A0A3Q0KMJ0_SCHMA Loading...

DUF4614 domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KMJ0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 426 aa.

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(Predicted Aligned Error values between residue pairs)

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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	37.1	Very low	33.7	Very low	246 Å²	246	170.7 Å²	170.7	100%	1.212	84%	0.839	S	S	*	*				0	128.3	0	-76.8	159.2	75.4	0	0	107.4
2	K	34.7	Very low	33.5	Very low	201 Å²	201	163.8 Å²	163.8	87%	0.874	82%	0.819	S	S	*	*			trans	-70.8	128.9	-178.7	-68.1	174.1	175.4	-179.9	0	109.1
3	N	37.8	Very low	33.4	Very low	145 Å²	145	165.7 Å²	165.7	78%	0.775	82%	0.824	S	S	*	*			trans	-147.1	76.6	154.6	-111.8	7.7	0	0	0	106.9	E5	N3-E5 VanDerWaalsContact C-N 3.33Å; N3-E5 PolarHBondContact O-N 3.38Å
4	T	36.6	Very low	33.4	Very low	129 Å²	129	167.2 Å²	167.2	79%	0.791	83%	0.828	S	S	*	*			trans	-84.2	88.2	166	-32.3	0	0	0	0	105.2	E6	T4-E6 PolarHBondContact O-N 3.36Å
5	E	37.7	Very low	33.3	Very low	153 Å²	153	167.5 Å²	167.5	72%	0.715	83%	0.831	S	S	*	*			trans	-70.8	97.8	171.8	-73.3	-167.8	171.1	0	0	108.1	N3 T7	N3-E5 VanDerWaalsContact C-N 3.33Å; N3-E5 PolarHBondContact O-N 3.38Å; E5-T7 VanDerWaalsContact C-N 3.27Å; E5-T7 PolarHBondContact O-N 3.25Å
6	E	33.7	Very low	33.2	Very low	182 Å²	182	162.3 Å²	162.3	85%	0.85	82%	0.816	S	S	*	*			trans	-61.2	92.6	164.5	-73.2	-178.7	167	0	0	108.4	T4 K8	T4-E6 PolarHBondContact O-N 3.36Å; E6-K8 PolarHBondContact O-N 2.89Å
7	T	30.6	Very low	32.9	Very low	122 Å²	122	157.4 Å²	157.4	75%	0.748	82%	0.816	S	S	*	*			trans	-69.9	88.4	169.9	13.8	0	0	0	0	107.6	E5 V9	E5-T7 VanDerWaalsContact C-N 3.27Å; E5-T7 PolarHBondContact O-N 3.25Å; T7-V9 PolarHBondContact O-N 3.23Å
8	K	30.7	Very low	32.9	Very low	201 Å²	201	159.3 Å²	159.3	87%	0.874	81%	0.812	S	S	*	*			trans	-68.9	81.1	171.6	-154.4	173.1	-169.5	173.1	0	107.7	E6 R10	E6-K8 PolarHBondContact O-N 2.89Å; K8-R10 VanDerWaalsContact C-N 3.31Å; K8-R10 PolarHBondContact O-N 3.39Å
9	V	31.3	Very low	32.9	Very low	113 Å²	113	157.7 Å²	157.7	69%	0.685	80%	0.803	S	S	*	*			trans	-64.1	96.6	173.8	-179.8	0	0	0	0	107	T7 L11	T7-V9 PolarHBondContact O-N 3.23Å; V9-L11 VanDerWaalsContact C-N 3.33Å; V9-L11 HydrophobicContact CG1-CD2 4.27Å; V9-L11 HydrophobicContact CG1-CG 4.34Å; V9-L11 PolarHBondContact O-N 3.09Å
10	R	28.5	Very low	32.9	Very low	220 Å²	220	158.6 Å²	158.6	83%	0.83	81%	0.807	S	S	*	*			trans	-64.2	97.9	165	-84.8	-179.8	160.9	131	-6.8	106.8	K8 S12	K8-R10 VanDerWaalsContact C-N 3.31Å; K8-R10 PolarHBondContact O-N 3.39Å; R10-S12 PolarHBondContact O-N 3.27Å
11	L	32.1	Very low	33.1	Very low	166 Å²	166	156 Å²	156	87%	0.869	80%	0.796	S	S	*	*			trans	-71.1	72.7	161.4	-68.9	170.1	0	0	0	107.7	V9 E13	V9-L11 VanDerWaalsContact C-N 3.33Å; V9-L11 HydrophobicContact CG1-CD2 4.27Å; V9-L11 HydrophobicContact CG1-CG 4.34Å; V9-L11 PolarHBondContact O-N 3.09Å; L11-E13 PolarHBondContact O-N 3.11Å
12	S	31.6	Very low	33.1	Very low	87 Å²	87	152.4 Å²	152.4	61%	0.608	78%	0.776	S	S	*	*			trans	-80.7	108.4	166.8	51.7	0	0	0	0	108.2	R10 Q14	R10-S12 PolarHBondContact O-N 3.27Å; S12-Q14 PolarHBondContact O-N 2.88Å
13	E	32.1	Very low	33.1	Very low	189 Å²	189	150.6 Å²	150.6	88%	0.883	77%	0.774	S	S	*	*			trans	46.7	68.9	139.7	-65	173.6	160.4	0	0	116.5	L11	L11-E13 PolarHBondContact O-N 3.11Å
14	Q	32.6	Very low	33	Very low	187 Å²	187	149.2 Å²	149.2	87%	0.874	78%	0.776	S	S	*	*			trans	-134.1	61.2	155	-81.4	-167.6	-10.9	0	0	110.1	S12	S12-Q14 PolarHBondContact O-N 2.88Å
15	I	32.9	Very low	32.8	Very low	171 Å²	171	148.2 Å²	148.2	88%	0.877	77%	0.774	S	S	*	*			trans	-115.5	71.2	152.7	-54	177.8	0	0	0	105.4	G17	I15-G17 PolarHBondContact O-N 3.04Å
16	S	31.2	Very low	32.4	Very low	85 Å²	85	150 Å²	150	59%	0.594	78%	0.782	S	S	*	*			trans	-51.8	127.4	161.1	168.5	0	0	0	0	107.9	Y18	S16-Y18 PolarHBondContact O-N 3.04Å
17	G	28.9	Very low	32.3	Very low	78 Å²	78	147.1 Å²	147.1	80%	0.804	78%	0.783	S	S	*	*			trans	-55.7	95.4	-178.4	0	0	0	0	0	112.6	I15	I15-G17 PolarHBondContact O-N 3.04Å
18	Y	33.1	Very low	32.4	Very low	193 Å²	193	146.8 Å²	146.8	76%	0.757	79%	0.785	S	S	*	*			trans	-101.8	102.7	162.6	-86.3	-87.1	0	0	0	108.4	S16	S16-Y18 PolarHBondContact O-N 3.04Å
19	M	33	Very low	32.6	Very low	129 Å²	129	141.7 Å²	141.7	64%	0.635	78%	0.781	S	S	*	*			trans	64.1	82.5	138.5	-51.2	-166.9	107.5	0	0	115.8	D21	M19-D21 HydrophobicContact CB-CB 4.29Å; M19-D21 WeakPolarHBondContact CE-OD2 3.25Å; M19-D21 PolarHBondContact O-N 2.88Å
20	I	32.7	Very low	32.6	Very low	174 Å²	174	140.1 Å²	140.1	89%	0.892	79%	0.788	S	S	*	*			trans	-73.7	71.5	143.5	-53	172.7	0	0	0	105.8	E22	I20-E22 PolarHBondContact O-N 3.11Å
21	D	37.1	Very low	32.7	Very low	106 Å²	106	132.9 Å²	132.9	57%	0.567	78%	0.781	S	S	*	*			trans	-90.8	96.6	171.1	-82.8	8.2	0	0	0	107.6	M19 I23	M19-D21 HydrophobicContact CB-CB 4.29Å; M19-D21 WeakPolarHBondContact CE-OD2 3.25Å; M19-D21 PolarHBondContact O-N 2.88Å; D21-I23 PolarHBondContact O-N 2.8Å
22	E	35.8	Very low	32.9	Very low	169 Å²	169	135.8 Å²	135.8	79%	0.79	78%	0.781	S	S	*	*			trans	36.9	87	132.2	-58.6	-176.2	172.6	0	0	117.3	I20	I20-E22 PolarHBondContact O-N 3.11Å
23	I	35.9	Very low	33.5	Very low	164 Å²	164	142.3 Å²	142.3	84%	0.841	79%	0.792	S	S	*	*			trans	-116.8	69.5	136.3	50.9	165.5	0	0	0	108.5	D21 S25	D21-I23 PolarHBondContact O-N 2.8Å; I23-S25 VanDerWaalsContact C-N 3.34Å; I23-S25 PolarHBondContact O-N 2.88Å; I23-S25 VanDerWaalsContact O-N 3.12Å
24	S	35.6	Very low	33.9	Very low	116 Å²	116	142.1 Å²	142.1	81%	0.811	79%	0.788	S	S	*	*			trans	-71.2	94.9	160.4	-69.4	0	0	0	0	107.6	E26	S24-E26 PolarHBondContact O-N 3.03Å
25	S	32.7	Very low	34.4	Very low	108 Å²	108	141 Å²	141	76%	0.755	79%	0.788	S	S	*	*			trans	-69.1	106.1	168.8	-63.3	0	0	0	0	109.6	I23	I23-S25 VanDerWaalsContact C-N 3.34Å; I23-S25 PolarHBondContact O-N 2.88Å; I23-S25 VanDerWaalsContact O-N 3.12Å
26	E	29	Very low	34.6	Very low	189 Å²	189	144.4 Å²	144.4	88%	0.883	79%	0.79	S	S	*	*			trans	37.8	85.6	145.2	-67.3	172.3	166.5	0	0	117.5	S24	S24-E26 PolarHBondContact O-N 3.03Å
27	S	31.3	Very low	34.7	Very low	123 Å²	123	146.2 Å²	146.2	86%	0.86	79%	0.793	S	S	*	*			trans	-87.6	97.4	151.1	174.8	0	0	0	0	108.4
28	S	32.7	Very low	35.1	Very low	114 Å²	114	148 Å²	148	80%	0.797	79%	0.79	S	S	*	*			trans	-74.6	150.2	161.3	-175.2	0	0	0	0	109.6
29	A	35.6	Very low	35.3	Very low	95 Å²	95	146.8 Å²	146.8	79%	0.785	79%	0.791	S	S	*	*	S	Bend	trans	81.6	93	176.5	0	0	0	0	0	118.1
30	G	30.8	Very low	35.5	Very low	80 Å²	80	149.1 Å²	149.1	83%	0.825	80%	0.798	S	S	*	*			trans	105.7	-11.5	134.7	0	0	0	0	0	119	R32	G30-R32 PolarHBondContact O-N 3.11Å
31	G	30.3	Very low	35.5	Very low	68 Å²	68	151.5 Å²	151.5	70%	0.701	80%	0.796	S	S	*	*			trans	-81.9	81.2	-177.3	0	0	0	0	0	114.2	R33	G31-R33 PolarHBondContact O-N 3.25Å
32	R	37	Very low	35.5	Very low	226 Å²	226	152.2 Å²	152.2	85%	0.853	80%	0.798	S	S	*	*			trans	-65.4	73.2	165.7	-71.3	-175	178.1	-154.1	0.4	110.8	G30 F34	G30-R32 PolarHBondContact O-N 3.11Å; R32-F34 PolarHBondContact O-N 3.26Å
33	R	43.5	Very low	35.4	Very low	225 Å²	225	152 Å²	152	85%	0.849	80%	0.797	S	S	*	*			trans	-86.8	96.5	169.9	-67.2	-174.1	170.3	-149.8	-2	107.4	G31 L35	G31-R33 PolarHBondContact O-N 3.25Å; R33-L35 VanDerWaalsContact C-N 3.3Å; R33-L35 PolarHBondContact O-N 3.29Å
34	F	39.6	Very low	35.4	Very low	184 Å²	184	152.2 Å²	152.2	81%	0.807	79%	0.792	S	S	*	*			trans	-58.1	98.6	165.3	-70.3	-82.1	0	0	0	107.8	R32 R36	R32-F34 PolarHBondContact O-N 3.26Å; F34-R36 PolarHBondContact O-N 2.99Å
35	L	44.1	Very low	35.2	Very low	165 Å²	165	154.1 Å²	154.1	86%	0.864	79%	0.793	S	S	*	*			trans	-61.9	104.4	166.9	-73.2	171.7	0	0	0	106.6	R33 N37	R33-L35 VanDerWaalsContact C-N 3.3Å; R33-L35 PolarHBondContact O-N 3.29Å; L35-N37 VanDerWaalsContact C-N 3.27Å; L35-N37 PolarHBondContact O-N 2.99Å
36	R	37	Very low	35.2	Very low	242 Å²	242	153.7 Å²	153.7	91%	0.913	79%	0.785	S	S	*	*			trans	-66.2	89.3	178.1	-164.9	178.5	-162.2	174.7	4.6	107.5	F34 P38	F34-R36 PolarHBondContact O-N 2.99Å; R36-P38 VanDerWaalsContact O-CD 3.28Å; R36-P38 WeakPolarHBondContact O-CD 3.39Å
37	N	33.4	Very low	35.3	Very low	122 Å²	122	151.2 Å²	151.2	65%	0.652	78%	0.783	S	S	*	*			trans	-58.7	116.3	179.7	-169.4	-22.2	0	0	0	109.8	L35 E39	L35-N37 VanDerWaalsContact C-N 3.27Å; L35-N37 PolarHBondContact O-N 2.99Å; N37-E39 VanDerWaalsContact C-N 3.33Å; N37-E39 PolarHBondContact O-N 2.97Å
38	P	36.5	Very low	35.3	Very low	116 Å²	116	155.9 Å²	155.9	75%	0.753	78%	0.782	S	S	*	*			trans	-81.1	4.5	-171	28.2	-29.5	0	0	0	115.7	R36	R36-P38 VanDerWaalsContact O-CD 3.28Å; R36-P38 WeakPolarHBondContact O-CD 3.39Å
39	E	37.2	Very low	35.2	Very low	168 Å²	168	159.7 Å²	159.7	79%	0.785	78%	0.784	S	S	*	*			trans	-110.5	29.5	-166.3	-63.3	-163.3	159.6	0	0	117.9	N37	N37-E39 VanDerWaalsContact C-N 3.33Å; N37-E39 PolarHBondContact O-N 2.97Å
40	K	38.1	Very low	34.9	Very low	178 Å²	178	164.6 Å²	164.6	77%	0.774	79%	0.79	S	S	*	*			trans	-120.1	68.2	170.7	-67.2	-170.6	-178.1	179.7	0	112.9	I42	K40-I42 HydrophobicContact CB-CG1 4.46Å; K40-I42 PolarHBondContact O-N 2.8Å
41	R	33.4	Very low	34.9	Very low	224 Å²	224	165.9 Å²	165.9	85%	0.845	79%	0.787	S	S	*	*			trans	-70.4	74	156.4	-72.8	-177.7	176.7	167.3	-0.1	109.3	H43	R41-H43 PolarHBondContact O-N 2.85Å
42	I	35.6	Very low	35.1	Very low	121 Å²	121	168.2 Å²	168.2	62%	0.621	79%	0.79	S	S	*	*			trans	-89.4	103.2	166.2	-56.4	176.6	0	0	0	106.7	K40 K44	K40-I42 HydrophobicContact CB-CG1 4.46Å; K40-I42 PolarHBondContact O-N 2.8Å; I42-K44 VanDerWaalsContact C-N 3.31Å; I42-K44 HydrophobicContact CG2-CG 4.22Å; I42-K44 PolarHBondContact O-N 2.9Å
43	H	34.7	Very low	34.9	Very low	164 Å²	164	162.3 Å²	162.3	76%	0.759	79%	0.789	S	S	*	*			trans	-61	87.3	171.5	-61.6	-86.3	0	0	0	110	R41	R41-H43 PolarHBondContact O-N 2.85Å
44	K	35.6	Very low	34.5	Very low	169 Å²	169	156.9 Å²	156.9	74%	0.735	78%	0.781	S	S	*	*			trans	-97.4	100.1	163.6	-78.1	-173.1	178.3	-179.4	0	108.2	I42 V46	I42-K44 VanDerWaalsContact C-N 3.31Å; I42-K44 HydrophobicContact CG2-CG 4.22Å; I42-K44 PolarHBondContact O-N 2.9Å; K44-V46 VanDerWaalsContact C-N 3.27Å; K44-V46 HydrophobicContact CB-CG2 4.47Å; K44-V46 PolarHBondContact O-N 2.8Å
45	N	31.3	Very low	34.4	Very low	156 Å²	156	155.1 Å²	155.1	83%	0.834	79%	0.785	S	S	*	*			trans	-58.4	87.7	167.7	-71.5	-18.3	0	0	0	109.4
46	V	33.3	Very low	34.2	Very low	98 Å²	98	155.3 Å²	155.3	59%	0.594	78%	0.782	S	S	*	*			trans	-102	95.7	168.6	-179.4	0	0	0	0	107	K44 R48	K44-V46 VanDerWaalsContact C-N 3.27Å; K44-V46 HydrophobicContact CB-CG2 4.47Å; K44-V46 PolarHBondContact O-N 2.8Å; V46-R48 VanDerWaalsContact C-N 3.35Å; V46-R48 HydrophobicContact CG1-CG 4.16Å; V46-R48 PolarHBondContact O-N 3.33Å
47	V	30.1	Very low	34.4	Very low	137 Å²	137	150.4 Å²	150.4	83%	0.83	77%	0.774	S	S	*	*			trans	-60.5	95.7	166.5	179	0	0	0	0	107.4
48	R	30.6	Very low	34.8	Very low	222 Å²	222	153.7 Å²	153.7	84%	0.838	79%	0.785	S	S	*	*			trans	-111.1	126.8	166.4	-97.6	-177.1	-177.9	134	-0.2	109.3	V46	V46-R48 VanDerWaalsContact C-N 3.35Å; V46-R48 HydrophobicContact CG1-CG 4.16Å; V46-R48 PolarHBondContact O-N 3.33Å
49	K	32.6	Very low	35.3	Very low	193 Å²	193	154.7 Å²	154.7	84%	0.839	78%	0.784	S	S	*	*			trans	-57.3	139.9	-169.5	-62	-172.7	174.1	-174.6	0	111.3	S51	K49-S51 PolarHBondContact O-N 3.2Å; K49-S51 VanDerWaalsContact O-N 3.15Å
50	Q	28	Very low	35.6	Very low	198 Å²	198	152 Å²	152	93%	0.925	78%	0.78	S	S	*	*			trans	-55.5	111.8	168.8	-74.7	168.7	-23.6	0	0	109.1
51	S	31.5	Very low	36	Very low	107 Å²	107	152.3 Å²	152.3	75%	0.748	78%	0.784	S	S	*	*			trans	-86.1	147.7	155.1	-71.1	0	0	0	0	108.3	K49 A53	K49-S51 PolarHBondContact O-N 3.2Å; K49-S51 VanDerWaalsContact O-N 3.15Å; S51-A53 PolarHBondContact O-N 3.19Å
