-N308 PolarHBondContact O-N 3.3Å; D306-N308 VanDerWaalsContact O-N 3.11Å; N308-F310 PolarHBondContact O-N 2.75Å; N308-V311 PolarHBondContact O-N 3.4Å
309	R	39.7	Very low	47.5	Very low	190 Å²	190	119 Å²	119	72%	0.717	55%	0.55	S	S	*	*	G	3₁₀ helix	trans	-69	-17.5	176.7	-158.9	176.2	-166.2	-179.4	4.8	112.2	D306 Y307	D306-R309 HydrophobicContact CB-CB 3.8Å; D306-R309 WeakPolarHBondContact O-CB 3.49Å; D306-R309 PolarHBondContact O-N 3.48Å; Y307-R309 VanDerWaalsContact C-N 3.28Å; Y307-R309 PolarHBondContact O-N 2.91Å
310	F	41.4	Very low	50.1	Low	51 Å²	51	117.3 Å²	117.3	22%	0.224	56%	0.56	C	S	.	*	G	3₁₀ helix	trans	-104.3	5.2	179.3	-55.9	-79.1	0	0	0	113.4	I305 D306 Y307 N308 P329 F332	I305-F310 HydrophobicContact CG2-CD2 4.34Å; I305-F310 HydrophobicContact CG2-CE2 3.41Å; I305-F310 VanDerWaalsContact CG2-CE2 3.41Å; I305-F310 HydrophobicContact CG2-CZ 4.05Å; D306-F310 WeakPolarHBondContact O-CD2 3.42Å; D306-F310 WeakPolarHBondContact O-CE2 3.39Å; Y307-F310 PolarHBondContact O-N 2.75Å; Y307-F310 VanDerWaalsContact O-N 3.09Å; N308-F310 PolarHBondContact O-N 2.75Å; F310-P329 HydrophobicContact CB-CB 4.27Å; F310-F332 HydrophobicContact CD1-CD1 4.16Å; F310-F332 AromaticContact CD1-CE1 3.81Å; F310-F332 HydrophobicContact CD1-CE1 3.81Å; F310-F332 HydrophobicContact CE1-CD1 4.33Å; F310-F332 AromaticContact CE1-CE1 3.59Å; F310-F332 HydrophobicContact CE1-CE1 3.59Å; F310-F332 HydrophobicContact CE1-CZ 4.49Å; F310-F332 HydrophobicContact CZ-CE1 4.37Å
311	V	43.5	Very low	52.3	Low	96 Å²	96	118.4 Å²	118.4	58%	0.582	56%	0.563	S	S	*	*			trans	-92.5	-3.1	178.2	-172.1	0	0	0	0	111.9	Y307 N308 D313	Y307-V311 WeakPolarHBondContact O-CG2 3.28Å; N308-V311 PolarHBondContact O-N 3.4Å; V311-D313 VanDerWaalsContact C-N 3.32Å; V311-D313 PolarHBondContact O-N 2.75Å
312	E	47.8	Very low	55.1	Low	161 Å²	161	111.8 Å²	111.8	75%	0.752	55%	0.547	S	S	*	.	S	Bend	trans	-71.3	-20.8	-169	-78.8	-174	156.1	0	0	115.1
313	D	44.4	Very low	57.5	Low	99 Å²	99	111 Å²	111	53%	0.529	55%	0.547	S	S	.	.			trans	-134.3	125.1	178	-56.8	-55.3	0	0	0	110.6	V311 E315	V311-D313 VanDerWaalsContact C-N 3.32Å; V311-D313 PolarHBondContact O-N 2.75Å; D313-E315 HydrophobicContact CB-CB 3.95Å; D313-E315 HydrophobicContact CB-CG 4.19Å; D313-E315 PolarHBondContact O-N 2.73Å
314	E	50.8	Low	59.9	Low	216 Å²	216	108.8 Å²	108.8	100%	1.009	54%	0.539	S	S	*	.	S	Bend	trans	-61.3	2.3	163.9	-68	-170.9	159.7	0	0	112.3
315	E	59.5	Low	62.2	Low	147 Å²	147	100.9 Å²	100.9	69%	0.687	52%	0.517	S	S	*	.	S	Bend	trans	-74.6	137.2	171.3	-59.2	-167.8	162	0	0	110.6	D313 Q317	D313-E315 HydrophobicContact CB-CB 3.95Å; D313-E315 HydrophobicContact CB-CG 4.19Å; D313-E315 PolarHBondContact O-N 2.73Å; E315-Q317 PolarHBondContact O-N 2.9Å; E315-Q317 PolarHBondContact O-NE2 3.16Å
316	Q	68.8	Low	64.5	Low	105 Å²	105	99.5 Å²	99.5	49%	0.491	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-49.6	128.9	-179.3	-67.8	172.4	-15.7	0	0	111.5	N318 F326	Q316-N318 PolarHBondContact O-N 2.76Å; Q316-F326 WeakPolarHBondContact CA-O 3.38Å
317	Q	72.1	Confident	66.5	Low	39 Å²	39	99.6 Å²	99.6	18%	0.182	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	116.9	178.7	-63.9	-62.3	-39.4	0	0	109	E315 S325 F326 F332	E315-Q317 PolarHBondContact O-N 2.9Å; E315-Q317 PolarHBondContact O-NE2 3.16Å; Q317-S325 CarbonylContact O-C 3.53Å; Q317-S325 WeakPolarHBondContact O-CA 3.45Å; Q317-F326 PolarHBondContact N-O 3.33Å; Q317-F326 WeakPolarHBondContact O-CD2 3.21Å; Q317-F326 PolarHBondContact O-N 3.44Å; Q317-F332 HydrophobicContact CB-CB 4.2Å; Q317-F332 HydrophobicContact CB-CD2 4.11Å; Q317-F332 HydrophobicContact CB-CG 4.06Å
318	N	82.2	Confident	68.6	Low	93 Å²	93	100 Å²	100	50%	0.497	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	130.2	-179.2	-63.3	-40.7	0	0	0	110.7	Q316 S320 L324 S325	Q316-N318 PolarHBondContact O-N 2.76Å; N318-S320 PolarHBondContact O-N 3.49Å; N318-L324 CarbonylContact C-O 3.57Å; N318-L324 WeakPolarHBondContact CA-O 3.34Å; N318-S325 WeakPolarHBondContact OD1-CA 3.31Å; N318-S325 WeakPolarHBondContact OD1-CB 3.48Å
319	C	87.9	Confident	70.6	Confident	0 Å²	0	95.6 Å²	95.6	0%	0	50%	0.5	C	S	.	.	P	Polyproline II helix	trans	-66.9	116.6	169.9	176	0	0	0	0	110.4	T321 C322 N323 L324 F326 F332 H335 I336 H340	C319-T321 PolarHBondContact O-N 3.49Å; C319-T321 VanDerWaalsContact O-N 3.08Å; C319-T321 PolarHBondContact SG-N 3.36Å; C319-T321 VanDerWaalsContact SG-N 3.4Å; C319-C322 VanDerWaalsContact CB-SG 3.59Å; C319-C322 PolarHBondContact O-N 3.09Å; C319-N323 WeakPolarHBondContact O-CA 3.39Å; C319-N323 PolarHBondContact O-N 3.14Å; C319-N323 PolarHBondContact O-OD1 3.32Å; C319-L324 PolarHBondContact N-O 3.1Å; C319-F326 HydrophobicContact CB-CE2 4.31Å; C319-F332 HydrophobicContact CB-CE2 4.33Å; C319-H335 VanDerWaalsContact CB-NE2 3.31Å; C319-H335 WeakPolarHBondContact CB-NE2 3.46Å; C319-H335 PolarHBondContact SG-NE2 3.49Å; C319-I336 HydrophobicContact CB-CD1 4.35Å; C319-H340 PolarHBondContact SG-NE2 2.87Å
320	S	81.9	Confident	72.7	Confident	107 Å²	107	89.1 Å²	89.1	75%	0.748	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-19.3	178.6	58.2	0	0	0	0	114.3	N318	N318-S320 PolarHBondContact O-N 3.49Å
321	T	80.8	Confident	74.8	Confident	98 Å²	98	90.2 Å²	90.2	60%	0.601	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-35.7	-176.8	-52	0	0	0	0	112.9	C319 H340	C319-T321 PolarHBondContact O-N 3.49Å; C319-T321 VanDerWaalsContact O-N 3.08Å; C319-T321 PolarHBondContact SG-N 3.36Å; C319-T321 VanDerWaalsContact SG-N 3.4Å; T321-H340 VanDerWaalsContact CB-CE1 3.41Å; T321-H340 WeakPolarHBondContact CB-CE1 3.47Å; T321-H340 WeakPolarHBondContact CG2-CE1 3.4Å
322	C	89.9	Confident	76.9	Confident	63 Å²	63	86.9 Å²	86.9	43%	0.426	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.8	1.3	-179	69.6	0	0	0	0	114.6	C319 L324 H335	C319-C322 VanDerWaalsContact CB-SG 3.59Å; C319-C322 PolarHBondContact O-N 3.09Å; C322-L324 PolarHBondContact O-N 3.21Å; C322-L324 VanDerWaalsContact O-N 3.13Å; C322-L324 VanDerWaalsContact SG-CB 3.5Å; C322-H335 PolarHBondContact SG-CE1 2.84Å; C322-H335 PolarHBondContact SG-NE2 2.83Å
323	N	84.2	Confident	78.7	Confident	129 Å²	129	79.9 Å²	79.9	69%	0.69	43%	0.433	S	S	*	.			trans	53.3	25	-176.2	-66.2	-18.7	0	0	0	114.6	C319	C319-N323 WeakPolarHBondContact O-CA 3.39Å; C319-N323 PolarHBondContact O-N 3.14Å; C319-N323 PolarHBondContact O-OD1 3.32Å
324	L	88	Confident	80.8	Confident	83 Å²	83	78.1 Å²	78.1	44%	0.435	42%	0.423	S	S	.	.			trans	-79	126.8	175	-167.3	60.3	0	0	0	109.8	N318 C319 C322 F326	N318-L324 CarbonylContact C-O 3.57Å; N318-L324 WeakPolarHBondContact CA-O 3.34Å; C319-L324 PolarHBondContact N-O 3.1Å; C322-L324 PolarHBondContact O-N 3.21Å; C322-L324 VanDerWaalsContact O-N 3.13Å; C322-L324 VanDerWaalsContact SG-CB 3.5Å; L324-F326 HydrophobicContact CB-CE2 3.91Å; L324-F326 HydrophobicContact CB-CZ 4.1Å; L324-F326 HydrophobicContact CD2-CE1 4.14Å; L324-F326 HydrophobicContact CD2-CE2 4.2Å; L324-F326 HydrophobicContact CD2-CZ 3.52Å; L324-F326 HydrophobicContact CG-CE1 4.4Å; L324-F326 HydrophobicContact CG-CE2 3.95Å; L324-F326 HydrophobicContact CG-CZ 3.73Å; L324-F326 VanDerWaalsContact O-CD2 3.32Å; L324-F326 WeakPolarHBondContact O-CD2 3.23Å; L324-F326 VanDerWaalsContact O-CE2 3.25Å; L324-F326 WeakPolarHBondContact O-CE2 3.4Å
325	S	86.1	Confident	82.7	Confident	44 Å²	44	68.8 Å²	68.8	31%	0.308	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	136.7	-179.4	61.5	0	0	0	0	111.7	Q317 N318	Q317-S325 CarbonylContact O-C 3.53Å; Q317-S325 WeakPolarHBondContact O-CA 3.45Å; N318-S325 WeakPolarHBondContact OD1-CA 3.31Å; N318-S325 WeakPolarHBondContact OD1-CB 3.48Å
326	F	89.9	Confident	84.2	Confident	30 Å²	30	63.7 Å²	63.7	13%	0.132	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	131.9	179.5	-61.3	-87.8	0	0	0	110.3	Q316 Q317 C319 L324 D331 F332 H335	Q316-F326 WeakPolarHBondContact CA-O 3.38Å; Q317-F326 PolarHBondContact N-O 3.33Å; Q317-F326 WeakPolarHBondContact O-CD2 3.21Å; Q317-F326 PolarHBondContact O-N 3.44Å; C319-F326 HydrophobicContact CB-CE2 4.31Å; L324-F326 HydrophobicContact CB-CE2 3.91Å; L324-F326 HydrophobicContact CB-CZ 4.1Å; L324-F326 HydrophobicContact CD2-CE1 4.14Å; L324-F326 HydrophobicContact CD2-CE2 4.2Å; L324-F326 HydrophobicContact CD2-CZ 3.52Å; L324-F326 HydrophobicContact CG-CE1 4.4Å; L324-F326 HydrophobicContact CG-CE2 3.95Å; L324-F326 HydrophobicContact CG-CZ 3.73Å; L324-F326 VanDerWaalsContact O-CD2 3.32Å; L324-F326 WeakPolarHBondContact O-CD2 3.23Å; L324-F326 VanDerWaalsContact O-CE2 3.25Å; L324-F326 WeakPolarHBondContact O-CE2 3.4Å; F326-D331 HydrophobicContact CD1-CB 3.75Å; F326-D331 HydrophobicContact CE1-CB 4.43Å; F326-F332 HydrophobicContact CB-CB 4.01Å; F326-F332 HydrophobicContact CD2-CB 4.09Å; F326-F332 AromaticContact CD2-CD2 3.81Å; F326-F332 HydrophobicContact CD2-CD2 3.81Å; F326-F332 HydrophobicContact CD2-CG 4.47Å; F326-F332 HydrophobicContact CE2-CD2 4.27Å; F326-F332 HydrophobicContact CG-CB 4.08Å; F326-H335 HydrophobicContact CE1-CB 3.83Å; F326-H335 HydrophobicContact CE2-CB 3.96Å; F326-H335 AromaticContact CE2-CD2 3.56Å; F326-H335 AromaticContact CE2-CG 3.66Å; F326-H335 HydrophobicContact CZ-CB 3.34Å; F326-H335 AromaticContact CZ-CD2 3.64Å; F326-H335 AromaticContact CZ-CG 3.21Å; F326-H335 AromaticContact CZ-ND1 3.61Å
327	C	82.2	Confident	85	Confident	107 Å²	107	60.1 Å²	60.1	72%	0.723	34%	0.34	S	S	*	.	S	Bend	trans	-79.6	-24.7	175.1	-60.1	0	0	0	0	112.4
328	Q	79.3	Confident	85.6	Confident	110 Å²	110	63.8 Å²	63.8	51%	0.514	36%	0.355	S	S	.	.	S	Bend	trans	-113.2	131.3	179.9	-65.2	-170.9	-8.9	0	0	110.5	I330 D331 F332	Q328-I330 PolarHBondContact O-N 3.05Å; Q328-D331 PolarHBondContact O-N 2.77Å; Q328-F332 PolarHBondContact O-N 2.87Å