52	P	34.7	Very low	36.7	Very low	118 Å²	118	148.2 Å²	148.2	77%	0.766	78%	0.779	S	S	*	*			trans	-62.6	134.3	-166.2	-16.7	30.3	0	0	0	111	T54	P52-T54 PolarHBondContact O-N 3.01Å
53	A	33	Very low	37.2	Very low	101 Å²	101	149.5 Å²	149.5	84%	0.835	79%	0.786	S	S	*	*			trans	-59.6	102.7	170	0	0	0	0	0	108.5	S51 T55	S51-A53 PolarHBondContact O-N 3.19Å; A53-T55 PolarHBondContact O-N 2.97Å
54	T	34.1	Very low	37.5	Very low	112 Å²	112	149.4 Å²	149.4	69%	0.687	79%	0.79	S	S	*	*			trans	-69	117	161.1	46.6	0	0	0	0	106.3	P52 E56	P52-T54 PolarHBondContact O-N 3.01Å; T54-E56 PolarHBondContact O-N 2.84Å
55	T	37	Very low	38	Very low	146 Å²	146	146.2 Å²	146.2	90%	0.896	79%	0.785	S	S	*	*			trans	-55.4	85.2	160	34.4	0	0	0	0	108.2	A53	A53-T55 PolarHBondContact O-N 2.97Å
56	E	40.3	Very low	38.2	Very low	170 Å²	170	143.9 Å²	143.9	79%	0.794	78%	0.778	S	S	*	*			trans	-97.1	135	162.6	-75.4	-162.8	157.2	0	0	108.3	T54	T54-E56 PolarHBondContact O-N 2.84Å
57	D	41.9	Very low	38.3	Very low	138 Å²	138	149 Å²	149	74%	0.738	79%	0.793	S	S	*	*			trans	-45.9	136	-164.6	-70.4	-55.9	0	0	0	115.2	N59	D57-N59 HydrophobicContact CB-CB 4.42Å; D57-N59 PolarHBondContact O-N 2.78Å
58	E	42	Very low	38.7	Very low	192 Å²	192	147.4 Å²	147.4	90%	0.897	79%	0.788	S	S	*	*	S	Bend	trans	-61	16.5	170.7	-73.7	-176.4	145	0	0	114.7
59	N	46.2	Very low	38.9	Very low	136 Å²	136	141.1 Å²	141.1	73%	0.727	78%	0.784	S	S	*	*			trans	-102.4	17.1	-166.9	-79.5	-2.6	0	0	0	115.7	D57	D57-N59 HydrophobicContact CB-CB 4.42Å; D57-N59 PolarHBondContact O-N 2.78Å
60	T	43.7	Very low	38.7	Very low	113 Å²	113	134.9 Å²	134.9	69%	0.693	77%	0.774	S	S	*	*	S	Bend	trans	-106.4	-2.6	-178.7	-25.5	0	0	0	0	115
61	E	47.1	Very low	38.9	Very low	183 Å²	183	134.9 Å²	134.9	86%	0.855	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-82.7	-11.6	179.2	-64	-164.2	174.1	0	0	114.2
62	D	48	Very low	38.8	Very low	138 Å²	138	135.6 Å²	135.6	74%	0.738	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-91	0.1	-175.7	-84.8	-8.7	0	0	0	115.6
63	L	45.9	Very low	38.7	Very low	149 Å²	149	134.9 Å²	134.9	78%	0.78	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-90.4	2.3	-179	-65.8	-176.8	0	0	0	115.1
64	L	40.6	Very low	38.5	Very low	161 Å²	161	136.1 Å²	136.1	84%	0.843	76%	0.761	S	S	*	*	G	3₁₀ helix	trans	-121.6	45.8	174.2	-72.7	167.1	0	0	0	111.1	P66	L64-P66 WeakPolarHBondContact O-CD 3.13Å
65	T	45.2	Very low	38.3	Very low	102 Å²	102	135.9 Å²	135.9	63%	0.626	76%	0.755	S	S	*	*			trans	-65.7	113.6	153.2	46.3	0	0	0	0	106.9	F67	T65-F67 PolarHBondContact O-N 2.89Å
66	P	36.7	Very low	38	Very low	107 Å²	107	133.8 Å²	133.8	70%	0.695	74%	0.738	S	S	*	*			trans	-53.4	125.3	168.7	22	-30.5	0	0	0	106.1	L64 S68	L64-P66 WeakPolarHBondContact O-CD 3.13Å; P66-S68 PolarHBondContact O-N 2.93Å
67	F	36.1	Very low	37.5	Very low	206 Å²	206	132.5 Å²	132.5	90%	0.904	74%	0.737	S	S	*	*			trans	-56.5	90.6	163.7	-78.9	-88.4	0	0	0	105.9	T65 A69	T65-F67 PolarHBondContact O-N 2.89Å; F67-A69 PolarHBondContact O-N 2.91Å
68	S	36.5	Very low	36.9	Very low	103 Å²	103	135.3 Å²	135.3	72%	0.72	74%	0.742	S	S	*	*			trans	-62.3	102	158.1	-61.1	0	0	0	0	101.6	P66 G70	P66-S68 PolarHBondContact O-N 2.93Å; S68-G70 PolarHBondContact O-N 3.1Å
69	A	35.6	Very low	36.3	Very low	91 Å²	91	131.9 Å²	131.9	75%	0.752	73%	0.726	S	S	*	*			trans	-49.5	102.1	168.9	0	0	0	0	0	104.4	F67 K71	F67-A69 PolarHBondContact O-N 2.91Å; A69-K71 VanDerWaalsContact C-N 3.34Å; A69-K71 PolarHBondContact O-N 2.85Å
70	G	28.3	Very low	35.6	Very low	62 Å²	62	131 Å²	131	64%	0.639	73%	0.731	S	S	*	*			trans	-52.9	115.1	172.7	0	0	0	0	0	102.1	S68 T72	S68-G70 PolarHBondContact O-N 3.1Å; G70-T72 PolarHBondContact O-N 3.35Å
71	K	33.2	Very low	34.8	Very low	197 Å²	197	130.9 Å²	130.9	86%	0.857	73%	0.73	S	S	*	*			trans	-55.5	96.1	163.2	-68.6	179.7	180	178.8	0	102	A69 S73	A69-K71 VanDerWaalsContact C-N 3.34Å; A69-K71 PolarHBondContact O-N 2.85Å; K71-S73 PolarHBondContact O-N 2.92Å
72	T	29.1	Very low	34	Very low	122 Å²	122	130.1 Å²	130.1	75%	0.748	73%	0.726	S	S	*	*			trans	-57	90	148.5	39.8	0	0	0	0	100.7	G70 L74	G70-T72 PolarHBondContact O-N 3.35Å; T72-L74 PolarHBondContact O-N 3.11Å
73	S	31.2	Very low	32.8	Very low	103 Å²	103	130.6 Å²	130.6	72%	0.72	72%	0.722	S	S	*	*			trans	-54.6	87.3	148.2	36.3	0	0	0	0	101.2	K71 N75	K71-S73 PolarHBondContact O-N 2.92Å; S73-N75 PolarHBondContact O-N 3.05Å
74	L	29.6	Very low	31.9	Very low	128 Å²	128	128.4 Å²	128.4	67%	0.67	72%	0.715	S	S	*	*			trans	-55.9	102.1	168.2	-160	119.3	0	0	0	100.2	T72 L76	T72-L74 PolarHBondContact O-N 3.11Å; L74-L76 HydrophobicContact CD2-CD2 3.7Å; L74-L76 HydrophobicContact CD2-CG 4.12Å; L74-L76 PolarHBondContact O-N 2.9Å
75	N	29.4	Very low	31.1	Very low	107 Å²	107	129 Å²	129	57%	0.572	71%	0.711	S	S	*	*			trans	-69.7	87.4	-177	-166.1	-15.8	0	0	0	102.7	S73 N77 K78	S73-N75 PolarHBondContact O-N 3.05Å; N75-N77 PolarHBondContact O-N 2.67Å; N75-N77 WeakPolarHBondContact OD1-CB 3.42Å; N75-N77 VanDerWaalsContact OD1-CG 3.22Å; N75-N77 PolarHBondContact OD1-N 2.73Å; N75-N77 PolarHBondContact OD1-ND2 2.7Å; N75-K78 PolarHBondContact O-N 3.4Å; N75-K78 VanDerWaalsContact O-N 3.09Å
76	L	31.4	Very low	30.3	Very low	101 Å²	101	130.5 Å²	130.5	53%	0.529	72%	0.715	S	S	.	*	G	3₁₀ helix	trans	-58	-5.8	178.8	-75.2	160.1	0	0	0	110.1	L74 K78 H79	L74-L76 HydrophobicContact CD2-CD2 3.7Å; L74-L76 HydrophobicContact CD2-CG 4.12Å; L74-L76 PolarHBondContact O-N 2.9Å; L76-K78 PolarHBondContact O-N 3.05Å; L76-H79 VanDerWaalsContact CD2-NE2 3.33Å; L76-H79 WeakPolarHBondContact CD2-NE2 3.31Å; L76-H79 PolarHBondContact O-CD2 2.74Å; L76-H79 PolarHBondContact O-N 3.17Å
77	N	29.6	Very low	29.8	Very low	144 Å²	144	132.7 Å²	132.7	77%	0.77	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-66.3	5.3	166.8	-57.9	-23.5	0	0	0	114.7	N75	N75-N77 PolarHBondContact O-N 2.67Å; N75-N77 WeakPolarHBondContact OD1-CB 3.42Å; N75-N77 VanDerWaalsContact OD1-CG 3.22Å; N75-N77 PolarHBondContact OD1-N 2.73Å; N75-N77 PolarHBondContact OD1-ND2 2.7Å
78	K	28.5	Very low	29.3	Very low	197 Å²	197	132.5 Å²	132.5	86%	0.857	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-109.3	31.5	162.8	-67.7	-170.9	-178	179.3	0	113.1	N75 L76 S80	N75-K78 PolarHBondContact O-N 3.4Å; N75-K78 VanDerWaalsContact O-N 3.09Å; L76-K78 PolarHBondContact O-N 3.05Å; K78-S80 PolarHBondContact O-N 2.89Å; K78-S80 VanDerWaalsContact O-N 3.11Å
79	H	30.2	Very low	28.8	Very low	120 Å²	120	131.9 Å²	131.9	56%	0.556	72%	0.715	S	S	*	*	S	Bend	trans	-58.4	117	146.1	-64.3	-59.5	0	0	0	106.5	L76 T81	L76-H79 VanDerWaalsContact CD2-NE2 3.33Å; L76-H79 WeakPolarHBondContact CD2-NE2 3.31Å; L76-H79 PolarHBondContact O-CD2 2.74Å; L76-H79 PolarHBondContact O-N 3.17Å; H79-T81 HydrophobicContact CB-CG2 4.31Å; H79-T81 PolarHBondContact O-N 2.86Å
80	S	30.8	Very low	28.3	Very low	118 Å²	118	137.1 Å²	137.1	83%	0.825	72%	0.721	S	S	*	*			trans	-63.1	78.6	163.4	174.6	0	0	0	0	106.6	K78 Q82	K78-S80 PolarHBondContact O-N 2.89Å; K78-S80 VanDerWaalsContact O-N 3.11Å; S80-Q82 PolarHBondContact O-N 3.12Å
81	T	27.8	Very low	28.2	Very low	109 Å²	109	140.3 Å²	140.3	67%	0.669	72%	0.723	S	S	*	*			trans	-66.4	89	167.7	41.3	0	0	0	0	104.9	H79 K83	H79-T81 HydrophobicContact CB-CG2 4.31Å; H79-T81 PolarHBondContact O-N 2.86Å; T81-K83 PolarHBondContact O-N 2.87Å
82	Q	29.7	Very low	28	Very low	167 Å²	167	137.2 Å²	137.2	78%	0.78	73%	0.726	S	S	*	*			trans	-66.7	89.4	161.7	-169.2	172.2	24.4	0	0	105.2	S80 V84	S80-Q82 PolarHBondContact O-N 3.12Å; Q82-V84 HydrophobicContact CG-CG2 4.2Å; Q82-V84 PolarHBondContact O-N 3.11Å
83	K	23.5	Very low	28	Very low	148 Å²	148	134.9 Å²	134.9	64%	0.643	72%	0.715	S	S	*	*			trans	-61.4	89.4	166	-83.3	-173.3	175.2	-175.8	0	106.2	T81 F85	T81-K83 PolarHBondContact O-N 2.87Å; K83-F85 HydrophobicContact CB-CD2 4.29Å; K83-F85 HydrophobicContact CB-CE2 4.24Å; K83-F85 HydrophobicContact CD-CE2 4.44Å; K83-F85 PolarHBondContact O-N 2.93Å
84	V	27.5	Very low	27.8	Very low	104 Å²	104	134.2 Å²	134.2	63%	0.63	73%	0.725	S	S	*	*			trans	-68.6	92.1	164.6	-178.2	0	0	0	0	104.8	Q82 N86	Q82-V84 HydrophobicContact CG-CG2 4.2Å; Q82-V84 PolarHBondContact O-N 3.11Å; V84-N86 VanDerWaalsContact C-N 3.26Å; V84-N86 PolarHBondContact O-N 2.76Å
85	F	24	Very low	27.6	Very low	174 Å²	174	134.3 Å²	134.3	76%	0.763	73%	0.725	S	S	*	*			trans	-61.1	98.5	165.3	-86.1	-85.9	0	0	0	106.4	K83 N87	K83-F85 HydrophobicContact CB-CD2 4.29Å; K83-F85 HydrophobicContact CB-CE2 4.24Å; K83-F85 HydrophobicContact CD-CE2 4.44Å; K83-F85 PolarHBondContact O-N 2.93Å; F85-N87 PolarHBondContact O-N 2.69Å; F85-N87 VanDerWaalsContact O-N 3.11Å
86	N	27.9	Very low	27.4	Very low	132 Å²	132	138.4 Å²	138.4	71%	0.706	74%	0.737	S	S	*	*			trans	-56.8	120.1	160.1	-83.4	-11.2	0	0	0	106.2	V84 K88	V84-N86 VanDerWaalsContact C-N 3.26Å; V84-N86 PolarHBondContact O-N 2.76Å; N86-K88 PolarHBondContact O-N 2.69Å; N86-K88 VanDerWaalsContact O-N 3.12Å
87	N	25.5	Very low	27.2	Very low	154 Å²	154	139.3 Å²	139.3	82%	0.824	75%	0.752	S	S	*	*			trans	-42.8	124	171.5	-89	-23.9	0	0	0	108.3	F85 S89	F85-N87 PolarHBondContact O-N 2.69Å; F85-N87 VanDerWaalsContact O-N 3.11Å; N87-S89 PolarHBondContact O-N 2.92Å
88	K	25.6	Very low	27.4	Very low	201 Å²	201	139.1 Å²	139.1	87%	0.874	74%	0.744	S	S	*	*			trans	-57.1	81.9	172.9	-76.7	176.9	174.5	174.1	0	109.1	N86 K90	N86-K88 PolarHBondContact O-N 2.69Å; N86-K88 VanDerWaalsContact O-N 3.12Å; K88-K90 PolarHBondContact O-N 3.17Å; K88-K90 VanDerWaalsContact O-N 3.11Å
89	S	26.7	Very low	27.4	Very low	91 Å²	91	138.1 Å²	138.1	64%	0.636	74%	0.743	S	S	*	*			trans	-72.7	102.7	159.2	61	0	0	0	0	105.4	N87 N91	N87-S89 PolarHBondContact O-N 2.92Å; S89-N91 PolarHBondContact O-N 3.36Å
90	K	24.4	Very low	27.6	Very low	200 Å²	200	137 Å²	137	87%	0.87	74%	0.744	S	S	*	*			trans	-58.2	80.7	170.5	-69.4	174.3	176.8	175.6	0	108.8	K88	K88-K90 PolarHBondContact O-N 3.17Å; K88-K90 VanDerWaalsContact O-N 3.11Å
91	N	25.5	Very low	27.6	Very low	129 Å²	129	137 Å²	137	69%	0.69	73%	0.731	S	S	*	*			trans	-87	122.1	165.5	-74.1	0.3	0	0	0	107	S89 S93	S89-N91 PolarHBondContact O-N 3.36Å; N91-S93 PolarHBondContact O-N 3.16Å
92	S	29.7	Very low	27.8	Very low	132 Å²	132	138.6 Å²	138.6	92%	0.923	73%	0.729	S	S	*	*	S	Bend	trans	-76.2	36.6	-162.2	55.8	0	0	0	0	114.7
93	S	29.1	Very low	27.9	Very low	73 Å²	73	136.8 Å²	136.8	51%	0.51	72%	0.716	S	S	.	*	S	Bend	trans	-116.5	125.1	169.7	56.7	0	0	0	0	108.1	N91 I95	N91-S93 PolarHBondContact O-N 3.16Å; S93-I95 PolarHBondContact O-N 2.59Å
94	G	26.8	Very low	28.1	Very low	89 Å²	89	134.8 Å²	134.8	92%	0.918	72%	0.72	S	S	*	*			trans	-67.4	32.3	-174.9	0	0	0	0	0	115.2	K96	G94-K96 PolarHBondContact O-N 2.87Å
95	I	25.5	Very low	28.2	Very low	131 Å²	131	134 Å²	134	67%	0.672	72%	0.716	S	S	*	*			trans	-84.9	106.3	176.7	-53.3	174.8	0	0	0	106.3	S93 S97	S93-I95 PolarHBondContact O-N 2.59Å; I95-S97 PolarHBondContact O-N 3.31Å
96	K	26.4	Very low	28.5	Very low	192 Å²	192	132.6 Å²	132.6	84%	0.835	72%	0.716	S	S	*	*			trans	-51.8	109.4	169.3	-70.2	179.9	179	178	0	107.7	G94 K98	G94-K96 PolarHBondContact O-N 2.87Å; K96-K98 PolarHBondContact O-N 2.92Å
97	S	27.2	Very low	28.6	Very low	120 Å²	120	131.9 Å²	131.9	84%	0.839	71%	0.712	S	S	*	*			trans	-65.7	105.4	174.8	-33.4	0	0	0	0	107	I95	I95-S97 PolarHBondContact O-N 3.31Å
98	K	33.4	Very low	29.1	Very low	141 Å²	141	132.5 Å²	132.5	61%	0.613	72%	0.716	S	S	*	*			trans	-65.9	141.7	176.6	-73.6	-170.2	176.3	-170.4	0	109.1	K96 V100 D120	K96-K98 PolarHBondContact O-N 2.92Å; K98-V100 PolarHBondContact O-N 2.97Å; K98-D120 IonicContact NZ-OD1 2.97Å; K98-D120 PolarHBondContact NZ-OD1 3.38Å; K98-D120 IonicContact NZ-OD2 2.71Å; K98-D120 PolarHBondContact NZ-OD2 3.35Å