329	P	81.2	Confident	85.7	Confident	39 Å²	39	63.7 Å²	63.7	25%	0.253	36%	0.358	S	S	.	.	H	α-helix	trans	-57.9	-31	175.3	-26.9	34.8	0	0	0	113.5	F310 F332 V333	F310-P329 HydrophobicContact CB-CB 4.27Å; P329-F332 WeakPolarHBondContact O-CB 3.39Å; P329-F332 PolarHBondContact O-N 2.93Å; P329-V333 WeakPolarHBondContact O-CG2 3.25Å; P329-V333 PolarHBondContact O-N 2.75Å
330	I	84.8	Confident	85.7	Confident	55 Å²	55	66.8 Å²	66.8	28%	0.282	37%	0.372	S	S	.	.	H	α-helix	trans	-61.2	-47.5	178.6	-44.8	-153.4	0	0	0	110.8	Y307 Q328 F332 V333 I334	Y307-I330 HydrophobicContact CE1-CD1 4.38Å; Y307-I330 HydrophobicContact CE1-CG1 3.94Å; Y307-I330 WeakPolarHBondContact OH-CA 3.33Å; Y307-I330 WeakPolarHBondContact OH-CB 3.31Å; Y307-I330 WeakPolarHBondContact OH-CD1 3.45Å; Y307-I330 WeakPolarHBondContact OH-CG1 3.48Å; Y307-I330 VanDerWaalsContact OH-CG2 3.31Å; Y307-I330 WeakPolarHBondContact OH-CG2 3.33Å; Q328-I330 PolarHBondContact O-N 3.05Å; I330-F332 VanDerWaalsContact C-N 3.31Å; I330-F332 PolarHBondContact O-N 2.82Å; I330-V333 PolarHBondContact O-N 2.8Å; I330-I334 HydrophobicContact CG2-CD1 3.96Å; I330-I334 WeakPolarHBondContact O-CG1 3.49Å; I330-I334 PolarHBondContact O-N 2.83Å
331	D	85.7	Confident	85.8	Confident	74 Å²	74	66.6 Å²	66.6	40%	0.396	36%	0.362	S	S	.	.	H	α-helix	trans	-66.8	-36.9	-179.3	-66.2	-32	0	0	0	111.3	F326 Q328 I334 H335	F326-D331 HydrophobicContact CD1-CB 3.75Å; F326-D331 HydrophobicContact CE1-CB 4.43Å; Q328-D331 PolarHBondContact O-N 2.77Å; D331-I334 PolarHBondContact O-N 3.04Å; D331-H335 WeakPolarHBondContact O-CB 3.21Å; D331-H335 PolarHBondContact O-N 2.74Å
332	F	87.5	Confident	85.1	Confident	25 Å²	25	64.8 Å²	64.8	11%	0.11	36%	0.363	C	S	.	.	H	α-helix	trans	-60.3	-48.4	173.3	174	-102.5	0	0	0	111.8	F310 Q317 C319 F326 Q328 P329 I330 I334 H335 I336	F310-F332 HydrophobicContact CD1-CD1 4.16Å; F310-F332 AromaticContact CD1-CE1 3.81Å; F310-F332 HydrophobicContact CD1-CE1 3.81Å; F310-F332 HydrophobicContact CE1-CD1 4.33Å; F310-F332 AromaticContact CE1-CE1 3.59Å; F310-F332 HydrophobicContact CE1-CE1 3.59Å; F310-F332 HydrophobicContact CE1-CZ 4.49Å; F310-F332 HydrophobicContact CZ-CE1 4.37Å; Q317-F332 HydrophobicContact CB-CB 4.2Å; Q317-F332 HydrophobicContact CB-CD2 4.11Å; Q317-F332 HydrophobicContact CB-CG 4.06Å; C319-F332 HydrophobicContact CB-CE2 4.33Å; F326-F332 HydrophobicContact CB-CB 4.01Å; F326-F332 HydrophobicContact CD2-CB 4.09Å; F326-F332 AromaticContact CD2-CD2 3.81Å; F326-F332 HydrophobicContact CD2-CD2 3.81Å; F326-F332 HydrophobicContact CD2-CG 4.47Å; F326-F332 HydrophobicContact CE2-CD2 4.27Å; F326-F332 HydrophobicContact CG-CB 4.08Å; Q328-F332 PolarHBondContact O-N 2.87Å; P329-F332 WeakPolarHBondContact O-CB 3.39Å; P329-F332 PolarHBondContact O-N 2.93Å; I330-F332 VanDerWaalsContact C-N 3.31Å; I330-F332 PolarHBondContact O-N 2.82Å; F332-I334 PolarHBondContact O-N 2.98Å; F332-H335 WeakPolarHBondContact O-CB 3.5Å; F332-H335 PolarHBondContact O-N 3.34Å; F332-I336 HydrophobicContact CD2-CG1 4.48Å; F332-I336 HydrophobicContact CE1-CG1 4.14Å; F332-I336 HydrophobicContact CE2-CD1 4.08Å; F332-I336 HydrophobicContact CE2-CG1 4.07Å; F332-I336 HydrophobicContact CZ-CD1 4.12Å; F332-I336 HydrophobicContact CZ-CG1 3.88Å; F332-I336 WeakPolarHBondContact O-CG1 3.34Å; F332-I336 PolarHBondContact O-N 3.11Å
333	V	85	Confident	83.6	Confident	15 Å²	15	65.3 Å²	65.3	9%	0.091	36%	0.361	C	S	.	.	H	α-helix	trans	-62.4	-45.9	178.5	172.3	0	0	0	0	111.2	I305 P329 I330 H335 I336 Q337	I305-V333 HydrophobicContact CD1-CG1 4.38Å; P329-V333 WeakPolarHBondContact O-CG2 3.25Å; P329-V333 PolarHBondContact O-N 2.75Å; I330-V333 PolarHBondContact O-N 2.8Å; V333-H335 VanDerWaalsContact C-N 3.27Å; V333-H335 PolarHBondContact O-N 2.67Å; V333-I336 PolarHBondContact O-N 3.26Å; V333-Q337 HydrophobicContact CG1-CG 4.37Å; V333-Q337 WeakPolarHBondContact O-CB 3.36Å; V333-Q337 VanDerWaalsContact O-CG 3.31Å; V333-Q337 WeakPolarHBondContact O-CG 3.05Å; V333-Q337 PolarHBondContact O-N 3.49Å
334	I	87.9	Confident	81.9	Confident	62 Å²	62	69 Å²	69	32%	0.318	37%	0.371	S	S	.	.	H	α-helix	trans	-60.3	-41.2	176.9	-68.5	170.7	0	0	0	110.5	I330 D331 F332 Q337 K338	I330-I334 HydrophobicContact CG2-CD1 3.96Å; I330-I334 WeakPolarHBondContact O-CG1 3.49Å; I330-I334 PolarHBondContact O-N 2.83Å; D331-I334 PolarHBondContact O-N 3.04Å; F332-I334 PolarHBondContact O-N 2.98Å; I334-Q337 PolarHBondContact O-N 3.47Å; I334-K338 HydrophobicContact CG2-CD 3.84Å; I334-K338 HydrophobicContact CG2-CG 4.3Å; I334-K338 WeakPolarHBondContact O-CB 3.19Å; I334-K338 WeakPolarHBondContact O-CG 3.45Å; I334-K338 PolarHBondContact O-N 3.44Å
335	H	92.3	Very high	79.9	Confident	19 Å²	19	68.9 Å²	68.9	9%	0.088	37%	0.369	C	S	.	.	H	α-helix	trans	-60.1	-51.6	176.6	165.2	76.3	0	0	0	111.7	C319 C322 F326 D331 F332 V333 Q337 K338 V339 H340	C319-H335 VanDerWaalsContact CB-NE2 3.31Å; C319-H335 WeakPolarHBondContact CB-NE2 3.46Å; C319-H335 PolarHBondContact SG-NE2 3.49Å; C322-H335 PolarHBondContact SG-CE1 2.84Å; C322-H335 PolarHBondContact SG-NE2 2.83Å; F326-H335 HydrophobicContact CE1-CB 3.83Å; F326-H335 HydrophobicContact CE2-CB 3.96Å; F326-H335 AromaticContact CE2-CD2 3.56Å; F326-H335 AromaticContact CE2-CG 3.66Å; F326-H335 HydrophobicContact CZ-CB 3.34Å; F326-H335 AromaticContact CZ-CD2 3.64Å; F326-H335 AromaticContact CZ-CG 3.21Å; F326-H335 AromaticContact CZ-ND1 3.61Å; D331-H335 WeakPolarHBondContact O-CB 3.21Å; D331-H335 PolarHBondContact O-N 2.74Å; F332-H335 WeakPolarHBondContact O-CB 3.5Å; F332-H335 PolarHBondContact O-N 3.34Å; V333-H335 VanDerWaalsContact C-N 3.27Å; V333-H335 PolarHBondContact O-N 2.67Å; H335-Q337 VanDerWaalsContact C-N 3.33Å; H335-Q337 PolarHBondContact O-N 3.43Å; H335-K338 PolarHBondContact O-N 3.01Å; H335-V339 VanDerWaalsContact O-CB 3.23Å; H335-V339 WeakPolarHBondContact O-CB 3.45Å; H335-V339 WeakPolarHBondContact O-CG2 3.26Å; H335-V339 PolarHBondContact O-N 2.96Å; H335-H340 AromaticContact CE1-NE2 3.75Å; H335-H340 AromaticContact NE2-CD2 3.66Å; H335-H340 AromaticContact NE2-NE2 3.29Å; H335-H340 PolarHBondContact NE2-NE2 2.9Å
336	I	89.6	Confident	77.8	Confident	40 Å²	40	70.9 Å²	70.9	21%	0.205	39%	0.389	C	S	.	.	I	π-helix	trans	-59.4	-45.5	178.5	-62.6	-59.4	0	0	0	110.9	C319 F332 V333 H340 L341	C319-I336 HydrophobicContact CB-CD1 4.35Å; F332-I336 HydrophobicContact CD2-CG1 4.48Å; F332-I336 HydrophobicContact CE1-CG1 4.14Å; F332-I336 HydrophobicContact CE2-CD1 4.08Å; F332-I336 HydrophobicContact CE2-CG1 4.07Å; F332-I336 HydrophobicContact CZ-CD1 4.12Å; F332-I336 HydrophobicContact CZ-CG1 3.88Å; F332-I336 WeakPolarHBondContact O-CG1 3.34Å; F332-I336 PolarHBondContact O-N 3.11Å; V333-I336 PolarHBondContact O-N 3.26Å; I336-H340 WeakPolarHBondContact O-CA 3.4Å; I336-H340 WeakPolarHBondContact O-CB 3.31Å; I336-H340 PolarHBondContact O-N 3.23Å; I336-L341 HydrophobicContact CG2-CD1 4.39Å; I336-L341 HydrophobicContact CG2-CG 4.4Å; I336-L341 PolarHBondContact O-N 3.03Å
337	Q	86.1	Confident	75.4	Confident	31 Å²	31	77.2 Å²	77.2	15%	0.145	42%	0.424	C	S	.	.	I	π-helix	trans	-65.7	-44.2	-177.2	-71.7	172.4	-27.4	0	0	112.8	I305 V333 I334 H335 L341 G342 L343 M345	I305-Q337 HydrophobicContact CD1-CG 4.4Å; V333-Q337 HydrophobicContact CG1-CG 4.37Å; V333-Q337 WeakPolarHBondContact O-CB 3.36Å; V333-Q337 VanDerWaalsContact O-CG 3.31Å; V333-Q337 WeakPolarHBondContact O-CG 3.05Å; V333-Q337 PolarHBondContact O-N 3.49Å; I334-Q337 PolarHBondContact O-N 3.47Å; H335-Q337 VanDerWaalsContact C-N 3.33Å; H335-Q337 PolarHBondContact O-N 3.43Å; Q337-L341 HydrophobicContact CG-CD1 4.4Å; Q337-G342 PolarHBondContact O-N 3.39Å; Q337-L343 PolarHBondContact O-N 3.47Å; Q337-M345 HydrophobicContact CB-CE 3.45Å; Q337-M345 VanDerWaalsContact CB-CE 3.45Å; Q337-M345 VanDerWaalsContact CD-CE 3.46Å; Q337-M345 HydrophobicContact CG-CE 4Å
338	K	86	Confident	73.2	Confident	115 Å²	115	77.4 Å²	77.4	50%	0.5	42%	0.417	S	S	.	.	I	π-helix	trans	-79.2	-41.6	-177.9	-71.1	-173.9	176.1	-178.7	0	112.9	I334 H335	I334-K338 HydrophobicContact CG2-CD 3.84Å; I334-K338 HydrophobicContact CG2-CG 4.3Å; I334-K338 WeakPolarHBondContact O-CB 3.19Å; I334-K338 WeakPolarHBondContact O-CG 3.45Å; I334-K338 PolarHBondContact O-N 3.44Å; H335-K338 PolarHBondContact O-N 3.01Å
339	V	83.4	Confident	71.3	Confident	91 Å²	91	80.2 Å²	80.2	55%	0.552	43%	0.431	S	S	*	.	I	π-helix	trans	-88.9	-44	-170.7	-178.1	0	0	0	0	111.8	H335	H335-V339 VanDerWaalsContact O-CB 3.23Å; H335-V339 WeakPolarHBondContact O-CB 3.45Å; H335-V339 WeakPolarHBondContact O-CG2 3.26Å; H335-V339 PolarHBondContact O-N 2.96Å
340	H	88.5	Confident	69.1	Low	66 Å²	66	85.6 Å²	85.6	31%	0.306	46%	0.457	S	S	.	.	I	π-helix	trans	-100	-34.9	-171.5	-64.7	-59.8	0	0	0	113.3	C319 T321 H335 I336	C319-H340 PolarHBondContact SG-NE2 2.87Å; T321-H340 VanDerWaalsContact CB-CE1 3.41Å; T321-H340 WeakPolarHBondContact CB-CE1 3.47Å; T321-H340 WeakPolarHBondContact CG2-CE1 3.4Å; H335-H340 AromaticContact CE1-NE2 3.75Å; H335-H340 AromaticContact NE2-CD2 3.66Å; H335-H340 AromaticContact NE2-NE2 3.29Å; H335-H340 PolarHBondContact NE2-NE2 2.9Å; I336-H340 WeakPolarHBondContact O-CA 3.4Å; I336-H340 WeakPolarHBondContact O-CB 3.31Å; I336-H340 PolarHBondContact O-N 3.23Å
341	L	83.3	Confident	66.5	Low	103 Å²	103	89.3 Å²	89.3	54%	0.539	48%	0.478	S	S	.	.	S	Bend	trans	-91.7	-13.1	176.9	-58.6	177.4	0	0	0	113.2	I336 Q337 L343	I336-L341 HydrophobicContact CG2-CD1 4.39Å; I336-L341 HydrophobicContact CG2-CG 4.4Å; I336-L341 PolarHBondContact O-N 3.03Å; Q337-L341 HydrophobicContact CG-CD1 4.4Å; L341-L343 HydrophobicContact CB-CD1 4.02Å; L341-L343 HydrophobicContact CB-CG 3.86Å; L341-L343 HydrophobicContact CD1-CD1 4.07Å; L341-L343 PolarHBondContact O-N 2.84Å