99	E	28.7	Very low	29.4	Very low	175 Å²	175	126.6 Å²	126.6	82%	0.818	71%	0.711	S	S	*	*			trans	-65.9	117.8	-170.1	-155.2	162.3	-163.8	0	0	109.9
100	V	33.8	Very low	29.7	Very low	97 Å²	97	127.9 Å²	127.9	59%	0.588	71%	0.71	S	S	*	*			trans	-91.4	103.8	177.5	178.6	0	0	0	0	107.8	K98 K102 V115	K98-V100 PolarHBondContact O-N 2.97Å; V100-K102 HydrophobicContact CG1-CG 4.37Å; V100-K102 PolarHBondContact O-N 3.42Å; V100-V115 HydrophobicContact CG1-CG1 4.41Å
101	E	31.5	Very low	30	Very low	117 Å²	117	125.4 Å²	125.4	55%	0.547	71%	0.706	S	S	.	*			trans	-74.9	117.7	170.2	-73.2	-169.4	155.9	0	0	109.7	Y103	E101-Y103 HydrophobicContact CB-CD2 4.47Å; E101-Y103 HydrophobicContact CB-CE2 3.74Å; E101-Y103 PolarHBondContact OE2-OH 3.06Å
102	K	31.5	Very low	30.2	Very low	143 Å²	143	125.3 Å²	125.3	62%	0.622	70%	0.702	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-96.2	115.1	176.3	-68.9	-176.6	179	-177	0	108.9	V100	V100-K102 HydrophobicContact CG1-CG 4.37Å; V100-K102 PolarHBondContact O-N 3.42Å
103	Y	31.3	Very low	30.3	Very low	129 Å²	129	122.5 Å²	122.5	51%	0.506	68%	0.676	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.4	123.6	170	-64.5	-87.8	0	0	0	108.6	E101	E101-Y103 HydrophobicContact CB-CD2 4.47Å; E101-Y103 HydrophobicContact CB-CE2 3.74Å; E101-Y103 PolarHBondContact OE2-OH 3.06Å
104	S	28	Very low	30.3	Very low	106 Å²	106	122.5 Å²	122.5	74%	0.741	67%	0.67	S	S	*	*			trans	-111.5	104.9	171.3	-60.6	0	0	0	0	107.9
105	V	30.7	Very low	30.7	Very low	89 Å²	89	120.3 Å²	120.3	54%	0.539	64%	0.639	S	S	.	*			trans	-89.5	112.4	173.4	-177.4	0	0	0	0	107.2	N107	V105-N107 VanDerWaalsContact C-N 3.3Å; V105-N107 PolarHBondContact O-N 2.78Å
106	N	29.2	Very low	30.9	Very low	144 Å²	144	118.5 Å²	118.5	77%	0.77	63%	0.633	S	S	*	*			trans	-83.2	73.4	-177.7	-168.3	17.3	0	0	0	110.1
107	N	31.3	Very low	31.2	Very low	117 Å²	117	115.5 Å²	115.5	63%	0.626	62%	0.622	S	S	*	*			trans	-107.4	103.7	170.9	-76.9	5.9	0	0	0	109	V105 G109	V105-N107 VanDerWaalsContact C-N 3.3Å; V105-N107 PolarHBondContact O-N 2.78Å; N107-G109 PolarHBondContact O-N 2.78Å
108	N	35.9	Very low	31.3	Very low	167 Å²	167	118.4 Å²	118.4	89%	0.893	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	44	50.3	154.3	-65.3	-7.6	0	0	0	118
109	G	30.6	Very low	31.3	Very low	76 Å²	76	115.5 Å²	115.5	78%	0.784	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	91.5	-1.1	159	0	0	0	0	0	116.6	N107	N107-G109 PolarHBondContact O-N 2.78Å
110	I	32.7	Very low	31.7	Very low	119 Å²	119	113 Å²	113	61%	0.61	61%	0.606	S	S	*	*			trans	-109.5	99.9	170.6	-46.9	179.2	0	0	0	107.1	E112	I110-E112 HydrophobicContact CB-CG 4.49Å; I110-E112 HydrophobicContact CG2-CG 3.61Å; I110-E112 PolarHBondContact O-N 2.85Å
111	N	31.8	Very low	31.9	Very low	147 Å²	147	117.5 Å²	117.5	79%	0.786	62%	0.621	S	S	*	*			trans	-72.6	73.3	172.2	-71.8	-33.6	0	0	0	108.8	L113	N111-L113 PolarHBondContact O-N 2.94Å
112	E	28.9	Very low	32.4	Very low	128 Å²	128	119.2 Å²	119.2	60%	0.598	63%	0.634	S	S	*	*			trans	-71.4	100.4	168.1	-66.4	-166.9	165.5	0	0	108	I110 L114	I110-E112 HydrophobicContact CB-CG 4.49Å; I110-E112 HydrophobicContact CG2-CG 3.61Å; I110-E112 PolarHBondContact O-N 2.85Å; E112-L114 PolarHBondContact O-N 2.73Å
113	L	32	Very low	32.6	Very low	72 Å²	72	118.7 Å²	118.7	38%	0.377	64%	0.638	S	S	.	*			trans	-76.8	89.2	175.9	-168.6	82.3	0	0	0	108.8	N111 V115 F132	N111-L113 PolarHBondContact O-N 2.94Å; L113-V115 HydrophobicContact CD2-CG2 4.18Å; L113-V115 HydrophobicContact CG-CG2 4.35Å; L113-V115 PolarHBondContact O-N 3.42Å; L113-F132 HydrophobicContact CD2-CE2 4.42Å
114	L	29.2	Very low	32.8	Very low	74 Å²	74	120.9 Å²	120.9	39%	0.387	66%	0.657	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.6	108.1	172.6	-75.2	160.1	0	0	0	109.5	E112 V129	E112-L114 PolarHBondContact O-N 2.73Å; L114-V129 HydrophobicContact CD2-CG1 4.09Å
115	V	34.1	Very low	33	Very low	43 Å²	43	120.8 Å²	120.8	26%	0.261	66%	0.657	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96	108.8	169.5	-179	0	0	0	0	107.7	V100 L113	V100-V115 HydrophobicContact CG1-CG1 4.41Å; L113-V115 HydrophobicContact CD2-CG2 4.18Å; L113-V115 HydrophobicContact CG-CG2 4.35Å; L113-V115 PolarHBondContact O-N 3.42Å
116	V	31.2	Very low	32.9	Very low	93 Å²	93	125 Å²	125	56%	0.564	66%	0.663	S	S	*	*			trans	-93.8	116.9	174.4	-177.6	0	0	0	0	107.7
117	Q	32.2	Very low	33	Very low	128 Å²	128	125.2 Å²	125.2	60%	0.598	66%	0.662	S	S	*	*			trans	-98.4	109.2	171.8	-176	176.2	-12.7	0	0	108.6	N119	Q117-N119 PolarHBondContact NE2-OD1 2.59Å; Q117-N119 VanDerWaalsContact NE2-OD1 3.16Å; Q117-N119 PolarHBondContact O-N 2.68Å
118	E	30.1	Very low	32.9	Very low	181 Å²	181	122.8 Å²	122.8	85%	0.846	66%	0.655	S	S	*	*			trans	-79.9	114.4	171.7	-149.5	175.4	-157.1	0	0	108.3
119	N	32.2	Very low	32.7	Very low	81 Å²	81	119.6 Å²	119.6	43%	0.433	64%	0.641	S	S	.	*			trans	-93.2	146.4	174.6	-69.3	-40.8	0	0	0	109.7	Q117 E121	Q117-N119 PolarHBondContact NE2-OD1 2.59Å; Q117-N119 VanDerWaalsContact NE2-OD1 3.16Å; Q117-N119 PolarHBondContact O-N 2.68Å; N119-E121 PolarHBondContact O-N 3.23Å
120	D	36.6	Very low	32.8	Very low	123 Å²	123	120.8 Å²	120.8	66%	0.658	63%	0.629	S	S	*	*			trans	-61.5	126.5	-173.1	-58.2	-38.5	0	0	0	112.4	K98 N122	K98-D120 IonicContact NZ-OD1 2.97Å; K98-D120 PolarHBondContact NZ-OD1 3.38Å; K98-D120 IonicContact NZ-OD2 2.71Å; K98-D120 PolarHBondContact NZ-OD2 3.35Å; D120-N122 PolarHBondContact O-N 2.79Å
121	E	38.8	Very low	32.7	Very low	191 Å²	191	118.9 Å²	118.9	89%	0.893	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	43.6	-8.3	150	-77.4	-172.4	161.5	0	0	124.9	N119	N119-E121 PolarHBondContact O-N 3.23Å
122	N	42.1	Very low	32.8	Very low	153 Å²	153	118.9 Å²	118.9	82%	0.818	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.8	-7.6	175	-85.5	-39.3	0	0	0	116.7	D120	D120-N122 PolarHBondContact O-N 2.79Å
123	D	36.7	Very low	32.8	Very low	131 Å²	131	119.1 Å²	119.1	70%	0.701	63%	0.625	S	S	*	*			trans	-117.3	62.3	-178.7	-73.3	-31.2	0	0	0	112	S125	D123-S125 PolarHBondContact O-N 2.95Å
124	L	34.1	Very low	32.6	Very low	175 Å²	175	122.5 Å²	122.5	92%	0.916	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn		50	-34.4	109.1	-52.7	175.3	0	0	0	123.5
125	S	32.9	Very low	32.7	Very low	105 Å²	105	128.6 Å²	128.6	73%	0.734	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-170.1	17.3	-153.2	33.3	0	0	0	0	120.3	D123	D123-S125 PolarHBondContact O-N 2.95Å
126	R	28.7	Very low	32.6	Very low	178 Å²	178	133.5 Å²	133.5	67%	0.672	69%	0.691	S	S	*	*			trans	-113.5	76.5	169.5	-69.9	-170.9	-178.1	-146.4	0.1	112.2	S128	R126-S128 PolarHBondContact O-N 2.79Å
127	I	29.9	Very low	32.3	Very low	147 Å²	147	134.3 Å²	134.3	75%	0.754	70%	0.701	S	S	*	*			trans	-75.5	98.4	161.5	-58	173.3	0	0	0	106.5	V129	I127-V129 HydrophobicContact CG2-CG2 4.09Å; I127-V129 PolarHBondContact O-N 3.18Å
128	S	30.4	Very low	31.9	Very low	67 Å²	67	136.7 Å²	136.7	47%	0.469	72%	0.717	S	S	.	*			trans	-82.7	103.1	172.9	-63.4	0	0	0	0	109.4	R126 L130	R126-S128 PolarHBondContact O-N 2.79Å; S128-L130 PolarHBondContact O-N 2.82Å
129	V	31.1	Very low	31.6	Very low	100 Å²	100	133.3 Å²	133.3	61%	0.606	71%	0.713	S	S	*	*			trans	-84.2	99.5	170	-177.2	0	0	0	0	107.9	L114 I127 S131	L114-V129 HydrophobicContact CD2-CG1 4.09Å; I127-V129 HydrophobicContact CG2-CG2 4.09Å; I127-V129 PolarHBondContact O-N 3.18Å; V129-S131 PolarHBondContact O-N 3.45Å
130	L	33.3	Very low	31.1	Very low	101 Å²	101	134.4 Å²	134.4	53%	0.529	73%	0.728	S	S	.	*			trans	-79.8	95.3	171.3	-84.7	152	0	0	0	108.9	S128 F132	S128-L130 PolarHBondContact O-N 2.82Å; L130-F132 HydrophobicContact CB-CE2 4.16Å; L130-F132 PolarHBondContact O-N 3.05Å
131	S	29.6	Very low	30.4	Very low	79 Å²	79	133.2 Å²	133.2	55%	0.552	74%	0.735	S	S	*	*			trans	-80.7	110.4	169.8	-175.7	0	0	0	0	109.6	V129 N133	V129-S131 PolarHBondContact O-N 3.45Å; S131-N133 VanDerWaalsContact C-N 3.34Å; S131-N133 PolarHBondContact O-N 2.98Å; S131-N133 VanDerWaalsContact O-N 3.15Å
132	F	34	Very low	29.5	Very low	146 Å²	146	131.4 Å²	131.4	64%	0.64	73%	0.731	S	S	*	*			trans	-83.2	82.1	171.8	-68.6	-83.1	0	0	0	109.3	L113 L130	L113-F132 HydrophobicContact CD2-CE2 4.42Å; L130-F132 HydrophobicContact CB-CE2 4.16Å; L130-F132 PolarHBondContact O-N 3.05Å
133	N	29.7	Very low	28.7	Very low	133 Å²	133	133.4 Å²	133.4	71%	0.711	73%	0.732	S	S	*	*			trans	-76.5	123.3	163.1	-78.3	-15.9	0	0	0	108.7	S131	S131-N133 VanDerWaalsContact C-N 3.34Å; S131-N133 PolarHBondContact O-N 2.98Å; S131-N133 VanDerWaalsContact O-N 3.15Å
134	N	27.6	Very low	28	Very low	144 Å²	144	135.9 Å²	135.9	77%	0.77	74%	0.74	S	S	*	*			trans	83.6	130.5	169.1	-57.3	-20.1	0	0	0	117.9	D136	N134-D136 PolarHBondContact O-N 2.92Å; N134-D136 VanDerWaalsContact O-N 3.16Å
135	K	31.1	Very low	27.5	Very low	201 Å²	201	132.7 Å²	132.7	87%	0.874	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	0.7	-176	-79.7	-90.3	-176.2	171.9	0	115.1
136	D	31.6	Very low	27	Very low	146 Å²	146	132.6 Å²	132.6	78%	0.781	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.1	18.5	-157.9	-64.3	-26.6	0	0	0	116.1	N134	N134-D136 PolarHBondContact O-N 2.92Å; N134-D136 VanDerWaalsContact O-N 3.16Å
137	S	26.1	Very low	26.7	Very low	111 Å²	111	134.8 Å²	134.8	78%	0.776	75%	0.747	S	S	*	*			trans	-126.4	44.3	179.8	-51.8	0	0	0	0	114.1	S139	S137-S139 VanDerWaalsContact C-N 3.34Å
138	L	24.1	Very low	26.4	Very low	178 Å²	178	134.6 Å²	134.6	93%	0.932	75%	0.747	S	S	*	*			trans	-95.3	57.9	160.5	-90.2	159.4	0	0	0	109.7	S140	L138-S140 PolarHBondContact O-N 3.05Å
139	S	22.3	Very low	26.1	Very low	109 Å²	109	140.4 Å²	140.4	76%	0.762	77%	0.767	S	S	*	*			trans	-83.6	106.2	166.1	73.4	0	0	0	0	108.3	S137 A141	S137-S139 VanDerWaalsContact C-N 3.34Å; S139-A141 PolarHBondContact O-N 3.11Å
140	S	21.5	Very low	25.8	Very low	105 Å²	105	140 Å²	140	73%	0.734	77%	0.768	S	S	*	*			trans	-58.6	96.4	174	55.5	0	0	0	0	110.7	L138 N142	L138-S140 PolarHBondContact O-N 3.05Å; S140-N142 PolarHBondContact O-N 2.69Å
141	A	23.2	Very low	25.5	Very low	97 Å²	97	145.4 Å²	145.4	80%	0.802	79%	0.788	S	S	*	*			trans	-77.7	67.2	170.2	0	0	0	0	0	110	S139 K143	S139-A141 PolarHBondContact O-N 3.11Å; A141-K143 VanDerWaalsContact C-N 3.28Å; A141-K143 PolarHBondContact O-N 3.02Å; A141-K143 VanDerWaalsContact O-N 3.17Å
142	N	20.3	Very low	25.2	Very low	154 Å²	154	148.7 Å²	148.7	82%	0.824	80%	0.796	S	S	*	*			trans	-76.6	85	157.2	-84.9	-23.4	0	0	0	107.3	S140	S140-N142 PolarHBondContact O-N 2.69Å
143	K	23.7	Very low	24.9	Very low	194 Å²	194	146.2 Å²	146.2	84%	0.843	80%	0.797	S	S	*	*			trans	-131.1	100.3	161.2	-95.7	-174.3	176.2	177.2	0	109.3	A141	A141-K143 VanDerWaalsContact C-N 3.28Å; A141-K143 PolarHBondContact O-N 3.02Å; A141-K143 VanDerWaalsContact O-N 3.17Å
144	E	22.8	Very low	25	Very low	183 Å²	183	145.6 Å²	145.6	86%	0.855	80%	0.798	S	S	*	*			trans	23	120.9	147.2	-71.2	171	148.4	0	0	118	S146	E144-S146 PolarHBondContact O-N 3.36Å
145	A	23.1	Very low	25.4	Very low	109 Å²	109	146.9 Å²	146.9	90%	0.901	80%	0.797	S	S	*	*			trans	-57.7	88.9	168.2	0	0	0	0	0	112	R147	A145-R147 PolarHBondContact O-N 2.99Å
146	S	24	Very low	25.7	Very low	103 Å²	103	143.4 Å²	143.4	72%	0.72	79%	0.788	S	S	*	*			trans	-84.8	95.4	159	73.9	0	0	0	0	108.6	E144 N148	E144-S146 PolarHBondContact O-N 3.36Å; S146-N148 PolarHBondContact O-N 3.42Å
147	R	20.7	Very low	25.9	Very low	223 Å²	223	143.8 Å²	143.8	84%	0.842	79%	0.79	S	S	*	*			trans	-48.3	97.1	168.4	-172.6	-174.2	-157.9	169	5	111	A145	A145-R147 PolarHBondContact O-N 2.99Å