342	G	65.5	Low	63.9	Low	59 Å²	59	92.2 Å²	92.2	61%	0.608	49%	0.493	S	S	*	.			trans	62.6	21.8	-178.8	0	0	0	0	0	113.8	Q337 K344	Q337-G342 PolarHBondContact O-N 3.39Å; G342-K344 PolarHBondContact O-N 3.16Å
343	L	58.6	Low	61	Low	75 Å²	75	97.7 Å²	97.7	39%	0.393	52%	0.522	S	S	.	.			trans	-75.4	113.8	-178	-65.9	174.8	0	0	0	109.4	Q337 L341 M345	Q337-L343 PolarHBondContact O-N 3.47Å; L341-L343 HydrophobicContact CB-CD1 4.02Å; L341-L343 HydrophobicContact CB-CG 3.86Å; L341-L343 HydrophobicContact CD1-CD1 4.07Å; L341-L343 PolarHBondContact O-N 2.84Å; L343-M345 PolarHBondContact O-N 2.9Å
344	K	49.6	Very low	58.2	Low	205 Å²	205	106.9 Å²	106.9	89%	0.891	56%	0.56	S	S	*	*			trans	-67.9	113.9	162.5	-89.6	-176.2	172.6	-179.3	0	107.9	G342 A346	G342-K344 PolarHBondContact O-N 3.16Å; K344-A346 PolarHBondContact O-N 2.82Å
345	M	46.1	Very low	55.1	Low	82 Å²	82	108.6 Å²	108.6	40%	0.404	58%	0.575	S	S	.	*			trans	-62.5	111.2	170.2	-67.2	-62.6	163.9	0	0	108.5	Q337 L343 N347	Q337-M345 HydrophobicContact CB-CE 3.45Å; Q337-M345 VanDerWaalsContact CB-CE 3.45Å; Q337-M345 VanDerWaalsContact CD-CE 3.46Å; Q337-M345 HydrophobicContact CG-CE 4Å; L343-M345 PolarHBondContact O-N 2.9Å; M345-N347 PolarHBondContact O-N 3.01Å
346	A	41.9	Very low	52	Low	86 Å²	86	115.6 Å²	115.6	71%	0.711	61%	0.612	S	S	*	*			trans	-68.6	110.7	167.7	0	0	0	0	0	108.4	K344 N348	K344-A346 PolarHBondContact O-N 2.82Å; A346-N348 PolarHBondContact O-N 2.95Å; A346-N348 VanDerWaalsContact O-N 3.14Å
347	N	39.8	Very low	48.9	Very low	163 Å²	163	123.5 Å²	123.5	87%	0.872	65%	0.646	S	S	*	*	S	Bend	trans	56.7	31.7	151.9	-53.8	-10.4	0	0	0	119.7	M345	M345-N347 PolarHBondContact O-N 3.01Å
348	N	35.8	Very low	46.1	Very low	110 Å²	110	130.1 Å²	130.1	59%	0.588	68%	0.676	S	S	*	*			trans	-110.3	42.6	162.7	-175.3	12.1	0	0	0	112.4	A346 N350	A346-N348 PolarHBondContact O-N 2.95Å; A346-N348 VanDerWaalsContact O-N 3.14Å; N348-N350 PolarHBondContact O-N 2.68Å
349	E	39.5	Very low	43.1	Very low	170 Å²	170	129.3 Å²	129.3	79%	0.794	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-5.2	175.8	-66.6	-161	151.7	0	0	113.5
350	N	35	Very low	40.5	Very low	152 Å²	152	131.4 Å²	131.4	81%	0.813	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	-3.6	-168.7	-74.7	-13.7	0	0	0	117.1	N348	N348-N350 PolarHBondContact O-N 2.68Å
351	N	29.4	Very low	37.6	Very low	132 Å²	132	135.6 Å²	135.6	71%	0.706	72%	0.718	S	S	*	*	S	Bend	trans	-118.5	-5.7	-172.4	-81.2	-27	0	0	0	119.2
352	L	32.1	Very low	34.8	Very low	136 Å²	136	135 Å²	135	71%	0.712	72%	0.722	S	S	*	*	S	Bend	trans	-138.7	6.1	-174.9	-79.2	171.9	0	0	0	119.1
353	I	26.7	Very low	32.9	Very low	140 Å²	140	138.6 Å²	138.6	72%	0.718	73%	0.727	S	S	*	*			trans	-137.3	93.3	171.6	-48.8	176.6	0	0	0	108.9	P355	I353-P355 HydrophobicContact CG2-CG 4.3Å; I353-P355 VanDerWaalsContact O-CD 3.26Å; I353-P355 WeakPolarHBondContact O-CD 3.47Å
354	K	24.3	Very low	31.6	Very low	207 Å²	207	143.6 Å²	143.6	90%	0.9	75%	0.746	S	S	*	*			trans	-81	107.1	149.6	-80.7	-178.9	-179.9	173.8	0	105.4	L356	K354-L356 PolarHBondContact O-N 2.86Å; K354-L356 VanDerWaalsContact O-N 3.16Å
355	P	24.5	Very low	30.6	Very low	98 Å²	98	140.7 Å²	140.7	64%	0.636	74%	0.74	S	S	*	*			trans	-61	123.5	166.5	-9.8	26.3	0	0	0	105.9	I353 K357	I353-P355 HydrophobicContact CG2-CG 4.3Å; I353-P355 VanDerWaalsContact O-CD 3.26Å; I353-P355 WeakPolarHBondContact O-CD 3.47Å; P355-K357 PolarHBondContact O-N 2.79Å
356	L	25.8	Very low	29.8	Very low	166 Å²	166	145 Å²	145	87%	0.869	76%	0.759	S	S	*	*			trans	-47.9	110.4	159.8	-96.4	139.1	0	0	0	105.9	K354 E358	K354-L356 PolarHBondContact O-N 2.86Å; K354-L356 VanDerWaalsContact O-N 3.16Å; L356-E358 PolarHBondContact O-N 2.91Å
357	K	26.1	Very low	29.2	Very low	207 Å²	207	147.8 Å²	147.8	90%	0.9	76%	0.76	S	S	*	*			trans	-65	82.1	172	-72.8	-179.8	176.7	-179.6	0	106.5	P355 S359	P355-K357 PolarHBondContact O-N 2.79Å; K357-S359 PolarHBondContact O-N 3.15Å; K357-S359 VanDerWaalsContact O-N 3.11Å
358	E	26.3	Very low	28.7	Very low	169 Å²	169	151.3 Å²	151.3	79%	0.79	76%	0.761	S	S	*	*			trans	-64.1	111.2	157.6	-76.7	-172.2	166.9	0	0	106.1	L356 V360	L356-E358 PolarHBondContact O-N 2.91Å; E358-V360 VanDerWaalsContact C-N 3.32Å; E358-V360 PolarHBondContact O-N 3.45Å
359	S	24.1	Very low	28.5	Very low	99 Å²	99	154.5 Å²	154.5	69%	0.692	77%	0.77	S	S	*	*			trans	-47.7	96.1	166.5	51.4	0	0	0	0	109.3	K357 Q361	K357-S359 PolarHBondContact O-N 3.15Å; K357-S359 VanDerWaalsContact O-N 3.11Å; S359-Q361 PolarHBondContact O-N 2.87Å
360	V	27.6	Very low	28.2	Very low	135 Å²	135	151.7 Å²	151.7	82%	0.818	77%	0.769	S	S	*	*			trans	-71.9	81.8	161.6	-178	0	0	0	0	106.1	E358 S362	E358-V360 VanDerWaalsContact C-N 3.32Å; E358-V360 PolarHBondContact O-N 3.45Å; V360-S362 VanDerWaalsContact C-N 3.28Å; V360-S362 PolarHBondContact O-N 2.94Å
361	Q	27	Very low	28.1	Very low	154 Å²	154	150.9 Å²	150.9	72%	0.72	77%	0.765	S	S	*	*			trans	-58.3	99	162.4	-152.8	92.2	-6	0	0	105.4	S359 N363	S359-Q361 PolarHBondContact O-N 2.87Å; Q361-N363 VanDerWaalsContact C-N 3.27Å; Q361-N363 PolarHBondContact O-N 3.2Å
362	S	25.5	Very low	28.2	Very low	89 Å²	89	153.7 Å²	153.7	62%	0.622	77%	0.771	S	S	*	*			trans	-64.4	91.6	175.5	66.8	0	0	0	0	108.2	V360 K364	V360-S362 VanDerWaalsContact C-N 3.28Å; V360-S362 PolarHBondContact O-N 2.94Å; S362-K364 PolarHBondContact O-N 2.89Å
363	N	25.7	Very low	28.2	Very low	136 Å²	136	154.5 Å²	154.5	73%	0.727	77%	0.774	S	S	*	*			trans	-71.4	82.8	165.7	-97.8	-22.2	0	0	0	107.5	Q361 N365	Q361-N363 VanDerWaalsContact C-N 3.27Å; Q361-N363 PolarHBondContact O-N 3.2Å; N363-N365 PolarHBondContact O-N 2.8Å
364	K	31.2	Very low	28.6	Very low	179 Å²	179	155.7 Å²	155.7	78%	0.778	78%	0.777	S	S	*	*			trans	-60.3	96.6	157.5	-79.9	178.3	177.8	173.6	0	106.1	S362 H366	S362-K364 PolarHBondContact O-N 2.89Å; K364-H366 PolarHBondContact O-N 2.77Å
365	N	28	Very low	28.9	Very low	144 Å²	144	157 Å²	157	77%	0.77	78%	0.776	S	S	*	*			trans	-60.3	91.1	169.9	-75.4	-34.7	0	0	0	108.1	N363 I367	N363-N365 PolarHBondContact O-N 2.8Å; N365-I367 PolarHBondContact O-N 2.91Å
366	H	30.1	Very low	29.3	Very low	172 Å²	172	159.2 Å²	159.2	80%	0.796	78%	0.782	S	S	*	*			trans	-64.2	103.4	165.5	-109.4	-63.4	0	0	0	107.1	K364 R368	K364-H366 PolarHBondContact O-N 2.77Å; H366-R368 VanDerWaalsContact C-N 3.34Å; H366-R368 PolarHBondContact O-N 2.96Å
367	I	28.3	Very low	29.7	Very low	145 Å²	145	156.2 Å²	156.2	74%	0.744	77%	0.771	S	S	*	*			trans	-57.4	102	165.4	-65.8	171.1	0	0	0	106.3	N365 K369	N365-I367 PolarHBondContact O-N 2.91Å; I367-K369 VanDerWaalsContact C-N 3.34Å; I367-K369 PolarHBondContact O-N 3.21Å
368	R	29.7	Very low	30.2	Very low	237 Å²	237	153.3 Å²	153.3	89%	0.894	77%	0.765	S	S	*	*			trans	-67	91.7	174.7	-72.6	-178.8	178.9	-176.5	-0.6	108.1	H366 S370	H366-R368 VanDerWaalsContact C-N 3.34Å; H366-R368 PolarHBondContact O-N 2.96Å; R368-S370 PolarHBondContact O-N 3.32Å
369	K	31.9	Very low	30.6	Very low	178 Å²	178	151.7 Å²	151.7	77%	0.774	76%	0.761	S	S	*	*			trans	-74.9	99.1	160	-76.2	-175.5	178.4	178.7	0	107.2	I367 N371	I367-K369 VanDerWaalsContact C-N 3.34Å; I367-K369 PolarHBondContact O-N 3.21Å; K369-N371 VanDerWaalsContact C-N 3.29Å; K369-N371 PolarHBondContact O-N 3.06Å
370	S	32.7	Very low	31.2	Very low	111 Å²	111	153 Å²	153	78%	0.776	77%	0.766	S	S	*	*			trans	-68.8	84.9	171.2	50.9	0	0	0	0	109.7	R368 K372	R368-S370 PolarHBondContact O-N 3.32Å; S370-K372 PolarHBondContact O-N 2.77Å
371	N	33	Very low	31.3	Very low	134 Å²	134	154.5 Å²	154.5	72%	0.717	77%	0.769	S	S	*	*			trans	-82.2	102.4	166.3	-76.6	-6.6	0	0	0	108.2	K369 I373	K369-N371 VanDerWaalsContact C-N 3.29Å; K369-N371 PolarHBondContact O-N 3.06Å; N371-I373 PolarHBondContact O-N 3.16Å
372	K	31.2	Very low	31.5	Very low	192 Å²	192	150.9 Å²	150.9	84%	0.835	77%	0.773	S	S	*	*			trans	-73.1	84.7	175.8	-160.6	176.5	-171.3	-179.6	0	108.1	S370	S370-K372 PolarHBondContact O-N 2.77Å
373	I	33.3	Very low	31.7	Very low	152 Å²	152	154.3 Å²	154.3	78%	0.779	78%	0.782	S	S	*	*			trans	-84.9	117.6	176	-59.3	175.9	0	0	0	107.9	N371	N371-I373 PolarHBondContact O-N 3.16Å
374	H	34	Very low	32.1	Very low	166 Å²	166	155.4 Å²	155.4	77%	0.769	79%	0.789	S	S	*	*			trans	-61	132.3	175.7	-82.6	-104.5	0	0	0	110.3	N376	H374-N376 PolarHBondContact O-N 3.46Å
375	R	30.3	Very low	31.9	Very low	235 Å²	235	157.9 Å²	157.9	89%	0.887	79%	0.793	S	S	*	*			trans	-73	108.9	170.4	-57.8	176.5	-165	156.5	2.2	107.2
376	N	33.2	Very low	32	Very low	144 Å²	144	156.2 Å²	156.2	77%	0.77	79%	0.788	S	S	*	*			trans	-96.2	114.3	155.6	-108.6	4	0	0	0	106.8	H374 D378	H374-N376 PolarHBondContact O-N 3.46Å; N376-D378 PolarHBondContact O-N 3.35Å
377	V	34.7	Very low	32.3	Very low	103 Å²	103	154.6 Å²	154.6	62%	0.624	79%	0.79	S	S	*	*			trans	-83.9	94.8	172.8	177.1	0	0	0	0	105.2	D379	V377-D379 PolarHBondContact O-N 3.23Å
378	D	37.3	Very low	32.5	Very low	146 Å²	146	157.6 Å²	157.6	78%	0.781	79%	0.794	S	S	*	*			trans	-92.7	88.3	163.8	-71.3	-34.4	0	0	0	107.1	N376 T380	N376-D378 PolarHBondContact O-N 3.35Å; D378-T380 PolarHBondContact O-N 3.24Å
379	D	33.4	Very low	32.7	Very low	134 Å²	134	156.4 Å²	156.4	72%	0.717	79%	0.789	S	S	*	*			trans	-68.6	114.4	162.7	-72.1	-39	0	0	0	107.9	V377	V377-D379 PolarHBondContact O-N 3.23Å
380	T	36.7	Very low	32.9	Very low	128 Å²	128	154 Å²	154	79%	0.785	79%	0.785	S	S	*	*			trans	179.2	109.8	140.4	23.6	0	0	0	0	112.5	D378	D378-T380 PolarHBondContact O-N 3.24Å
381	N	30.9	Very low	33.2	Very low	166 Å²	166	154.1 Å²	154.1	89%	0.888	78%	0.777	S	S	*	*			trans	33.4	102.2	133.5	-66.2	-17.5	0	0	0	119