148	N	25.3	Very low	26.5	Very low	144 Å²	144	144.3 Å²	144.3	77%	0.77	78%	0.78	S	S	*	*			trans	-137.5	104	162.2	-80.7	-27.4	0	0	0	108	S146 S150	S146-N148 PolarHBondContact O-N 3.42Å; N148-S150 VanDerWaalsContact C-N 3.3Å; N148-S150 PolarHBondContact O-N 3.37Å
149	E	23.8	Very low	27.1	Very low	189 Å²	189	143 Å²	143	88%	0.883	77%	0.773	S	S	*	*			trans	-65.3	88.6	169.1	-63.9	172.3	-171.1	0	0	108.3
150	S	24	Very low	27.7	Very low	91 Å²	91	144.7 Å²	144.7	64%	0.636	77%	0.773	S	S	*	*			trans	-111.8	110.9	167.8	-165.3	0	0	0	0	108.4	N148 M152	N148-S150 VanDerWaalsContact C-N 3.3Å; N148-S150 PolarHBondContact O-N 3.37Å; S150-M152 PolarHBondContact O-N 2.94Å
151	K	27.3	Very low	28.4	Very low	214 Å²	214	143.9 Å²	143.9	93%	0.93	76%	0.76	S	S	*	*			trans	-64.8	78.3	168.4	-67.4	174.3	179.1	174.8	0	108.3
152	M	23.4	Very low	29.2	Very low	148 Å²	148	141.9 Å²	141.9	73%	0.729	74%	0.739	S	S	*	*			trans	-123.5	106.3	163.3	-147.9	84.9	84.2	0	0	105.4	S150 T154	S150-M152 PolarHBondContact O-N 2.94Å; M152-T154 PolarHBondContact O-N 3.03Å
153	S	27.4	Very low	30.4	Very low	94 Å²	94	139.8 Å²	139.8	66%	0.657	73%	0.732	S	S	*	*			trans	-57.8	84.9	168.2	172.2	0	0	0	0	107.6	F155	S153-F155 PolarHBondContact O-N 3.07Å; S153-F155 WeakPolarHBondContact OG-CD2 3.46Å; S153-F155 WeakPolarHBondContact OG-CE2 3.31Å
154	T	31.9	Very low	31.3	Very low	120 Å²	120	136.3 Å²	136.3	74%	0.736	72%	0.723	S	S	*	*			trans	-64.3	89.1	158.8	37.7	0	0	0	0	104.8	M152 D156	M152-T154 PolarHBondContact O-N 3.03Å; T154-D156 VanDerWaalsContact C-N 3.28Å; T154-D156 PolarHBondContact O-N 3.04Å
155	F	35.1	Very low	32.3	Very low	171 Å²	171	132 Å²	132	75%	0.75	70%	0.703	S	S	*	*			trans	-46.6	110.7	147.8	-81.7	-92	0	0	0	104.3	S153 D157	S153-F155 PolarHBondContact O-N 3.07Å; S153-F155 WeakPolarHBondContact OG-CD2 3.46Å; S153-F155 WeakPolarHBondContact OG-CE2 3.31Å; F155-D157 PolarHBondContact O-N 3.02Å
156	D	38.2	Very low	33.3	Very low	129 Å²	129	132 Å²	132	69%	0.69	69%	0.687	S	S	*	*			trans	-47	119.6	164.8	-75.2	-44.7	0	0	0	105.1	T154 Q158	T154-D156 VanDerWaalsContact C-N 3.28Å; T154-D156 PolarHBondContact O-N 3.04Å; D156-Q158 HydrophobicContact CB-CG 4.26Å; D156-Q158 PolarHBondContact O-N 3.05Å
157	D	36.8	Very low	34.5	Very low	153 Å²	153	133.7 Å²	133.7	82%	0.818	69%	0.685	S	S	*	*			trans	-63.1	68.7	171.1	-65.3	-39.8	0	0	0	107.3	F155 L159	F155-D157 PolarHBondContact O-N 3.02Å; D157-L159 PolarHBondContact O-N 3.19Å
158	Q	38.1	Very low	35.7	Very low	123 Å²	123	127.5 Å²	127.5	58%	0.575	67%	0.669	S	S	*	*			trans	-67.2	96.3	164.5	-72.8	-179.9	18.3	0	0	103.2	D156 I160	D156-Q158 HydrophobicContact CB-CG 4.26Å; D156-Q158 PolarHBondContact O-N 3.05Å; Q158-I160 PolarHBondContact O-N 3.48Å
159	L	37.2	Very low	36.7	Very low	149 Å²	149	127.5 Å²	127.5	78%	0.78	67%	0.669	S	S	*	*			trans	-56.9	86.1	167.5	-68.1	168.4	0	0	0	106.9	D157 L161	D157-L159 PolarHBondContact O-N 3.19Å; L159-L161 PolarHBondContact O-N 3.25Å
160	I	35	Very low	37.4	Very low	146 Å²	146	124.7 Å²	124.7	75%	0.749	66%	0.66	S	S	*	*			trans	-74.3	82.5	166.1	-59.9	172.1	0	0	0	103.9	Q158 S162	Q158-I160 PolarHBondContact O-N 3.48Å; I160-S162 PolarHBondContact O-N 3.05Å
161	L	35.9	Very low	38	Very low	88 Å²	88	130.3 Å²	130.3	46%	0.461	67%	0.667	S	S	.	*			trans	-60.9	109.1	168.7	-64.2	172.1	0	0	0	105.8	L159 E165	L159-L161 PolarHBondContact O-N 3.25Å; L161-E165 HydrophobicContact CB-CB 4.47Å; L161-E165 HydrophobicContact CD2-CB 4.35Å; L161-E165 WeakPolarHBondContact CD2-OE2 3.45Å
162	S	39.3	Very low	38.6	Very low	54 Å²	54	126.8 Å²	126.8	38%	0.378	66%	0.657	S	S	.	*			trans	-60.9	153.1	171.9	65.4	0	0	0	0	108.8	I160 D164 E165 L166	I160-S162 PolarHBondContact O-N 3.05Å; S162-D164 PolarHBondContact O-N 3.05Å; S162-E165 WeakPolarHBondContact O-CA 3.45Å; S162-E165 WeakPolarHBondContact O-CB 3.49Å; S162-E165 PolarHBondContact O-N 3.37Å; S162-L166 PolarHBondContact O-N 3.39Å
163	V	44.6	Very low	39.2	Very low	111 Å²	111	126.9 Å²	126.9	67%	0.673	66%	0.66	S	S	*	*	H	α-helix	trans	-53.6	-29.7	179	176.4	0	0	0	0	111.4	E165 L166 M167	V163-E165 VanDerWaalsContact C-N 3.34Å; V163-E165 PolarHBondContact O-N 2.78Å; V163-L166 PolarHBondContact O-N 2.98Å; V163-M167 WeakPolarHBondContact O-CG 3.43Å; V163-M167 PolarHBondContact O-N 2.85Å
164	D	42.7	Very low	39.7	Very low	120 Å²	120	128.1 Å²	128.1	64%	0.642	67%	0.668	S	S	*	*	H	α-helix	trans	-66.1	-32.2	175.3	-64.5	-21.1	0	0	0	112.9	S162 M167 N168	S162-D164 PolarHBondContact O-N 3.05Å; D164-M167 PolarHBondContact O-N 2.75Å; D164-N168 PolarHBondContact O-N 3.17Å; D164-N168 PolarHBondContact O-ND2 3.05Å
165	E	45.1	Very low	39.7	Very low	93 Å²	93	124.5 Å²	124.5	44%	0.435	65%	0.654	S	S	.	*	H	α-helix	trans	-74.9	-37.4	175.5	-68.8	-175.4	169.4	0	0	111.9	L161 S162 V163 M167 N168 D169	L161-E165 HydrophobicContact CB-CB 4.47Å; L161-E165 HydrophobicContact CD2-CB 4.35Å; L161-E165 WeakPolarHBondContact CD2-OE2 3.45Å; S162-E165 WeakPolarHBondContact O-CA 3.45Å; S162-E165 WeakPolarHBondContact O-CB 3.49Å; S162-E165 PolarHBondContact O-N 3.37Å; V163-E165 VanDerWaalsContact C-N 3.34Å; V163-E165 PolarHBondContact O-N 2.78Å; E165-M167 PolarHBondContact O-N 3.42Å; E165-N168 PolarHBondContact O-N 3.03Å; E165-D169 PolarHBondContact O-N 2.67Å
166	L	44	Very low	39.5	Very low	108 Å²	108	120.9 Å²	120.9	57%	0.565	65%	0.65	S	S	*	*	H	α-helix	trans	-61.9	-26.6	172.3	-89.2	158	0	0	0	112.8	S162 V163	S162-L166 PolarHBondContact O-N 3.39Å; V163-L166 PolarHBondContact O-N 2.98Å
167	M	49.7	Very low	39.2	Very low	139 Å²	139	125.3 Å²	125.3	69%	0.685	66%	0.659	S	S	*	*	H	α-helix	trans	-84.1	-17.6	175.7	-66.8	-69.1	-74.7	0	0	113	V163 D164 E165	V163-M167 WeakPolarHBondContact O-CG 3.43Å; V163-M167 PolarHBondContact O-N 2.85Å; D164-M167 PolarHBondContact O-N 2.75Å; E165-M167 PolarHBondContact O-N 3.42Å
168	N	45.6	Very low	38.9	Very low	93 Å²	93	123.1 Å²	123.1	50%	0.497	65%	0.654	S	S	.	*	H	α-helix	trans	-85	-29.8	-179	-77.6	-26.5	0	0	0	113.4	D164 E165 N170 R171	D164-N168 PolarHBondContact O-N 3.17Å; D164-N168 PolarHBondContact O-ND2 3.05Å; E165-N168 PolarHBondContact O-N 3.03Å; N168-N170 PolarHBondContact O-N 3.31Å; N168-R171 PolarHBondContact O-N 3.45Å; N168-R171 VanDerWaalsContact O-N 3.09Å
169	D	45.5	Very low	38.5	Very low	144 Å²	144	122.3 Å²	122.3	77%	0.77	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-15.6	179.2	-77.1	-12.3	0	0	0	113.1	E165	E165-D169 PolarHBondContact O-N 2.67Å
170	N	39.4	Very low	38.1	Very low	131 Å²	131	121.6 Å²	121.6	70%	0.701	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.5	25.9	171.4	-72.9	-31.2	0	0	0	113.1	N168 I172	N168-N170 PolarHBondContact O-N 3.31Å; N170-I172 PolarHBondContact O-N 3.15Å
171	R	34.9	Very low	37.8	Very low	209 Å²	209	118.9 Å²	118.9	79%	0.789	66%	0.658	S	S	*	*			trans	-66.7	75.4	158.1	-94.9	-172.9	169.9	-160.3	-1.3	108.9	N168 D173	N168-R171 PolarHBondContact O-N 3.45Å; N168-R171 VanDerWaalsContact O-N 3.09Å; R171-D173 PolarHBondContact O-N 2.95Å; R171-D173 VanDerWaalsContact O-N 3.11Å
172	I	40.3	Very low	37.4	Very low	140 Å²	140	126 Å²	126	72%	0.718	68%	0.678	S	S	*	*			trans	-54.7	115.6	148.7	-61.9	172.8	0	0	0	104.1	N170 C174	N170-I172 PolarHBondContact O-N 3.15Å; I172-C174 PolarHBondContact O-N 2.83Å
173	D	37.4	Very low	37.2	Very low	150 Å²	150	132.3 Å²	132.3	80%	0.802	70%	0.699	S	S	*	*			trans	-56.9	90.1	172.8	-172.4	13.7	0	0	0	107.3	R171 G175	R171-D173 PolarHBondContact O-N 2.95Å; R171-D173 VanDerWaalsContact O-N 3.11Å; D173-G175 PolarHBondContact O-N 2.78Å
174	C	37.7	Very low	36.5	Very low	120 Å²	120	134.2 Å²	134.2	81%	0.811	71%	0.706	S	S	*	*			trans	-70.5	68.4	165.7	-66.4	0	0	0	0	106.7	I172 S176	I172-C174 PolarHBondContact O-N 2.83Å; C174-S176 VanDerWaalsContact C-N 3.35Å; C174-S176 PolarHBondContact O-N 3.39Å
175	G	31.5	Very low	35.8	Very low	44 Å²	44	138.2 Å²	138.2	45%	0.454	72%	0.718	S	S	.	*			trans	-56.5	100.4	170.7	0	0	0	0	0	108.6	D173 Y177	D173-G175 PolarHBondContact O-N 2.78Å; G175-Y177 PolarHBondContact O-N 3.16Å
176	S	29.7	Very low	35.2	Very low	94 Å²	94	139 Å²	139	66%	0.657	73%	0.733	S	S	*	*			trans	49.1	60.6	141.9	-170.8	0	0	0	0	117.1	C174 C178	C174-S176 VanDerWaalsContact C-N 3.35Å; C174-S176 PolarHBondContact O-N 3.39Å; S176-C178 VanDerWaalsContact C-N 3.27Å; S176-C178 PolarHBondContact O-N 2.95Å; S176-C178 VanDerWaalsContact O-N 3.11Å
177	Y	33.7	Very low	34.4	Very low	223 Å²	223	144.7 Å²	144.7	88%	0.875	75%	0.749	S	S	*	*			trans	-78.4	90.2	148.5	-71.4	-77.8	0	0	0	108.2	G175 S179	G175-Y177 PolarHBondContact O-N 3.16Å; Y177-S179 PolarHBondContact O-N 3.11Å
178	C	28.9	Very low	33.5	Very low	106 Å²	106	144.7 Å²	144.7	72%	0.716	75%	0.752	S	S	*	*			trans	-67.8	74	168.1	-85.7	0	0	0	0	109.6	S176 T180	S176-C178 VanDerWaalsContact C-N 3.27Å; S176-C178 PolarHBondContact O-N 2.95Å; S176-C178 VanDerWaalsContact O-N 3.11Å; C178-T180 PolarHBondContact O-N 3.2Å
179	S	30.1	Very low	32.7	Very low	106 Å²	106	149.8 Å²	149.8	74%	0.741	77%	0.773	S	S	*	*			trans	-82.1	90	161.2	-66.3	0	0	0	0	107.5	Y177 S181	Y177-S179 PolarHBondContact O-N 3.11Å; S179-S181 PolarHBondContact O-N 2.95Å
180	T	28.5	Very low	32.1	Very low	135 Å²	135	151.3 Å²	151.3	83%	0.828	77%	0.772	S	S	*	*			trans	-65.2	78.3	169.9	43.1	0	0	0	0	110	C178 R182	C178-T180 PolarHBondContact O-N 3.2Å; T180-R182 PolarHBondContact O-N 3.01Å
181	S	30.3	Very low	31.8	Very low	88 Å²	88	150.5 Å²	150.5	62%	0.615	78%	0.777	S	S	*	*			trans	-84.4	83.5	166.3	152.5	0	0	0	0	107.8	S179 F183	S179-S181 PolarHBondContact O-N 2.95Å; S181-F183 PolarHBondContact O-N 3.07Å; S181-F183 WeakPolarHBondContact OG-CD2 3.42Å
182	R	27.1	Very low	31.6	Very low	237 Å²	237	149.4 Å²	149.4	89%	0.894	79%	0.786	S	S	*	*			trans	-70.8	87.4	158.9	-80.2	-176.8	179.9	157.9	0.2	107.2	T180	T180-R182 PolarHBondContact O-N 3.01Å
183	F	34.6	Very low	31.1	Very low	187 Å²	187	150.5 Å²	150.5	82%	0.82	79%	0.79	S	S	*	*			trans	-115.8	101.8	164	-81.2	-75.6	0	0	0	108.9	S181	S181-F183 PolarHBondContact O-N 3.07Å; S181-F183 WeakPolarHBondContact OG-CD2 3.42Å
184	D	29.9	Very low	30.9	Very low	152 Å²	152	151.8 Å²	151.8	81%	0.813	79%	0.791	S	S	*	*			trans	-52.4	140.8	167.4	-82.6	-49.6	0	0	0	110.5	S186	D184-S186 PolarHBondContact O-N 3.49Å
185	K	28.2	Very low	30.9	Very low	203 Å²	203	153.7 Å²	153.7	88%	0.883	79%	0.792	S	S	*	*			trans	-48.1	103.6	174.7	-64.6	172.7	179.4	178.9	0	110.7
186	S	31.5	Very low	30.9	Very low	110 Å²	110	159.6 Å²	159.6	77%	0.769	81%	0.808	S	S	*	*			trans	-137.1	102.2	157	56.5	0	0	0	0	108.8	D184 N188	D184-S186 PolarHBondContact O-N 3.49Å; S186-N188 PolarHBondContact O-N 3.09Å
187	Y	27.6	Very low	31	Very low	228 Å²	228	163 Å²	163	89%	0.894	81%	0.813	S	S	*	*			trans	-56.3	115	167.7	-82.4	-101.9	0	0	0	108.7
188	N	31.9	Very low	30.9	Very low	138 Å²	138	157.6 Å²	157.6	74%	0.738	80%	0.803	S	S	*	*			trans	-153.1	107.4	148	-119	-26.1	0	0	0	109.6	S186 K190	S186-N188 PolarHBondContact O-N 3.09Å; N188-K190 PolarHBondContact O-N 2.89Å
189	E	27.6	Very low	31	Very low	201 Å²	201	158.8 Å²	158.8	94%	0.939	80%	0.801	S	S	*	*			trans	-64.4	86.8	174.8	-167.8	173.9	-151.3	0	0	108.8
190	K	34.2	Very low	31	Very low	175 Å²	175	161.9 Å²	161.9	76%	0.761	80%	0.803	S	S	*	*			trans	-142.3	118.1	171.6	-68.6	-168.7	179.7	-174.7	0	110.6	N188	N188-K190 PolarHBondContact O-N 2.89Å
191	S	31.8	Very low	30.9	Very low	115 Å²	115	160.2 Å²	160.2	80%	0.804	80%	0.796	S	S	*	*			trans	50.8	106.6	167.5	-75.9	0	0	0	0	117.2	M193	S191-M193 PolarHBondContact O-N 2.74Å
192	L	30.2	Very low	30.8	Very low	185 Å²	185	164.9 Å²	164.9	97%	0.969	81%	0.808	S	S	*	*			trans	-58.9	85.3	150.2	-78	160.3	0	0	0	108
193	M	30.9	Very low	30.8	Very low	164 Å²	164	160.9 Å²	160.9	81%	0.808	81%	0.805	S	S	*	*			trans	-74.7	120.6	164.4	-168.8	158.8	37.7	0	0	105.7	S191 I195	S191-M193 PolarHBondContact O-N 2.74Å; M193-I195 PolarHBondContact O-N 2.91Å; M193-I195 VanDerWaalsContact O-N 3.13Å
194	E	33.4	Very low	30.4	Very low	177 Å²	177	156.5 Å²	156.5	83%	0.827	80%	0.797	S	S	*	*			trans	-43.3	118.5	178.7	-76.4	167.8	143.2	0	0	109.8	E196	E194-E196 PolarHBondContact O-N 2.92Å
195	I	37.4	Very low	30.2	Very low	160 Å²	160	157.7 Å²	157.7	82%	0.821	80%	0.798	S	S	*	*			trans	-73.7	90.6	169	-59.9	170.5	0	0	0	104.6	M193 E197	M193-I195 PolarHBondContact O-N 2.91Å; M193-I195 VanDerWaalsContact O-N 3.13Å; I195-E197 PolarHBondContact O-N 2.62Å
196	E	31.4	Very low	30	Very low	168 Å²	168	154 Å²	154	79%	0.785	80%	0.797	S	S	*	*			trans	-62.7	95.6	158.3	-79	-174.1	154.4	0	0	106.6	E194 V198	E194-E196 PolarHBondContact O-N 2.92Å; E196-V198 VanDerWaalsContact C-N 3.25Å; E196-V198 PolarHBondContact O-N 3.48Å
197	E	32.3	Very low	29.7	Very low	165 Å²	165	160.1 Å²	160.1	77%	0.771	80%	0.804	S	S	*	*			trans	-67.2	90	170.6	-171.1	175.1	-175.5	0	0	107.8	I195 I199	I195-E197 PolarHBondContact O-N 2.62Å; E197-I199 VanDerWaalsContact C-N 3.34Å; E197-I199 HydrophobicContact CG-CG1 4.35Å; E197-I199 PolarHBondContact O-N 3.29Å
198	V	32.2	Very low	29.5	Very low	109 Å²	109	155.7 Å²	155.7	66%	0.661	80%	0.8	S	S	*	*			trans	-68.8	96.1	170.1	-178	0	0	0	0	107.1	E196 E200	E196-V198 VanDerWaalsContact C-N 3.25Å; E196-V198 PolarHBondContact O-N 3.48Å; V198-E200 VanDerWaalsContact C-N 3.29Å; V198-E200 HydrophobicContact CG1-CG 4.05Å; V198-E200 PolarHBondContact O-N 3.49Å
199	I	29.8	Very low	29.3	Very low	132 Å²	132	156 Å²	156	68%	0.677	80%	0.801	S	S	*	*			trans	-70.5	90.2	169.9	-52.7	172.3	0	0	0	106.7	E197 C201	E197-I199 VanDerWaalsContact C-N 3.34Å; E197-I199 HydrophobicContact CG-CG1 4.35Å; E197-I199 PolarHBondContact O-N 3.29Å; I199-C201 VanDerWaalsContact C-N 3.34Å; I199-C201 PolarHBondContact O-N 2.98Å
200	E	30.7	Very low	29.1	Very low	170 Å²	170	152.8 Å²	152.8	79%	0.794	80%	0.796	S	S	*	*			trans	-68.4	95.2	168.3	-73.8	-169.8	167.4	0	0	108.5	V198 E202	V198-E200 VanDerWaalsContact C-N 3.29Å; V198-E200 HydrophobicContact CG1-CG 4.05Å; V198-E200 PolarHBondContact O-N 3.49Å; E200-E202 PolarHBondContact O-N 2.86Å; E200-E202 VanDerWaalsContact O-N 3.11Å
201	C	25.5	Very low	28.8	Very low	101 Å²	101	151.6 Å²	151.6	68%	0.682	79%	0.793	S	S	*	*			trans	-58.5	113.9	167	-68.8	0	0	0	0	108.4	I199 N203	I199-C201 VanDerWaalsContact C-N 3.34Å; I199-C201 PolarHBondContact O-N 2.98Å; C201-N203 VanDerWaalsContact C-N 3.25Å; C201-N203 PolarHBondContact O-N 3.35Å
202	E	28.2	Very low	28.5	Very low	185 Å²	185	155.2 Å²	155.2	86%	0.864	80%	0.797	S	S	*	*			trans	-57.2	88.8	171.1	-69.6	-174.1	166.2	0	0	109.6	E200 S204	E200-E202 PolarHBondContact O-N 2.86Å; E200-E202 VanDerWaalsContact O-N 3.11Å; E202-S204 PolarHBondContact O-N 3.1Å
203	N	27.8	Very low	28.5	Very low	154 Å²	154	153.3 Å²	153.3	82%	0.824	79%	0.786	S	S	*	*			trans	-68.1	91.9	162.4	-86	-25.8	0	0	0	106.4	C201 H205	C201-N203 VanDerWaalsContact C-N 3.25Å; C201-N203 PolarHBondContact O-N 3.35Å; N203-H205 PolarHBondContact O-N 2.88Å
204	S	25.4	Very low	28.3	Very low	94 Å²	94	149.2 Å²	149.2	66%	0.657	77%	0.774	S	S	*	*			trans	-39.5	135.9	159.5	-53.7	0	0	0	0	108.1	E202	E202-S204 PolarHBondContact O-N 3.1Å
205	H	25.9	Very low	27.9	Very low	178 Å²	178	148.3 Å²	148.3	82%	0.824	78%	0.775	S	S	*	*			trans	93	80.8	177.1	-49.6	73.2	0	0	0	115.2	N203	N203-H205 PolarHBondContact O-N 2.88Å
206	S	25.1	Very low	27.6	Very low	125 Å²	125	148.6 Å²	148.6	87%	0.874	77%	0.77	S	S	*	*			trans	-157.8	131.6	141.5	-82.1	0	0	0	0	110.2
207	R	25.2	Very low	27.5	Very low	239 Å²	239	148.2 Å²	148.2	90%	0.902	77%	0.773	S	S	*	*			trans	-60.7	143	-172.3	-74.5	161.7	163.1	167.9	-6.6	112.2	L209	R207-L209 PolarHBondContact O-N 3.16Å
208	T	23	Very low	27.3	Very low	135 Å²	135	147.2 Å²	147.2	83%	0.828	77%	0.773	S	S	*	*			trans	-36.1	103.7	155.2	46.3	0	0	0	0	112
209	L	27.2	Very low	27.2	Very low	144 Å²	144	147.7 Å²	147.7	75%	0.754	78%	0.778	S	S	*	*			trans	-119.6	96.9	154.8	-145.7	92.9	0	0	0	106.7	R207 E211	R207-L209 PolarHBondContact O-N 3.16Å; L209-E211 HydrophobicContact CD2-CG 4.44Å; L209-E211 PolarHBondContact O-N 3.34Å
210	T	23.9	Very low	27.1	Very low	134 Å²	134	149.8 Å²	149.8	82%	0.822	79%	0.789	S	S	*	*			trans	-62.6	94.3	169.2	0.5	0	0	0	0	108.1
211	E	27.3	Very low	27	Very low	149 Å²	149	150 Å²	150	70%	0.696	79%	0.79	S	S	*	*			trans	-105.1	99.5	161.9	-91.7	-173.7	158.9	0	0	108.8	L209 I213	L209-E211 HydrophobicContact CD2-CG 4.44Å; L209-E211 PolarHBondContact O-N 3.34Å; E211-I213 VanDerWaalsContact C-N 3.31Å; E211-I213 HydrophobicContact CB-CG1 4.5Å; E211-I213 PolarHBondContact O-N 3.23Å
212	E	26.1	Very low	27.1	Very low	191 Å²	191	154.7 Å²	154.7	89%	0.893	80%	0.799	S	S	*	*			trans	-61.9	87.3	165.6	-65.7	-179	150.6	0	0	109.4	S214	E212-S214 PolarHBondContact O-N 2.99Å
213	I	29.8	Very low	27.1	Very low	146 Å²	146	152.8 Å²	152.8	75%	0.749	79%	0.793	S	S	*	*			trans	-87.8	98.5	168.4	-56.2	-179.1	0	0	0	107.6	E211	E211-I213 VanDerWaalsContact C-N 3.31Å; E211-I213 HydrophobicContact CB-CG1 4.5Å; E211-I213 PolarHBondContact O-N 3.23Å
214	S	26.7	Very low	27.1	Very low	78 Å²	78	150.6 Å²	150.6	55%	0.545	79%	0.79	S	S	.	*			trans	-49.7	133.8	179.1	67.5	0	0	0	0	112.7	E212 K216	E212-S214 PolarHBondContact O-N 2.99Å; S214-K216 PolarHBondContact O-N 2.77Å
215	N	25.7	Very low	27.1	Very low	158 Å²	158	151.3 Å²	151.3	85%	0.845	79%	0.794	S	S	*	*			trans	-52.4	90	166.4	-68.9	-33.8	0	0	0	111.7
216	K	31.3	Very low	27.2	Very low	165 Å²	165	150.8 Å²	150.8	72%	0.717	79%	0.792	S	S	*	*			trans	-97.8	96.6	163.3	-73.4	-172.2	-179.9	177.9	0	107.7	S214 L218	S214-K216 PolarHBondContact O-N 2.77Å; K216-L218 HydrophobicContact CB-CD1 4.26Å; K216-L218 PolarHBondContact O-N 3.02Å
217	N	27.9	Very low	27.5	Very low	160 Å²	160	152.9 Å²	152.9	86%	0.856	79%	0.79	S	S	*	*			trans	-52	97.1	163.5	-68.5	-36.1	0	0	0	108.7
218	L	29	Very low	27.9	Very low	145 Å²	145	147.7 Å²	147.7	76%	0.759	78%	0.78	S	S	*	*			trans	-86.8	135.4	164.8	-99.5	82.1	0	0	0	108.9	K216	K216-L218 HydrophobicContact CB-CD1 4.26Å; K216-L218 PolarHBondContact O-N 3.02Å
219	P	30	Very low	28.4	Very low	119 Å²	119	148 Å²	148	77%	0.773	78%	0.777	S	S	*	*			trans	-67.6	134.7	-174.9	26.4	-31.7	0	0	0	111.1	E221	P219-E221 VanDerWaalsContact C-N 3.31Å; P219-E221 PolarHBondContact O-N 2.93Å
220	L	26.8	Very low	29	Very low	175 Å²	175	148.6 Å²	148.6	92%	0.916	78%	0.776	S	S	*	*			trans	-60.9	87.8	172.3	-67.5	161.7	0	0	0	109.8	K222	L220-K222 PolarHBondContact O-N 2.82Å
221	E	28.4	Very low	29.5	Very low	175 Å²	175	149.3 Å²	149.3	82%	0.818	77%	0.774	S	S	*	*			trans	-73.2	109.8	168.4	-156.1	165.6	-153.4	0	0	107.4	P219 I223	P219-E221 VanDerWaalsContact C-N 3.31Å; P219-E221 PolarHBondContact O-N 2.93Å; E221-I223 VanDerWaalsContact C-N 3.3Å; E221-I223 PolarHBondContact O-N 2.73Å
222	K	29.3	Very low	29.9	Very low	200 Å²	200	149 Å²	149	87%	0.87	78%	0.778	S	S	*	*			trans	-64.5	89.5	176.6	-74.3	178.5	176.5	-179.6	0	108.7	L220 S224	L220-K222 PolarHBondContact O-N 2.82Å; K222-S224 PolarHBondContact O-N 3.11Å
223	I	28	Very low	30.7	Very low	144 Å²	144	145.9 Å²	145.9	74%	0.738	77%	0.771	S	S	*	*			trans	-73.5	102.7	167.3	-40.4	176.6	0	0	0	106	E221 C225	E221-I223 VanDerWaalsContact C-N 3.3Å; E221-I223 PolarHBondContact O-N 2.73Å; I223-C225 VanDerWaalsContact C-N 3.3Å; I223-C225 PolarHBondContact O-N 3.03Å
224	S	26.5	Very low	31.5	Very low	109 Å²	109	143.6 Å²	143.6	76%	0.762	77%	0.768	S	S	*	*			trans	-67	90.3	169.6	171.7	0	0	0	0	107.8	K222 Q226	K222-S224 PolarHBondContact O-N 3.11Å; S224-Q226 PolarHBondContact O-N 3.03Å
225	C	26.9	Very low	32.6	Very low	108 Å²	108	148.3 Å²	148.3	73%	0.73	78%	0.782	S	S	*	*			trans	-68.3	102.3	171.8	-63.3	0	0	0	0	108.3	I223 M227	I223-C225 VanDerWaalsContact C-N 3.3Å; I223-C225 PolarHBondContact O-N 3.03Å; C225-M227 PolarHBondContact O-N 2.99Å
226	Q	27.7	Very low	33.7	Very low	167 Å²	167	147.6 Å²	147.6	78%	0.78	78%	0.777	S	S	*	*			trans	-54.8	123.8	163.8	-122.5	171.7	-36.9	0	0	107.5	S224 D228	S224-Q226 PolarHBondContact O-N 3.03Å; Q226-D228 VanDerWaalsContact C-N 3.29Å; Q226-D228 PolarHBondContact O-N 2.68Å
227	M	30.4	Very low	34.6	Very low	169 Å²	169	147 Å²	147	83%	0.833	78%	0.781	S	S	*	*			trans	-70.3	89.4	173	-82.9	-149.6	153.4	0	0	108.9	C225 N229	C225-M227 PolarHBondContact O-N 2.99Å; M227-N229 VanDerWaalsContact C-N 3.35Å; M227-N229 PolarHBondContact O-N 2.69Å
228	D	34.8	Very low	35.8	Very low	131 Å²	131	147.3 Å²	147.3	70%	0.701	78%	0.778	S	S	*	*			trans	-76.2	98.6	158.1	-66.3	-32	0	0	0	106.2	Q226 E230	Q226-D228 VanDerWaalsContact C-N 3.29Å; Q226-D228 PolarHBondContact O-N 2.68Å; D228-E230 PolarHBondContact O-N 2.69Å
229	N	32.7	Very low	37	Very low	141 Å²	141	150.6 Å²	150.6	75%	0.754	78%	0.782	S	S	*	*			trans	-63.4	72.2	167.8	-85	-20.4	0	0	0	108.7	M227	M227-N229 VanDerWaalsContact C-N 3.35Å; M227-N229 PolarHBondContact O-N 2.69Å
230	E	39.8	Very low	38.2	Very low	157 Å²	157	149.4 Å²	149.4	73%	0.734	78%	0.776	S	S	*	*			trans	-85.1	113.9	160.6	-66.7	-159.2	167.3	0	0	107.1	D228 N232	D228-E230 PolarHBondContact O-N 2.69Å; E230-N232 PolarHBondContact O-N 3.17Å
231	N	35.2	Very low	39.8	Very low	148 Å²	148	146.9 Å²	146.9	79%	0.791	76%	0.763	S	S	*	*			trans	-54.6	80.5	172.7	-69.5	-42.8	0	0	0	109.8	T233	N231-T233 PolarHBondContact O-N 2.97Å
232	N	35.6	Very low	41.7	Very low	144 Å²	144	145 Å²	145	77%	0.77	76%	0.759	S	S	*	*			trans	-78.4	80.2	159.1	-74.3	-18	0	0	0	105.7	E230 S234	E230-N232 PolarHBondContact O-N 3.17Å; N232-S234 PolarHBondContact O-N 3.08Å
233	T	41.7	Very low	42.5	Very low	124 Å²	124	143.9 Å²	143.9	76%	0.761	75%	0.754	S	S	*	*			trans	-57.2	91.1	150.8	44.6	0	0	0	0	105.3	N231 E235	N231-T233 PolarHBondContact O-N 2.97Å; T233-E235 VanDerWaalsContact C-N 3.35Å; T233-E235 PolarHBondContact O-N 3.36Å
234	S	46.6	Very low	43.5	Very low	98 Å²	98	145.5 Å²	145.5	69%	0.685	76%	0.759	S	S	*	*			trans	-56.8	108.7	164.6	37.9	0	0	0	0	105.4	N232 I236	N232-S234 PolarHBondContact O-N 3.08Å; S234-I236 PolarHBondContact O-N 3.11Å
235	E	50.4	Low	44.3	Very low	178 Å²	178	146 Å²	146	83%	0.832	75%	0.753	S	S	*	*			trans	-52.1	102.2	161.8	-82.8	173.3	151.5	0	0	105.4	T233 D237	T233-E235 VanDerWaalsContact C-N 3.35Å; T233-E235 PolarHBondContact O-N 3.36Å; E235-D237 VanDerWaalsContact C-N 3.27Å; E235-D237 PolarHBondContact O-N 2.93Å
236	I	48.8	Very low	45	Very low	142 Å²	142	149.9 Å²	149.9	73%	0.728	76%	0.76	S	S	*	*			trans	-63.8	103.3	162.4	-70.4	153.6	0	0	0	102.6	S234 E238	S234-I236 PolarHBondContact O-N 3.11Å; I236-E238 PolarHBondContact O-N 2.95Å
237	D	49.8	Very low	45.7	Very low	152 Å²	152	149.2 Å²	149.2	81%	0.813	76%	0.757	S	S	*	*			trans	-55.9	93.3	169.2	-87.5	-30.3	0	0	0	106.7	E235 Y239	E235-D237 VanDerWaalsContact C-N 3.27Å; E235-D237 PolarHBondContact O-N 2.93Å; D237-Y239 PolarHBondContact O-N 3.06Å
238	E	54.3	Low	46	Very low	167 Å²	167	147.5 Å²	147.5	78%	0.78	75%	0.752	S	S	*	*			trans	-60.1	113.9	172	-79.8	-176.5	168	0	0	106.9	I236 S240	I236-E238 PolarHBondContact O-N 2.95Å; E238-S240 PolarHBondContact O-N 2.71Å; E238-S240 PolarHBondContact O-OG 2.97Å
239	Y	54.4	Low	46.1	Very low	215 Å²	215	149.6 Å²	149.6	84%	0.843	76%	0.762	S	S	*	*			trans	-50.4	103.8	174.3	-172.2	-98	0	0	0	108.8	D237 D241	D237-Y239 PolarHBondContact O-N 3.06Å; Y239-D241 PolarHBondContact O-N 3.46Å
240	S	55.1	Low	46.2	Very low	93 Å²	93	150.1 Å²	150.1	65%	0.65	76%	0.763	S	S	*	*			trans	-77	119.8	179.6	-60.8	0	0	0	0	107.3	E238 D242	E238-S240 PolarHBondContact O-N 2.71Å; E238-S240 PolarHBondContact O-OG 2.97Å; S240-D242 PolarHBondContact O-N 2.89Å; S240-D242 VanDerWaalsContact O-N 3.12Å
241	D	59.6	Low	45.7	Very low	122 Å²	122	147.9 Å²	147.9	65%	0.652	77%	0.765	S	S	*	*			trans	-66.5	107.3	177.7	-167.1	7.6	0	0	0	108.9	Y239 F243	Y239-D241 PolarHBondContact O-N 3.46Å; D241-F243 PolarHBondContact O-N 3.26Å