382	G	30.9	Very low	33.3	Very low	77 Å²	77	153.9 Å²	153.9	79%	0.794	78%	0.776	S	S	*	*			trans	-157.8	70.2	163.9	0	0	0	0	0	111.4	N384	G382-N384 PolarHBondContact O-N 3.29Å
383	I	28.4	Very low	33.6	Very low	161 Å²	161	152 Å²	152	83%	0.826	77%	0.774	S	S	*	*			trans	-65.3	116.4	167.1	-63.3	167	0	0	0	107.2
384	N	34.7	Very low	33.6	Very low	160 Å²	160	151.8 Å²	151.8	86%	0.856	77%	0.77	S	S	*	*			trans	-156.2	118.9	147.7	-97	-30.1	0	0	0	113.3	G382	G382-N384 PolarHBondContact O-N 3.29Å
385	R	28	Very low	33.7	Very low	230 Å²	230	150.7 Å²	150.7	87%	0.868	78%	0.775	S	S	*	*			trans	-31.1	134.7	165.4	-93	166.8	165.7	170.7	-3.9	117.2
386	V	28.9	Very low	33.7	Very low	110 Å²	110	147.1 Å²	147.1	67%	0.667	77%	0.766	S	S	*	*				32.1	114.2	122.5	-171.4	0	0	0	0	117.3	Y388	V386-Y388 HydrophobicContact CG1-CD2 4.2Å; V386-Y388 HydrophobicContact CG1-CE2 4.49Å
387	T	36.3	Very low	33.8	Very low	138 Å²	138	146.3 Å²	146.3	85%	0.847	76%	0.762	S	S	*	*			trans	-144.8	116.2	134.4	40.2	0	0	0	0	109.8
388	Y	32.2	Very low	33.9	Very low	208 Å²	208	150.6 Å²	150.6	82%	0.816	78%	0.775	S	S	*	*			trans	-66.4	129.6	160.7	-75.9	-97.7	0	0	0	107.5	V386	V386-Y388 HydrophobicContact CG1-CD2 4.2Å; V386-Y388 HydrophobicContact CG1-CE2 4.49Å
389	R	34.8	Very low	33.8	Very low	211 Å²	211	150.7 Å²	150.7	80%	0.796	77%	0.774	S	S	*	*			trans	-120.8	78	173.4	-148.9	-172.2	-150.8	-167.1	7.5	108.9	N391	R389-N391 PolarHBondContact O-N 3.17Å; R389-N391 VanDerWaalsContact O-N 3.13Å
390	D	35.4	Very low	33.8	Very low	129 Å²	129	155.9 Å²	155.9	69%	0.69	78%	0.783	S	S	*	*			trans	-74.8	89.5	166.2	-67.3	-33.4	0	0	0	108.3	N392	D390-N392 VanDerWaalsContact C-N 3.31Å; D390-N392 PolarHBondContact O-N 3.35Å; D390-N392 VanDerWaalsContact O-N 3.11Å
391	N	39.3	Very low	33.5	Very low	113 Å²	113	156.8 Å²	156.8	60%	0.604	78%	0.783	S	S	*	*			trans	-82.4	85.8	169	-78.1	-4.3	0	0	0	108.9	R389 N393	R389-N391 PolarHBondContact O-N 3.17Å; R389-N391 VanDerWaalsContact O-N 3.13Å; N391-N393 PolarHBondContact O-N 3.43Å
392	N	34.7	Very low	33.6	Very low	129 Å²	129	156.1 Å²	156.1	69%	0.69	78%	0.78	S	S	*	*			trans	-59.6	93.5	159.9	-74.3	-37.9	0	0	0	109.7	D390 H394	D390-N392 VanDerWaalsContact C-N 3.31Å; D390-N392 PolarHBondContact O-N 3.35Å; D390-N392 VanDerWaalsContact O-N 3.11Å; N392-H394 PolarHBondContact O-N 3.28Å
393	N	37.4	Very low	34	Very low	151 Å²	151	161.9 Å²	161.9	81%	0.807	79%	0.786	S	S	*	*			trans	-88.2	92.7	162.2	-85.7	-8.3	0	0	0	108.9	N391 T395	N391-N393 PolarHBondContact O-N 3.43Å; N393-T395 PolarHBondContact O-N 3.02Å
394	H	33.4	Very low	34.4	Very low	149 Å²	149	162 Å²	162	69%	0.69	79%	0.788	S	S	*	*			trans	-64	120.4	157.9	-73.1	-73.1	0	0	0	109.3	N392	N392-H394 PolarHBondContact O-N 3.28Å
395	T	36.4	Very low	34.4	Very low	142 Å²	142	157.9 Å²	157.9	87%	0.871	78%	0.783	S	S	*	*			trans	-131.1	85.7	151.8	-15.7	0	0	0	0	106.6	N393	N393-T395 PolarHBondContact O-N 3.02Å
396	K	31.1	Very low	34.9	Very low	160 Å²	160	153.5 Å²	153.5	70%	0.696	78%	0.776	S	S	*	*			trans	-73.2	158.9	161.8	-91.3	176.1	169.1	176.7	0	108.7
397	D	35.8	Very low	35.2	Very low	128 Å²	128	155.7 Å²	155.7	68%	0.684	78%	0.784	S	S	*	*			trans	91.6	100.6	156.2	-50.4	-33.4	0	0	0	118
398	Q	36.5	Very low	35.2	Very low	193 Å²	193	157.5 Å²	157.5	90%	0.902	78%	0.783	S	S	*	*			trans	174.6	80.4	131	-93.5	175.2	63.5	0	0	107.8
399	I	33.9	Very low	35.4	Very low	148 Å²	148	153.1 Å²	153.1	76%	0.759	78%	0.78	S	S	*	*				33.6	101.8	94	-49.9	177.6	0	0	0	113.1
400	R	33.8	Very low	35.5	Very low	243 Å²	243	150.7 Å²	150.7	92%	0.917	78%	0.782	S	S	*	*			trans	-157.2	79.6	137.1	-99.8	178.9	-157.8	-165.4	4.8	107.9
401	N	31.3	Very low	35.5	Very low	146 Å²	146	149.7 Å²	149.7	78%	0.781	78%	0.784	S	S	*	*			trans	-95.1	125.5	154.5	-64.4	-26.5	0	0	0	105.2
402	N	32.7	Very low	35.4	Very low	153 Å²	153	151.8 Å²	151.8	82%	0.818	80%	0.795	S	S	*	*			trans	168.9	98	153.6	-83	-13.3	0	0	0	107.2
403	E	38.8	Very low	35.6	Very low	197 Å²	197	154.5 Å²	154.5	92%	0.921	80%	0.8	S	S	*	*			trans	-164.1	87.3	145.2	-108	170.9	-151.6	0	0	107.3	G405	E403-G405 PolarHBondContact O-N 3.3Å
404	D	36.8	Very low	35.5	Very low	164 Å²	164	152.4 Å²	152.4	88%	0.877	80%	0.798	S	S	*	*			trans	-66.1	94.1	166.8	-67.3	-49.6	0	0	0	108.6
405	G	35.7	Very low	35.8	Very low	73 Å²	73	151.5 Å²	151.5	75%	0.753	80%	0.803	S	S	*	*			trans	-105.9	76.1	175.3	0	0	0	0	0	111.5	E403	E403-G405 PolarHBondContact O-N 3.3Å
406	I	37.6	Very low	35.7	Very low	139 Å²	139	155.5 Å²	155.5	71%	0.713	80%	0.802	S	S	*	*			trans	1.8	117.9	160.4	-57.8	169.1	0	0	0	116.4	H408	I406-H408 PolarHBondContact O-N 3.05Å
407	D	35.5	Very low	36.2	Very low	156 Å²	156	157.6 Å²	157.6	83%	0.834	81%	0.811	S	S	*	*			trans	-52.8	118.8	164.9	-65.3	-55.8	0	0	0	112.5