242	D	68.4	Low	45.4	Very low	136 Å²	136	146.1 Å²	146.1	73%	0.727	76%	0.764	S	S	*	*			trans	-66.4	16	-176.6	-62.6	-29.4	0	0	0	114.1	S240 E244	S240-D242 PolarHBondContact O-N 2.89Å; S240-D242 VanDerWaalsContact O-N 3.12Å; D242-E244 PolarHBondContact O-N 3.3Å
243	F	46.2	Very low	44.9	Very low	177 Å²	177	145.2 Å²	145.2	78%	0.776	76%	0.764	S	S	*	*			trans	-72.2	80.9	168.1	-91.5	-88.7	0	0	0	109.2	D241 N245	D241-F243 PolarHBondContact O-N 3.26Å; F243-N245 VanDerWaalsContact C-N 3.27Å; F243-N245 PolarHBondContact O-N 2.91Å
244	E	49.5	Very low	44.4	Very low	177 Å²	177	148.3 Å²	148.3	83%	0.827	77%	0.767	S	S	*	*			trans	-46.7	97.9	156.9	-77.5	-82.8	157.8	0	0	107.4	D242 E246	D242-E244 PolarHBondContact O-N 3.3Å; E244-E246 PolarHBondContact O-N 3.45Å
245	N	42.3	Very low	43.6	Very low	121 Å²	121	151.9 Å²	151.9	65%	0.647	77%	0.772	S	S	*	*			trans	-62.4	104.6	173.1	-161.5	10.7	0	0	0	104.9	F243 Q247	F243-N245 VanDerWaalsContact C-N 3.27Å; F243-N245 PolarHBondContact O-N 2.91Å; N245-Q247 PolarHBondContact ND2-NE2 2.91Å; N245-Q247 PolarHBondContact O-N 3.49Å
246	E	42.7	Very low	42.5	Very low	189 Å²	189	151 Å²	151	88%	0.883	77%	0.773	S	S	*	*			trans	-62.2	71	171.6	-72.4	-170.6	173.1	0	0	108.5	E244 D248	E244-E246 PolarHBondContact O-N 3.45Å; E246-D248 VanDerWaalsContact C-N 3.35Å; E246-D248 PolarHBondContact O-N 3.45Å; E246-D248 VanDerWaalsContact O-N 3.08Å
247	Q	40.8	Very low	41.6	Very low	152 Å²	152	151.6 Å²	151.6	71%	0.71	78%	0.777	S	S	*	*			trans	-84.8	92.3	179.2	-155	160.1	88.4	0	0	105.7	N245 L249	N245-Q247 PolarHBondContact ND2-NE2 2.91Å; N245-Q247 PolarHBondContact O-N 3.49Å; Q247-L249 PolarHBondContact O-N 3.36Å
248	D	37.8	Very low	40.6	Very low	134 Å²	134	152.2 Å²	152.2	72%	0.717	77%	0.773	S	S	*	*			trans	20.4	96.6	154.6	-66.6	-41.9	0	0	0	114.1	E246 I250	E246-D248 VanDerWaalsContact C-N 3.35Å; E246-D248 PolarHBondContact O-N 3.45Å; E246-D248 VanDerWaalsContact O-N 3.08Å; D248-I250 HydrophobicContact CB-CG1 4.33Å; D248-I250 PolarHBondContact O-N 2.85Å
249	L	36.3	Very low	39.2	Very low	175 Å²	175	150.2 Å²	150.2	92%	0.916	78%	0.776	S	S	*	*			trans	-59.7	75.3	164.8	-80.8	149.2	0	0	0	110	Q247 S251	Q247-L249 PolarHBondContact O-N 3.36Å; L249-S251 PolarHBondContact O-N 3.2Å; L249-S251 VanDerWaalsContact O-N 3.17Å
250	I	34.4	Very low	37.9	Very low	152 Å²	152	145.9 Å²	145.9	78%	0.779	77%	0.767	S	S	*	*			trans	-72	109.7	164.6	-52.4	171.6	0	0	0	105.6	D248 S252	D248-I250 HydrophobicContact CB-CG1 4.33Å; D248-I250 PolarHBondContact O-N 2.85Å; I250-S252 PolarHBondContact O-N 2.67Å
251	S	28.9	Very low	36.3	Very low	110 Å²	110	148.8 Å²	148.8	77%	0.769	78%	0.775	S	S	*	*			trans	-59.3	101.2	-173.7	-38.1	0	0	0	0	111.2	L249	L249-S251 PolarHBondContact O-N 3.2Å; L249-S251 VanDerWaalsContact O-N 3.17Å
252	S	29.5	Very low	34.8	Very low	111 Å²	111	150.3 Å²	150.3	78%	0.776	78%	0.781	S	S	*	*			trans	-97.8	108.1	166.7	-179.3	0	0	0	0	109.4	I250	I250-S252 PolarHBondContact O-N 2.67Å
253	T	25.4	Very low	32.8	Very low	125 Å²	125	148.7 Å²	148.7	77%	0.767	78%	0.777	S	S	*	*			trans	-87.5	104.6	177.2	-46.8	0	0	0	0	108.5
254	K	30.3	Very low	31.7	Very low	189 Å²	189	146.1 Å²	146.1	82%	0.822	78%	0.776	S	S	*	*			trans	157	114.2	167.3	-95.8	160.3	-175.6	-175.8	0	105.9
255	E	31.3	Very low	30.6	Very low	172 Å²	172	146 Å²	146	80%	0.804	78%	0.775	S	S	*	*				-161.1	144.1	56	-90.8	163	177.4	0	0	110.5	L257	E255-L257 PolarHBondContact O-N 3.37Å; E255-L257 VanDerWaalsContact O-N 3.11Å
256	N	25.8	Very low	29.7	Very low	159 Å²	159	151.3 Å²	151.3	85%	0.85	79%	0.786	S	S	*	*			trans	-63.5	100.4	168.9	-104.2	-69.5	0	0	0	110.2
257	L	30.7	Very low	28.7	Very low	156 Å²	156	147.6 Å²	147.6	82%	0.817	78%	0.781	S	S	*	*			trans	-105.5	87.2	156.3	-69.5	179.7	0	0	0	108.9	E255 C259	E255-L257 PolarHBondContact O-N 3.37Å; E255-L257 VanDerWaalsContact O-N 3.11Å; L257-C259 VanDerWaalsContact C-N 3.31Å; L257-C259 PolarHBondContact O-N 2.64Å
258	K	28	Very low	28.1	Very low	164 Å²	164	147.7 Å²	147.7	71%	0.713	79%	0.786	S	S	*	*			trans	-61.8	87.6	167.8	-177	179	-179.7	180	0	108.9	N260	K258-N260 WeakPolarHBondContact CE-OD1 3.44Å; K258-N260 PolarHBondContact O-N 2.84Å
259	C	24.9	Very low	27.4	Very low	125 Å²	125	146.1 Å²	146.1	85%	0.845	79%	0.785	S	S	*	*			trans	-69.7	102.3	167	-72	0	0	0	0	108.3	L257	L257-C259 VanDerWaalsContact C-N 3.31Å; L257-C259 PolarHBondContact O-N 2.64Å
260	N	28.2	Very low	27	Very low	124 Å²	124	143.5 Å²	143.5	66%	0.663	78%	0.778	S	S	*	*			trans	-69.7	129.9	175.9	-71.1	-44.9	0	0	0	110.4	K258 I262	K258-N260 WeakPolarHBondContact CE-OD1 3.44Å; K258-N260 PolarHBondContact O-N 2.84Å; N260-I262 PolarHBondContact O-N 2.71Å
261	L	22	Very low	26.6	Very low	154 Å²	154	145.7 Å²	145.7	81%	0.806	78%	0.782	S	S	*	*			trans	-40.1	120.8	164.2	-162.6	78.8	0	0	0	113.3
262	I	27.5	Very low	26.6	Very low	154 Å²	154	147 Å²	147	79%	0.79	79%	0.786	S	S	*	*			trans	-128.7	82.4	154.5	-53.8	177.5	0	0	0	107.1	N260	N260-I262 PolarHBondContact O-N 2.71Å
263	T	25.4	Very low	26.4	Very low	103 Å²	103	151.1 Å²	151.1	63%	0.632	79%	0.79	S	S	*	*			trans	-99.1	98.3	166	-53.7	0	0	0	0	107.4	Q265	T263-Q265 PolarHBondContact O-N 2.93Å
264	T	24.9	Very low	26.4	Very low	123 Å²	123	154.9 Å²	154.9	76%	0.755	80%	0.795	S	S	*	*			trans	-66.6	96.3	174.4	-56.3	0	0	0	0	109.4	R266	T264-R266 PolarHBondContact O-N 3.03Å
265	Q	26.4	Very low	26.3	Very low	174 Å²	174	150.8 Å²	150.8	81%	0.813	80%	0.797	S	S	*	*			trans	-74.9	108.5	169.1	-70.3	-167.4	-4.6	0	0	109.4	T263 S267	T263-Q265 PolarHBondContact O-N 2.93Å; Q265-S267 PolarHBondContact O-N 3.43Å
266	R	22	Very low	26	Very low	232 Å²	232	149.6 Å²	149.6	88%	0.875	80%	0.796	S	S	*	*			trans	-80.5	92.7	171.5	-157.6	175.7	-161.1	165.5	4.1	108.4	T264 L268	T264-R266 PolarHBondContact O-N 3.03Å; R266-L268 PolarHBondContact O-N 3.24Å
267	S	23.2	Very low	25.9	Very low	112 Å²	112	152.4 Å²	152.4	78%	0.783	80%	0.795	S	S	*	*			trans	-72.7	116.3	172.5	57.4	0	0	0	0	110.6	Q265	Q265-S267 PolarHBondContact O-N 3.43Å
268	L	26.9	Very low	25.7	Very low	154 Å²	154	152.2 Å²	152.2	81%	0.806	79%	0.794	S	S	*	*			trans	-119.3	114.2	157.9	-87	159.3	0	0	0	108.1	R266	R266-L268 PolarHBondContact O-N 3.24Å
269	S	22.7	Very low	25.6	Very low	101 Å²	101	151.6 Å²	151.6	71%	0.706	80%	0.796	S	S	*	*			trans	-65.1	132.6	-171.6	54.9	0	0	0	0	114
270	P	29.4	Very low	26	Very low	119 Å²	119	152 Å²	152	77%	0.773	79%	0.79	S	S	*	*			trans	-93.5	110	156.4	0.4	19.7	0	0	0	109.1	T272	P270-T272 PolarHBondContact O-N 2.74Å
271	K	25.2	Very low	25.9	Very low	199 Å²	199	153.8 Å²	153.8	87%	0.865	80%	0.795	S	S	*	*			trans	-80.3	100.5	164.8	-77.5	-175.2	176.5	175.5	0	108.8
272	T	29.1	Very low	26.2	Very low	137 Å²	137	156.4 Å²	156.4	84%	0.84	80%	0.799	S	S	*	*			trans	-133.9	138.3	158	45	0	0	0	0	111	P270	P270-T272 PolarHBondContact O-N 2.74Å
273	K	25.7	Very low	26.1	Very low	198 Å²	198	153.6 Å²	153.6	86%	0.861	79%	0.789	S	S	*	*			trans	-82.2	144.9	-161.8	-67.8	167.8	174.3	173	0	111.3
274	K	24.5	Very low	26	Very low	203 Å²	203	158.5 Å²	158.5	88%	0.883	80%	0.798	S	S	*	*			trans	35.1	113	135	-60.6	-174.8	175.8	-172.6	0	117.6
275	A	28.4	Very low	26.2	Very low	103 Å²	103	159.5 Å²	159.5	85%	0.851	80%	0.799	S	S	*	*				-162.2	111.7	128.4	0	0	0	0	0	108.8
276	D	25.4	Very low	26.1	Very low	147 Å²	147	160.6 Å²	160.6	79%	0.786	80%	0.804	S	S	*	*			trans	-62.5	147.4	172.7	-75.4	-62.7	0	0	0	112.3
277	R	22.6	Very low	26.4	Very low	219 Å²	219	155.9 Å²	155.9	83%	0.826	80%	0.8	S	S	*	*			trans	44.5	115	141	-70	176.1	166.7	-179.7	-3.8	117.9
278	L	28.3	Very low	26.8	Very low	152 Å²	152	156 Å²	156	80%	0.796	80%	0.799	S	S	*	*			trans	-154.4	94.4	130.5	-103.2	152.3	0	0	0	109	N280	L278-N280 PolarHBondContact O-N 3.25Å
279	I	25.9	Very low	26.7	Very low	150 Å²	150	157.2 Å²	157.2	77%	0.769	80%	0.802	S	S	*	*			trans	-69.6	103.3	165.8	-65.1	166.2	0	0	0	106
280	N	31.8	Very low	27.1	Very low	133 Å²	133	159.9 Å²	159.9	71%	0.711	81%	0.808	S	S	*	*			trans	-109.5	86.7	166.3	-80.7	-32.8	0	0	0	108.5	L278 K282	L278-N280 PolarHBondContact O-N 3.25Å; N280-K282 PolarHBondContact O-N 2.96Å
281	Q	25.8	Very low	26.9	Very low	163 Å²	163	159.1 Å²	159.1	76%	0.762	81%	0.806	S	S	*	*			trans	-64.8	105	165.3	-178.9	178	25.8	0	0	108.5	V283	Q281-V283 HydrophobicContact CG-CG2 4Å
282	K	30.1	Very low	27.2	Very low	208 Å²	208	159.3 Å²	159.3	90%	0.904	81%	0.807	S	S	*	*			trans	-100.9	99.5	164	-85.4	-174.9	175.4	-179	0	108.6	N280	N280-K282 PolarHBondContact O-N 2.96Å
283	V	23.9	Very low	27	Very low	95 Å²	95	156 Å²	156	58%	0.576	80%	0.801	S	S	*	*			trans	-79.4	162.6	161	172.4	0	0	0	0	108	Q281	Q281-V283 HydrophobicContact CG-CG2 4Å
284	Y	23.7	Very low	27.5	Very low	207 Å²	207	152.4 Å²	152.4	81%	0.812	80%	0.798	S	S	*	*			trans	93.1	120.2	-178.9	-57.8	-73.6	0	0	0	113.2
285	N	29.9	Very low	27.8	Very low	144 Å²	144	150.6 Å²	150.6	77%	0.77	80%	0.797	S	S	*	*			cis	-147.5	142.2	32.2	-74.3	-53.6	0	0	0	112.4
286	E	23.9	Very low	27.9	Very low	197 Å²	197	153.1 Å²	153.1	92%	0.921	80%	0.796	S	S	*	*			trans	-65.5	134	160.6	-76.4	173.6	143.3	0	0	110.2
287	V	28.1	Very low	28.4	Very low	133 Å²	133	155.3 Å²	155.3	81%	0.806	80%	0.798	S	S	*	*			trans	-118.3	140.4	165.4	173.4	0	0	0	0	107.7
288	P	30.4	Very low	28.8	Very low	115 Å²	115	150.9 Å²	150.9	75%	0.747	80%	0.796	S	S	*	*			trans	-76.2	146.3	-155.4	-15.7	31.8	0	0	0	115.2	N290	P288-N290 PolarHBondContact O-N 3.09Å
289	M	25.6	Very low	28.8	Very low	178 Å²	178	150.8 Å²	150.8	88%	0.877	80%	0.796	S	S	*	*			trans	-33.7	114.9	164	-72.1	-81	165.2	0	0	114.8
290	N	30.4	Very low	29	Very low	157 Å²	157	151.3 Å²	151.3	84%	0.84	80%	0.8	S	S	*	*			trans	-100.3	105.9	149.3	-80.9	-18.7	0	0	0	108	P288	P288-N290 PolarHBondContact O-N 3.09Å
291	S	25.6	Very low	28.7	Very low	104 Å²	104	155 Å²	155	73%	0.727	80%	0.803	S	S	*	*			trans	-67.4	121.7	178.8	57.1	0	0	0	0	111.8
292	F	32.5	Very low	28.9	Very low	202 Å²	202	154.8 Å²	154.8	89%	0.886	80%	0.802	S	S	*	*			trans	-119.7	113.9	149.1	-80.8	-82.8	0	0	0	107.2
293	G	25.4	Very low	28.7	Very low	68 Å²	68	150.3 Å²	150.3	70%	0.701	79%	0.793	S	S	*	*			trans	-64.2	140.1	-170	0	0	0	0	0	112.8
294	P	35.1	Very low	29.2	Very low	123 Å²	123	152.8 Å²	152.8	80%	0.799	80%	0.801	S	S	*	*			trans	-69.9	133	177.7	24.9	-29.8	0	0	0	111.5	N296	P294-N296 PolarHBondContact O-N 3.11Å
295	L	31.1	Very low	29.4	Very low	165 Å²	165	147.5 Å²	147.5	86%	0.864	79%	0.794	S	S	*	*			trans	-37.9	125.2	172.6	-100.2	77.6	0	0	0	112.5	K297	L295-K297 PolarHBondContact O-N 2.77Å
296	N	31.1	Very low	29.3	Very low	156 Å²	156	146.3 Å²	146.3	83%	0.834	80%	0.798	S	S	*	*			trans	-59.1	94.7	168	-70.4	-35.6	0	0	0	110.2	P294 T298	P294-N296 PolarHBondContact O-N 3.11Å; N296-T298 VanDerWaalsContact C-N 3.3Å; N296-T298 PolarHBondContact O-N 2.94Å
297	K	34.7	Very low	29.7	Very low	193 Å²	193	145.4 Å²	145.4	84%	0.839	79%	0.791	S	S	*	*			trans	-71.2	90.7	160.5	-71.2	-177.9	179.2	-179.8	0	107.3	L295 N299	L295-K297 PolarHBondContact O-N 2.77Å; K297-N299 PolarHBondContact O-N 2.76Å
298	T	31.2	Very low	29.6	Very low	126 Å²	126	149 Å²	149	77%	0.773	80%	0.795	S	S	*	*			trans	-61.7	109.5	169.6	45.3	0	0	0	0	108.7	N296 L300	N296-T298 VanDerWaalsContact C-N 3.3Å; N296-T298 PolarHBondContact O-N 2.94Å; T298-L300 PolarHBondContact O-N 3.3Å
299	N	29	Very low	29.7	Very low	149 Å²	149	151 Å²	151	80%	0.797	80%	0.798	S	S	*	*			trans	-52.7	94.9	169	-76.6	-77.9	0	0	0	111.1	K297 R301	K297-N299 PolarHBondContact O-N 2.76Å; N299-R301 VanDerWaalsContact C-N 3.26Å; N299-R301 PolarHBondContact O-N 2.95Å
300	L	29.3	Very low	29.9	Very low	162 Å²	162	147.3 Å²	147.3	85%	0.848	79%	0.79	S	S	*	*			trans	-87.1	81.5	152.7	-93.6	163.7	0	0	0	107.5	T298 E302	T298-L300 PolarHBondContact O-N 3.3Å; L300-E302 VanDerWaalsContact C-N 3.32Å; L300-E302 PolarHBondContact O-N 2.85Å
301	R	25.8	Very low	29.7	Very low	209 Å²	209	148.7 Å²	148.7	79%	0.789	79%	0.789	S	S	*	*			trans	-81.6	78.4	173.2	-168.6	-174.8	-168.7	-156.6	3.9	107.9	N299 T303	N299-R301 VanDerWaalsContact C-N 3.26Å; N299-R301 PolarHBondContact O-N 2.95Å; R301-T303 PolarHBondContact O-N 2.69Å; R301-T303 PolarHBondContact O-OG1 2.64Å
302	E	30.5	Very low	29.8	Very low	159 Å²	159	151 Å²	151	74%	0.743	79%	0.793	S	S	*	*			trans	-68.5	102.3	167.9	-79.7	-169.4	167.1	0	0	108.9	L300 I304	L300-E302 VanDerWaalsContact C-N 3.32Å; L300-E302 PolarHBondContact O-N 2.85Å; E302-I304 PolarHBondContact O-N 2.68Å
303	T	25.9	Very low	29.6	Very low	114 Å²	114	146.6 Å²	146.6	70%	0.699	79%	0.787	S	S	*	*			trans	-87.1	78.7	-180	-47.1	0	0	0	0	107.2	R301 S305	R301-T303 PolarHBondContact O-N 2.69Å; R301-T303 PolarHBondContact O-OG1 2.64Å; T303-S305 PolarHBondContact O-N 2.64Å
304	I	33.1	Very low	29.7	Very low	147 Å²	147	149.5 Å²	149.5	75%	0.754	80%	0.797	S	S	*	*			trans	-86.7	105.6	174.8	-53.2	179.5	0	0	0	108.5	E302 S306	E302-I304 PolarHBondContact O-N 2.68Å; I304-S306 PolarHBondContact O-N 2.8Å
305	S	28.3	Very low	29.6	Very low	96 Å²	96	151.4 Å²	151.4	67%	0.671	80%	0.795	S	S	*	*			trans	-43.5	118.5	176.6	152	0	0	0	0	113.2	T303 K307	T303-S305 PolarHBondContact O-N 2.64Å; S305-K307 VanDerWaalsContact C-N 3.32Å; S305-K307 PolarHBondContact O-N 2.83Å
306	S	28.4	Very low	29.4	Very low	120 Å²	120	150.3 Å²	150.3	84%	0.839	80%	0.795	S	S	*	*			trans	-68	84.2	165.6	38.3	0	0	0	0	110.7	I304 K308	I304-S306 PolarHBondContact O-N 2.8Å; S306-K308 PolarHBondContact O-N 2.86Å; S306-K308 VanDerWaalsContact O-N 3.1Å
307	K	31.6	Very low	29.5	Very low	178 Å²	178	153.7 Å²	153.7	77%	0.774	80%	0.796	S	S	*	*			trans	-75.2	99.3	170.4	-159.3	170.8	-174.4	176.1	0	108.5	S305 I309	S305-K307 VanDerWaalsContact C-N 3.32Å; S305-K307 PolarHBondContact O-N 2.83Å; K307-I309 PolarHBondContact O-N 3.38Å
308	K	27.6	Very low	29.4	Very low	208 Å²	208	152.8 Å²	152.8	90%	0.904	80%	0.795	S	S	*	*			trans	-51	107.9	167.2	-85.3	177.6	173.9	174.6	0	109.1	S306	S306-K308 PolarHBondContact O-N 2.86Å; S306-K308 VanDerWaalsContact O-N 3.1Å
309	I	31.2	Very low	29.7	Very low	156 Å²	156	152 Å²	152	80%	0.8	80%	0.795	S	S	*	*			trans	-98	119	160.8	-64.3	173.5	0	0	0	106.5	K307	K307-I309 PolarHBondContact O-N 3.38Å
310	S	29.7	Very low	30.1	Very low	102 Å²	102	154.2 Å²	154.2	71%	0.713	80%	0.797	S	S	*	*			trans	-74.8	138.7	-178.1	60.3	0	0	0	0	111.7
311	K	26.5	Very low	30.6	Very low	186 Å²	186	153.8 Å²	153.8	81%	0.809	80%	0.796	S	S	*	*			trans	34.7	123.2	139.5	-76.4	-176.1	178.8	179.7	0	119.1
312	N	27.7	Very low	31.3	Very low	152 Å²	152	147.8 Å²	147.8	81%	0.813	79%	0.791	S	S	*	*			trans	95.7	91.1	147.6	-51.5	-15.8	0	0	0	116.7
313	S	28.3	Very low	31.5	Very low	110 Å²	110	148.1 Å²	148.1	77%	0.769	79%	0.793	S	S	*	*				-169.3	113.4	124.9	56.7	0	0	0	0	108.5	E315	S313-E315 PolarHBondContact O-N 2.86Å; S313-E315 VanDerWaalsContact O-N 3.16Å
314	S	28.6	Very low	32.1	Very low	128 Å²	128	148.3 Å²	148.3	90%	0.895	79%	0.793	S	S	*	*			trans	-64.3	102.2	164.6	46.7	0	0	0	0	108.7
315	E	31	Very low	32.1	Very low	164 Å²	164	148.3 Å²	148.3	77%	0.766	79%	0.79	S	S	*	*			trans	-140.2	112.5	162.6	-150.6	167.1	-150	0	0	107.1	S313 R317	S313-E315 PolarHBondContact O-N 2.86Å; S313-E315 VanDerWaalsContact O-N 3.16Å; E315-R317 PolarHBondContact O-N 2.9Å
316	T	28.4	Very low	32.5	Very low	141 Å²	141	149.2 Å²	149.2	87%	0.865	79%	0.791	S	S	*	*			trans	-57.7	86.4	177.7	-48.4	0	0	0	0	108.4	Q318	T316-Q318 PolarHBondContact O-N 3.36Å
317	R	33.6	Very low	32.8	Very low	228 Å²	228	149.2 Å²	149.2	86%	0.86	79%	0.786	S	S	*	*			trans	-68	104.6	171.5	-78.3	-173.6	177.3	-170.4	-1.2	106.7	E315 S319	E315-R317 PolarHBondContact O-N 2.9Å; R317-S319 PolarHBondContact O-N 3.21Å; R317-S319 VanDerWaalsContact O-N 3.11Å
318	Q	32.4	Very low	33	Very low	174 Å²	174	152.4 Å²	152.4	81%	0.813	79%	0.794	S	S	*	*			trans	-43.2	118.1	162.9	-73.9	175.4	-10.6	0	0	108	T316 K320	T316-Q318 PolarHBondContact O-N 3.36Å; Q318-K320 PolarHBondContact O-N 2.92Å
319	S	36	Very low	33.5	Very low	109 Å²	109	147.3 Å²	147.3	76%	0.762	78%	0.784	S	S	*	*			trans	-56.2	104.3	167.8	-53.5	0	0	0	0	106.5	R317 D321	R317-S319 PolarHBondContact O-N 3.21Å; R317-S319 VanDerWaalsContact O-N 3.11Å; S319-D321 PolarHBondContact O-N 3.44Å
320	K	38	Very low	33.5	Very low	195 Å²	195	142.2 Å²	142.2	85%	0.848	77%	0.77	S	S	*	*			trans	-71.9	108.9	164.7	-71	-167.9	175.5	-171.4	0	105.1	Q318 A322	Q318-K320 PolarHBondContact O-N 2.92Å; K320-A322 PolarHBondContact O-N 3.45Å
321	D	39.4	Very low	33.6	Very low	153 Å²	153	147.9 Å²	147.9	82%	0.818	78%	0.777	S	S	*	*			trans	-53.8	108.5	168.4	-66	-40.1	0	0	0	107.2	S319 E323	S319-D321 PolarHBondContact O-N 3.44Å; D321-E323 PolarHBondContact O-N 3.12Å
322	A	41	Very low	34	Very low	84 Å²	84	148 Å²	148	69%	0.694	78%	0.778	S	S	*	*			trans	-74.7	99.7	178.3	0	0	0	0	0	106.6	K320 V324	K320-A322 PolarHBondContact O-N 3.45Å; A322-V324 WeakPolarHBondContact O-CG2 3.2Å; A322-V324 PolarHBondContact O-N 2.75Å
323	E	34	Very low	34.5	Very low	166 Å²	166	145.1 Å²	145.1	78%	0.776	77%	0.77	S	S	*	*			trans	-60.1	99.1	170	-169.2	-176.5	167.4	0	0	108.5	D321 Q325	D321-E323 PolarHBondContact O-N 3.12Å; E323-Q325 PolarHBondContact O-N 2.87Å
324	V	40.4	Very low	34.8	Very low	117 Å²	117	148.1 Å²	148.1	71%	0.709	77%	0.771	S	S	*	*			trans	-78	92.1	178.5	-173.6	0	0	0	0	107.7	A322 T326	A322-V324 WeakPolarHBondContact O-CG2 3.2Å; A322-V324 PolarHBondContact O-N 2.75Å; V324-T326 HydrophobicContact CG1-CG2 4.43Å; V324-T326 PolarHBondContact O-N 3.01Å
325	Q	31.1	Very low	35	Very low	148 Å²	148	148.4 Å²	148.4	69%	0.692	76%	0.763	S	S	*	*			trans	-67.9	102.3	165.2	-71.8	-172.4	-7.6	0	0	108.8	E323 V327	E323-Q325 PolarHBondContact O-N 2.87Å; Q325-V327 PolarHBondContact O-N 3.39Å
326	T	38.6	Very low	35.3	Very low	114 Å²	114	150.4 Å²	150.4	70%	0.699	77%	0.765	S	S	*	*			trans	-73.1	92.9	169.3	32	0	0	0	0	109.2	V324 W328	V324-T326 HydrophobicContact CG1-CG2 4.43Å; V324-T326 PolarHBondContact O-N 3.01Å; T326-W328 PolarHBondContact O-N 3.31Å
327	V	33.6	Very low	35.6	Very low	121 Å²	121	152 Å²	152	73%	0.733	76%	0.762	S	S	*	*			trans	-74.5	118.8	168	-179.1	0	0	0	0	108.2	Q325 S329	Q325-V327 PolarHBondContact O-N 3.39Å; V327-S329 PolarHBondContact O-N 2.83Å
328	W	36.1	Very low	35.8	Very low	245 Å²	245	146.6 Å²	146.6	93%	0.928	75%	0.75	S	S	*	*			trans	-67.7	92.5	173.2	-69.9	86.1	0	0	0	109.9	T326 G330	T326-W328 PolarHBondContact O-N 3.31Å; W328-G330 PolarHBondContact O-N 3.48Å
329	S	37.7	Very low	35.8	Very low	101 Å²	101	142.8 Å²	142.8	71%	0.706	74%	0.74	S	S	*	*			trans	-79.8	56.1	168	66.6	0	0	0	0	110.4	V327 Y331	V327-S329 PolarHBondContact O-N 2.83Å; S329-Y331 PolarHBondContact O-N 3.3Å
330	G	31.3	Very low	35.5	Very low	48 Å²	48	146.1 Å²	146.1	50%	0.495	74%	0.743	S	S	.	*			trans	-78.9	89.4	166.6	0	0	0	0	0	108.1	W328 F332	W328-G330 PolarHBondContact O-N 3.48Å; G330-F332 VanDerWaalsContact C-N 3.28Å; G330-F332 WeakPolarHBondContact O-CD2 3.26Å; G330-F332 PolarHBondContact O-N 3.32Å
331	Y	32.3	Very low	35.3	Very low	222 Å²	222	143.8 Å²	143.8	87%	0.871	74%	0.74	S	S	*	*			trans	-61	98.8	163.2	-78.9	-88.1	0	0	0	107	S329 S333	S329-Y331 PolarHBondContact O-N 3.3Å; Y331-S333 PolarHBondContact O-N 3.46Å
332	F	34.5	Very low	35	Very low	189 Å²	189	145.1 Å²	145.1	83%	0.829	74%	0.738	S	S	*	*			trans	-58.6	106.1	168.1	-67.8	-83.5	0	0	0	106.5	G330 Q334	G330-F332 VanDerWaalsContact C-N 3.28Å; G330-F332 WeakPolarHBondContact O-CD2 3.26Å; G330-F332 PolarHBondContact O-N 3.32Å; F332-Q334 VanDerWaalsContact C-N 3.33Å; F332-Q334 PolarHBondContact O-N 3.23Å
333	S	37.8	Very low	34.5	Very low	91 Å²	91	146.2 Å²	146.2	64%	0.636	74%	0.739	S	S	*	*			trans	-59.9	100.3	172.7	-176.9	0	0	0	0	107	Y331 N335	Y331-S333 PolarHBondContact O-N 3.46Å; S333-N335 PolarHBondContact O-N 2.98Å
334	Q	35.8	Very low	34.5	Very low	172 Å²	172	145.8 Å²	145.8	80%	0.804	74%	0.74	S	S	*	*			trans	-71	32.2	179	-70.6	-179.6	-5.2	0	0	112.2	F332 Y336	F332-Q334 VanDerWaalsContact C-N 3.33Å; F332-Q334 PolarHBondContact O-N 3.23Å; Q334-Y336 PolarHBondContact O-N 3.03Å
335	N	31.8	Very low	34.2	Very low	135 Å²	135	147 Å²	147	72%	0.722	74%	0.741	S	S	*	*			trans	-84.6	63.1	173.6	-76.5	-26.7	0	0	0	109.9	S333 H337	S333-N335 PolarHBondContact O-N 2.98Å; N335-H337 PolarHBondContact O-N 2.88Å
336	Y	38.8	Very low	34.3	Very low	205 Å²	205	148.9 Å²	148.9	80%	0.804	75%	0.747	S	S	*	*			trans	-75.8	60.5	157.6	-69.9	-79.4	0	0	0	109.4	Q334	Q334-Y336 PolarHBondContact O-N 3.03Å
337	H	33.9	Very low	34.2	Very low	174 Å²	174	154.2 Å²	154.2	81%	0.806	76%	0.756	S	S	*	*			trans	-117.7	80.2	155.3	-99.6	-59.2	0	0	0	105.9	N335 P339	N335-H337 PolarHBondContact O-N 2.88Å; H337-P339 WeakPolarHBondContact O-CD 3.28Å
338	I	36.9	Very low	34.2	Very low	116 Å²	116	157.1 Å²	157.1	60%	0.595	76%	0.762	S	S	*	*			trans	-66.1	112.8	158.8	-60.3	170.8	0	0	0	104.4	H340	I338-H340 PolarHBondContact O-N 2.88Å
339	P	33	Very low	34.2	Very low	94 Å²	94	154 Å²	154	61%	0.61	76%	0.757	S	S	*	*			trans	-64.4	109.2	176.7	25.1	-30.6	0	0	0	108	H337 N341	H337-P339 WeakPolarHBondContact O-CD 3.28Å; P339-N341 PolarHBondContact O-N 2.86Å
340	H	30.2	Very low	34.2	Very low	179 Å²	179	156.3 Å²	156.3	83%	0.829	76%	0.76	S	S	*	*	S	Bend	trans	-68.4	69.2	167	-67.6	-74.7	0	0	0	109.2	I338	I338-H340 PolarHBondContact O-N 2.88Å
341	N	33.3	Very low	34.4	Very low	145 Å²	145	159.6 Å²	159.6	78%	0.775	77%	0.772	S	S	*	*			trans	-164.3	64.8	168.4	-101.1	-12.1	0	0	0	108.1	P339 P343	P339-N341 PolarHBondContact O-N 2.86Å; N341-P343 WeakPolarHBondContact O-CD 3.35Å
342	F	32.5	Very low	34.6	Very low	181 Å²	181	154.6 Å²	154.6	79%	0.794	77%	0.765	S	S	*	*			trans	-74	119.3	150.2	-75.3	-77.2	0	0	0	106.1	I344	F342-I344 PolarHBondContact O-N 3.11Å; F342-I344 VanDerWaalsContact O-N 3.11Å
343	P	30.7	Very low	34.7	Very low	108 Å²	108	151.7 Å²	151.7	70%	0.701	77%	0.765	S	S	*	*			trans	-54.4	123.1	170.7	-17.6	29	0	0	0	107.1	N341 I345	N341-P343 WeakPolarHBondContact O-CD 3.35Å; P343-I345 PolarHBondContact O-N 3.19Å
344	I	33.6	Very low	34.7	Very low	156 Å²	156	153 Å²	153	80%	0.8	77%	0.769	S	S	*	*			trans	-60.8	97.7	165.8	-61.4	167.9	0	0	0	104.5	F342 K346	F342-I344 PolarHBondContact O-N 3.11Å; F342-I344 VanDerWaalsContact O-N 3.11Å; I344-K346 VanDerWaalsContact C-N 3.28Å; I344-K346 PolarHBondContact O-N 3.26Å
345	I	34.3	Very low	35	Very low	143 Å²	143	150.8 Å²	150.8	73%	0.733	76%	0.762	S	S	*	*			trans	-63.6	101.7	170.8	-52.5	174.1	0	0	0	103.2	P343 Y347	P343-I345 PolarHBondContact O-N 3.19Å; I345-Y347 PolarHBondContact O-N 2.81Å
346	K	34.9	Very low	35.3	Very low	187 Å²	187	151.4 Å²	151.4	81%	0.813	77%	0.765	S	S	*	*			trans	-56.5	116.9	171.6	-68.9	-176	178.9	-177.7	0	105.1	I344 E348	I344-K346 VanDerWaalsContact C-N 3.28Å; I344-K346 PolarHBondContact O-N 3.26Å; K346-E348 PolarHBondContact O-N 3.06Å
347	Y	35.3	Very low	35.3	Very low	227 Å²	227	147.7 Å²	147.7	89%	0.89	76%	0.764	S	S	*	*			trans	-50.5	108.9	175.9	-70.2	-89.3	0	0	0	107.6	I345 E349	I345-Y347 PolarHBondContact O-N 2.81Å; Y347-E349 PolarHBondContact O-N 2.64Å
348	E	34.7	Very low	35.3	Very low	182 Å²	182	145.2 Å²	145.2	85%	0.85	76%	0.762	S	S	*	*			trans	-63.1	128.2	170.1	-158.6	166.3	-161	0	0	106.2	K346 I350	K346-E348 PolarHBondContact O-N 3.06Å; E348-I350 PolarHBondContact O-N 2.91Å; E348-I350 VanDerWaalsContact O-N 3.09Å