408	H	36.1	Very low	36.4	Very low	176 Å²	176	162.3 Å²	162.3	82%	0.815	82%	0.819	S	S	*	*			trans	-107.4	116.4	160.8	-86	-58.2	0	0	0	110.3	I406	I406-H408 PolarHBondContact O-N 3.05Å
409	P	36.9	Very low	36.2	Very low	116 Å²	116	158.3 Å²	158.3	75%	0.753	81%	0.813	S	S	*	*			trans	-78.2	126.8	-178.5	29.9	-32.1	0	0	0	112	S411	P409-S411 PolarHBondContact O-N 2.95Å
410	L	36.3	Very low	36.6	Very low	160 Å²	160	161.9 Å²	161.9	84%	0.838	82%	0.818	S	S	*	*			trans	15.6	96.7	146.2	-60.9	169.9	0	0	0	117.2
411	S	35.4	Very low	36.9	Very low	107 Å²	107	159 Å²	159	75%	0.748	82%	0.815	S	S	*	*			trans	-92	89.4	155.6	-179.8	0	0	0	0	109.1	P409 K413	P409-S411 PolarHBondContact O-N 2.95Å; S411-K413 PolarHBondContact O-N 3.01Å
412	L	38.4	Very low	37.2	Very low	158 Å²	158	157.2 Å²	157.2	83%	0.827	81%	0.814	S	S	*	*			trans	-66.3	98.9	166.1	-84.2	155.6	0	0	0	108.3	S414	L412-S414 PolarHBondContact O-N 3.37Å
413	K	37	Very low	37.8	Very low	185 Å²	185	156.3 Å²	156.3	80%	0.804	81%	0.814	S	S	*	*			trans	-62.5	100	171	-73.4	178.6	178	175.2	0	109.1	S411 T415	S411-K413 PolarHBondContact O-N 3.01Å; K413-T415 PolarHBondContact O-N 3.48Å
414	S	36.5	Very low	38	Very low	108 Å²	108	155.9 Å²	155.9	76%	0.755	81%	0.809	S	S	*	*			trans	-62.8	97.4	166.3	176.2	0	0	0	0	109.4	L412 R416	L412-S414 PolarHBondContact O-N 3.37Å; S414-R416 VanDerWaalsContact C-N 3.29Å; S414-R416 PolarHBondContact O-N 2.94Å
415	T	38.4	Very low	38.3	Very low	130 Å²	130	154.6 Å²	154.6	80%	0.798	81%	0.807	S	S	*	*			trans	-70.1	86.5	168.6	24.7	0	0	0	0	109.4	K413 K417	K413-T415 PolarHBondContact O-N 3.48Å; T415-K417 PolarHBondContact O-N 3.04Å
416	R	35.9	Very low	38.8	Very low	225 Å²	225	156.5 Å²	156.5	85%	0.849	80%	0.804	S	S	*	*			trans	-64	101.3	163.3	-109.6	179.9	175.1	170.3	-1.5	108.4	S414 R418	S414-R416 VanDerWaalsContact C-N 3.29Å; S414-R416 PolarHBondContact O-N 2.94Å; R416-R418 PolarHBondContact O-N 3.43Å
417	K	42	Very low	38.9	Very low	205 Å²	205	153.1 Å²	153.1	89%	0.891	80%	0.804	S	S	*	*			trans	-64.2	99.4	165.7	-71.1	-177.6	177.8	178.8	0	108	T415 S419	T415-K417 PolarHBondContact O-N 3.04Å; K417-S419 PolarHBondContact O-N 3.42Å
418	R	38.3	Very low	39.5	Very low	226 Å²	226	156 Å²	156	85%	0.853	80%	0.804	S	S	*	*			trans	-70.6	112.7	169.1	-82	-178.6	174.5	176.1	-1.8	108.1	R416 Y420	R416-R418 PolarHBondContact O-N 3.43Å; R418-Y420 PolarHBondContact O-N 3.3Å
419	S	33.9	Very low	39.9	Very low	109 Å²	109	159 Å²	159	76%	0.762	83%	0.827	S	S	*	*			trans	-65	119	166.1	167.3	0	0	0	0	108.9	K417 Q421	K417-S419 PolarHBondContact O-N 3.42Å; S419-Q421 PolarHBondContact O-N 3.35Å
420	Y	41.5	Very low	40.1	Very low	224 Å²	224	161.2 Å²	161.2	88%	0.878	83%	0.83	S	S	*	*			trans	-74.2	112.1	171.1	-76.9	-94.5	0	0	0	108.9	R418	R418-Y420 PolarHBondContact O-N 3.3Å
421	Q	39.8	Very low	40.3	Very low	181 Å²	181	161.3 Å²	161.3	85%	0.846	83%	0.83	S	S	*	*			trans	-77	118.3	164.1	-103.8	171.4	-9.9	0	0	108.2	S419 V423	S419-Q421 PolarHBondContact O-N 3.35Å; Q421-V423 PolarHBondContact O-N 3.13Å; Q421-V423 VanDerWaalsContact O-N 3.17Å
422	S	38.6	Very low	40.5	Very low	109 Å²	109	164.3 Å²	164.3	76%	0.762	83%	0.834	S	S	*	*			trans	-65.7	108.9	172.3	59.8	0	0	0	0	109.4	K424	S422-K424 PolarHBondContact O-N 3.46Å
423	V	44.5	Very low	40.7	Very low	135 Å²	135	164.6 Å²	164.6	82%	0.818	84%	0.835	S	S	*	*			trans	-73.9	113.7	170.7	-178.6	0	0	0	0	107.3	Q421 T425	Q421-V423 PolarHBondContact O-N 3.13Å; Q421-V423 VanDerWaalsContact O-N 3.17Å; V423-T425 PolarHBondContact O-N 3.35Å
424	K	42.2	Very low	40.9	Very low	187 Å²	187	163.4 Å²	163.4	81%	0.813	84%	0.837	S	S	*	*			trans	-64.2	115.8	170.6	-70.1	179.9	177.4	-179.9	0	107.7	S422 V426	S422-K424 PolarHBondContact O-N 3.46Å; K424-V426 PolarHBondContact O-N 3.01Å
425	T	44.2	Very low	41.2	Very low	137 Å²	137	167.1 Å²	167.1	84%	0.84	84%	0.842	S	S	*	*			trans	-64.5	115.6	168.4	43.2	0	0	0	0	108.5	V423 G427	V423-T425 PolarHBondContact O-N 3.35Å; T425-G427 PolarHBondContact O-N 3.11Å
426	V	45.7	Very low	41.4	Very low	114 Å²	114	169.7 Å²	169.7	69%	0.691	85%	0.845	S	S	*	*			trans	-71.1	114	170	-176.1	0	0	0	0	106.5	K424 Y428	K424-V426 PolarHBondContact O-N 3.01Å; V426-Y428 HydrophobicContact CG1-CE2 4.49Å; V426-Y428 PolarHBondContact O-N 3.06Å
427	G	38.9	Very low	41.8	Very low	68 Å²	68	165.5 Å²	165.5	70%	0.701	85%	0.845	S	S	*	*			trans	-65.7	125.8	167.3	0	0	0	0	0	108.5	T425	T425-G427 PolarHBondContact O-N 3.11Å
428	Y	48.1	Very low	41.8	Very low	216 Å²	216	162.2 Å²	162.2	85%	0.847	84%	0.841	S	S	*	*			trans	-93.8	126.9	160.7	-77.8	-88.7	0	0	0	106.4	V426	V426-Y428 HydrophobicContact CG1-CE2 4.49Å; V426-Y428 PolarHBondContact O-N 3.06Å
429	D	45.9	Very low	42.1	Very low	240 Å²	240	156.4 Å²	156.4	100%	1.283	84%	0.84	S	S	*	*			trans	-59.4	0	173.5	-67.5	-46.6	0	0	0	113

Retrieved 429 of 429 residues in 148.3 ms (Link to these results)

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