349	E	34.4	Very low	35.4	Very low	180 Å²	180	147.5 Å²	147.5	84%	0.841	77%	0.774	S	S	*	*			trans	-47.8	114.9	-174	-169.3	171.3	-175.3	0	0	109.9	Y347 P351	Y347-E349 PolarHBondContact O-N 2.64Å; E349-P351 VanDerWaalsContact O-CD 3.25Å; E349-P351 WeakPolarHBondContact O-CD 3.36Å; E349-P351 VanDerWaalsContact O-N 3.08Å
350	I	38.6	Very low	35.5	Very low	149 Å²	149	152 Å²	152	76%	0.764	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-55.5	117.3	-176.8	-60.3	168.8	0	0	0	107.3	E348 T352	E348-I350 PolarHBondContact O-N 2.91Å; E348-I350 VanDerWaalsContact O-N 3.09Å; I350-T352 PolarHBondContact O-N 3.3Å; I350-T352 VanDerWaalsContact O-N 3.11Å
351	P	36.2	Very low	35.5	Very low	116 Å²	116	151.2 Å²	151.2	75%	0.753	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-57.5	123	176.2	-21.1	31.1	0	0	0	108.6	E349	E349-P351 VanDerWaalsContact O-CD 3.25Å; E349-P351 WeakPolarHBondContact O-CD 3.36Å; E349-P351 VanDerWaalsContact O-N 3.08Å
352	T	35.3	Very low	35.9	Very low	117 Å²	117	152.2 Å²	152.2	72%	0.718	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-46.8	132.9	178.8	36.3	0	0	0	0	110.9	I350 T354	I350-T352 PolarHBondContact O-N 3.3Å; I350-T352 VanDerWaalsContact O-N 3.11Å; T352-T354 PolarHBondContact O-N 2.92Å; T352-T354 PolarHBondContact O-OG1 3.3Å
353	P	37.4	Very low	36.1	Very low	128 Å²	128	149 Å²	149	83%	0.831	77%	0.773	S	S	*	*			trans	-66.6	100.7	-165.7	26.5	-33.8	0	0	0	109.9	I355	P353-I355 PolarHBondContact O-N 3.48Å
354	T	37.9	Very low	36.3	Very low	118 Å²	118	151.4 Å²	151.4	72%	0.724	78%	0.778	S	S	*	*			trans	-86.5	97.4	174.5	-51.4	0	0	0	0	107.7	T352	T352-T354 PolarHBondContact O-N 2.92Å; T352-T354 PolarHBondContact O-OG1 3.3Å
355	I	42	Very low	36.8	Very low	127 Å²	127	149.1 Å²	149.1	65%	0.651	77%	0.771	S	S	*	*	S	Bend	trans	63.9	96.6	148.6	-45.2	166.6	0	0	0	115.9	P353 T357	P353-I355 PolarHBondContact O-N 3.48Å; I355-T357 PolarHBondContact O-N 3.48Å; I355-T357 VanDerWaalsContact O-N 3.11Å
356	N	36.9	Very low	37.2	Very low	148 Å²	148	145.8 Å²	145.8	79%	0.791	76%	0.76	S	S	*	*			trans	51.2	42.3	138.2	-51.3	-17.5	0	0	0	118.9	T358	N356-T358 PolarHBondContact O-N 3.48Å
357	T	39.3	Very low	37.8	Very low	126 Å²	126	141.2 Å²	141.2	77%	0.773	75%	0.752	S	S	*	*			trans	-71.3	87.1	153.5	41	0	0	0	0	108.2	I355 L359	I355-T357 PolarHBondContact O-N 3.48Å; I355-T357 VanDerWaalsContact O-N 3.11Å; T357-L359 VanDerWaalsContact C-N 3.3Å; T357-L359 PolarHBondContact O-N 3.44Å
358	T	33.1	Very low	38.2	Very low	123 Å²	123	136.6 Å²	136.6	76%	0.755	74%	0.742	S	S	*	*			trans	-51.6	101.5	161.2	-57.9	0	0	0	0	106.7	N356 K360	N356-T358 PolarHBondContact O-N 3.48Å; T358-K360 PolarHBondContact O-N 3.28Å
359	L	39.9	Very low	39.1	Very low	163 Å²	163	132.6 Å²	132.6	85%	0.853	73%	0.725	S	S	*	*			trans	-60.5	96.8	169.5	-73.7	167.4	0	0	0	105.6	T357 M361	T357-L359 VanDerWaalsContact C-N 3.3Å; T357-L359 PolarHBondContact O-N 3.44Å; L359-M361 VanDerWaalsContact C-N 3.34Å; L359-M361 PolarHBondContact O-N 2.86Å
360	K	35.6	Very low	39.9	Very low	190 Å²	190	127.9 Å²	127.9	83%	0.826	71%	0.706	S	S	*	*			trans	-59.1	109.2	164.6	-82.6	-172.3	174.9	-177.9	0	104.6	T358 Q362	T358-K360 PolarHBondContact O-N 3.28Å; K360-Q362 PolarHBondContact O-N 3.27Å
361	M	30.6	Very low	40.6	Very low	161 Å²	161	128.9 Å²	128.9	79%	0.793	70%	0.701	S	S	*	*			trans	-53.4	100.9	167.1	-154.5	178.5	89.6	0	0	104.8	L359 N363	L359-M361 VanDerWaalsContact C-N 3.34Å; L359-M361 PolarHBondContact O-N 2.86Å; M361-N363 VanDerWaalsContact C-N 3.26Å; M361-N363 PolarHBondContact O-N 2.72Å
362	Q	39.8	Very low	41.7	Very low	166 Å²	166	130.9 Å²	130.9	78%	0.776	70%	0.698	S	S	*	*			trans	-66	104.5	173.6	-157.3	173.3	17.2	0	0	101.9	K360 M364	K360-Q362 PolarHBondContact O-N 3.27Å; Q362-M364 PolarHBondContact O-N 2.95Å
363	N	38.6	Very low	42.7	Very low	113 Å²	113	129.4 Å²	129.4	60%	0.604	69%	0.689	S	S	*	*			trans	-53.2	101.7	166.8	-84.4	-16.7	0	0	0	103.5	M361 T365	M361-N363 VanDerWaalsContact C-N 3.26Å; M361-N363 PolarHBondContact O-N 2.72Å; N363-T365 HydrophobicContact CB-CG2 4.17Å; N363-T365 PolarHBondContact O-N 2.97Å
364	M	34.9	Very low	43.6	Very low	160 Å²	160	126.7 Å²	126.7	79%	0.788	67%	0.667	S	S	*	*			trans	-64.8	76.2	149.5	-67.6	-150.7	168	0	0	102.8	Q362 S366	Q362-M364 PolarHBondContact O-N 2.95Å; M364-S366 PolarHBondContact O-N 3.39Å
365	T	42.7	Very low	44.4	Very low	108 Å²	108	126 Å²	126	66%	0.663	66%	0.659	S	S	*	*			trans	-48.6	98.2	150.9	43.8	0	0	0	0	102	N363 S367	N363-T365 HydrophobicContact CB-CG2 4.17Å; N363-T365 PolarHBondContact O-N 2.97Å; T365-S367 PolarHBondContact O-N 3.38Å
366	S	43.1	Very low	45.2	Very low	73 Å²	73	124.2 Å²	124.2	51%	0.51	65%	0.654	S	S	.	*			trans	31.1	80.3	157.6	36.8	0	0	0	0	109.4	M364 L368	M364-S366 PolarHBondContact O-N 3.39Å; S366-L368 VanDerWaalsContact O-CA 3.31Å; S366-L368 WeakPolarHBondContact O-CA 3.42Å; S366-L368 PolarHBondContact O-N 2.88Å
367	S	46.7	Very low	46.1	Very low	91 Å²	91	122.6 Å²	122.6	64%	0.636	65%	0.645	S	S	*	*			trans	-40.3	103.8	140.1	156.6	0	0	0	0	101.8	T365 I369	T365-S367 PolarHBondContact O-N 3.38Å; S367-I369 WeakPolarHBondContact O-CG1 2.99Å; S367-I369 PolarHBondContact O-N 3.43Å
368	L	45.3	Very low	47	Very low	129 Å²	129	120 Å²	120	68%	0.675	63%	0.629	S	S	*	*			trans	-71.2	82.2	-163.6	-161	89.8	0	0	0	100.9	S366 N370	S366-L368 VanDerWaalsContact O-CA 3.31Å; S366-L368 WeakPolarHBondContact O-CA 3.42Å; S366-L368 PolarHBondContact O-N 2.88Å; L368-N370 PolarHBondContact O-N 2.96Å
369	I	52.3	Low	48.4	Very low	98 Å²	98	118.4 Å²	118.4	50%	0.503	62%	0.619	S	S	.	*			trans	-63.3	95	170.9	-58.3	171.9	0	0	0	99.1	S367 Y371 L374	S367-I369 WeakPolarHBondContact O-CG1 2.99Å; S367-I369 PolarHBondContact O-N 3.43Å; I369-Y371 PolarHBondContact O-N 2.95Å; I369-L374 HydrophobicContact CB-CD1 4.05Å; I369-L374 HydrophobicContact CG2-CB 4.46Å; I369-L374 HydrophobicContact CG2-CD1 3.27Å; I369-L374 HydrophobicContact CG2-CD2 4.48Å; I369-L374 HydrophobicContact CG2-CG 3.46Å; I369-L374 VanDerWaalsContact CG2-CG 3.46Å
370	N	52.2	Low	49.4	Very low	82 Å²	82	120 Å²	120	44%	0.439	62%	0.615	S	S	.	*			trans	-55.4	111.2	-169.2	179.3	-5.3	0	0	0	103.2	L368 K372 T373 L374	L368-N370 PolarHBondContact O-N 2.96Å; N370-K372 CarbonylContact O-C 3.51Å; N370-K372 PolarHBondContact O-N 2.83Å; N370-T373 WeakPolarHBondContact O-CA 3.42Å; N370-T373 WeakPolarHBondContact O-CB 3.37Å; N370-T373 PolarHBondContact O-N 2.93Å; N370-L374 PolarHBondContact O-N 3.22Å
371	Y	53.8	Low	51.2	Low	170 Å²	170	113.5 Å²	113.5	67%	0.667	59%	0.59	S	S	*	*	H	α-helix	trans	-55.4	-27.4	-169.6	-60.2	-83.6	0	0	0	109.9	I369 L374 D375	I369-Y371 PolarHBondContact O-N 2.95Å; Y371-L374 PolarHBondContact O-N 3.44Å; Y371-D375 WeakPolarHBondContact O-CB 3.15Å; Y371-D375 PolarHBondContact O-N 2.78Å
372	K	58.2	Low	53.6	Low	157 Å²	157	110.5 Å²	110.5	68%	0.683	58%	0.582	S	S	*	*	H	α-helix	trans	-57.5	-44.3	167.7	-76.8	-171	171	-173.5	0	114.5	N370 D375 T376	N370-K372 CarbonylContact O-C 3.51Å; N370-K372 PolarHBondContact O-N 2.83Å; K372-D375 PolarHBondContact O-N 3.32Å; K372-T376 WeakPolarHBondContact O-CB 3.22Å; K372-T376 PolarHBondContact O-N 2.84Å; K372-T376 PolarHBondContact O-OG1 3.25Å
373	T	57.8	Low	55.8	Low	86 Å²	86	107 Å²	107	53%	0.528	58%	0.575	S	S	.	*	H	α-helix	trans	-69.1	-38	178.9	-45	0	0	0	0	111.3	N370 T376 L377	N370-T373 WeakPolarHBondContact O-CA 3.42Å; N370-T373 WeakPolarHBondContact O-CB 3.37Å; N370-T373 PolarHBondContact O-N 2.93Å; T373-T376 PolarHBondContact O-N 3.44Å; T373-L377 VanDerWaalsContact O-CB 3.31Å; T373-L377 WeakPolarHBondContact O-CB 3.39Å; T373-L377 PolarHBondContact O-N 2.97Å
374	L	54.5	Low	57.9	Low	72 Å²	72	105.6 Å²	105.6	38%	0.377	57%	0.567	S	S	.	*	H	α-helix	trans	-63.5	-46.1	170.4	-95	169	0	0	0	110.9	I369 N370 Y371 T376 L377 T378	I369-L374 HydrophobicContact CB-CD1 4.05Å; I369-L374 HydrophobicContact CG2-CB 4.46Å; I369-L374 HydrophobicContact CG2-CD1 3.27Å; I369-L374 HydrophobicContact CG2-CD2 4.48Å; I369-L374 HydrophobicContact CG2-CG 3.46Å; I369-L374 VanDerWaalsContact CG2-CG 3.46Å; N370-L374 PolarHBondContact O-N 3.22Å; Y371-L374 PolarHBondContact O-N 3.44Å; L374-T376 VanDerWaalsContact C-N 3.3Å; L374-T376 PolarHBondContact O-N 3.46Å; L374-L377 CarbonylContact O-C 3.48Å; L374-L377 WeakPolarHBondContact O-CA 3.37Å; L374-L377 WeakPolarHBondContact O-CB 3.34Å; L374-L377 PolarHBondContact O-N 2.92Å; L374-T378 WeakPolarHBondContact O-CG2 3.32Å; L374-T378 PolarHBondContact O-N 3.07Å; L374-T378 PolarHBondContact O-OG1 3.01Å; L374-T378 VanDerWaalsContact O-OG1 3.05Å
375	D	56.4	Low	60	Low	102 Å²	102	101 Å²	101	55%	0.545	55%	0.548	S	S	.	.	H	α-helix	trans	-59.3	-41.5	175.4	-115.7	4.8	0	0	0	111.6	Y371 K372 L377 T378 T379	Y371-D375 WeakPolarHBondContact O-CB 3.15Å; Y371-D375 PolarHBondContact O-N 2.78Å; K372-D375 PolarHBondContact O-N 3.32Å; D375-L377 VanDerWaalsContact C-N 3.27Å; D375-L377 PolarHBondContact O-N 3.21Å; D375-T378 WeakPolarHBondContact CA-OG1 3.47Å; D375-T378 PolarHBondContact O-N 2.77Å; D375-T378 PolarHBondContact O-OG1 3.13Å; D375-T379 WeakPolarHBondContact O-CA 3.33Å; D375-T379 WeakPolarHBondContact O-CB 3.39Å; D375-T379 PolarHBondContact O-N 3.23Å; D375-T379 PolarHBondContact O-OG1 2.97Å
376	T	58.4	Low	62	Low	90 Å²	90	98.7 Å²	98.7	55%	0.552	54%	0.54	S	S	*	.	H	α-helix	trans	-66.4	-36.1	176.8	-36.1	0	0	0	0	110.2	K372 T373 L374 Y380	K372-T376 WeakPolarHBondContact O-CB 3.22Å; K372-T376 PolarHBondContact O-N 2.84Å; K372-T376 PolarHBondContact O-OG1 3.25Å; T373-T376 PolarHBondContact O-N 3.44Å; L374-T376 VanDerWaalsContact C-N 3.3Å; L374-T376 PolarHBondContact O-N 3.46Å; T376-Y380 WeakPolarHBondContact O-CB 3.31Å; T376-Y380 PolarHBondContact O-N 3.05Å
377	L	54.7	Low	64.1	Low	114 Å²	114	99.2 Å²	99.2	60%	0.597	54%	0.537	S	S	*	.	H	α-helix	trans	-74	-31.3	178.6	-162.5	75.2	0	0	0	112.4	T373 L374 D375 N381	T373-L377 VanDerWaalsContact O-CB 3.31Å; T373-L377 WeakPolarHBondContact O-CB 3.39Å; T373-L377 PolarHBondContact O-N 2.97Å; L374-L377 CarbonylContact O-C 3.48Å; L374-L377 WeakPolarHBondContact O-CA 3.37Å; L374-L377 WeakPolarHBondContact O-CB 3.34Å; L374-L377 PolarHBondContact O-N 2.92Å; D375-L377 VanDerWaalsContact C-N 3.27Å; D375-L377 PolarHBondContact O-N 3.21Å; L377-N381 VanDerWaalsContact O-CB 3.28Å; L377-N381 WeakPolarHBondContact O-CB 3.3Å
378	T	58.7	Low	66.1	Low	71 Å²	71	98.3 Å²	98.3	44%	0.436	53%	0.525	S	S	.	.	H	α-helix	trans	-86	-43.6	178.1	52.7	0	0	0	0	111.7	L374 D375 Y380	L374-T378 WeakPolarHBondContact O-CG2 3.32Å; L374-T378 PolarHBondContact O-N 3.07Å; L374-T378 PolarHBondContact O-OG1 3.01Å; L374-T378 VanDerWaalsContact O-OG1 3.05Å; D375-T378 WeakPolarHBondContact CA-OG1 3.47Å; D375-T378 PolarHBondContact O-N 2.77Å; D375-T378 PolarHBondContact O-OG1 3.13Å; T378-Y380 VanDerWaalsContact C-N 3.34Å; T378-Y380 PolarHBondContact O-N 2.91Å
379	T	63.1	Low	68.1	Low	90 Å²	90	95.8 Å²	95.8	55%	0.552	51%	0.512	S	S	*	.	H	α-helix	trans	-70.3	-31	-177.1	-52.6	0	0	0	0	111.9	D375	D375-T379 WeakPolarHBondContact O-CA 3.33Å; D375-T379 WeakPolarHBondContact O-CB 3.39Å; D375-T379 PolarHBondContact O-N 3.23Å; D375-T379 PolarHBondContact O-OG1 2.97Å
380	Y	61.2	Low	70.1	Confident	196 Å²	196	96.1 Å²	96.1	77%	0.769	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.8	28.9	-173.5	-104.3	-87	0	0	0	114	T376 T378 P382	T376-Y380 WeakPolarHBondContact O-CB 3.31Å; T376-Y380 PolarHBondContact O-N 3.05Å; T378-Y380 VanDerWaalsContact C-N 3.34Å; T378-Y380 PolarHBondContact O-N 2.91Å; Y380-P382 WeakPolarHBondContact O-CD 3.39Å
381	N	73.2	Confident	72.1	Confident	54 Å²	54	95.9 Å²	95.9	29%	0.289	51%	0.511	S	S	.	.			trans	-93.4	104	168	-165.5	-26.8	0	0	0	110	L377 C383 L384 T385	L377-N381 VanDerWaalsContact O-CB 3.28Å; L377-N381 WeakPolarHBondContact O-CB 3.3Å; N381-C383 PolarHBondContact O-N 3.45Å; N381-C383 VanDerWaalsContact OD1-CB 3.26Å; N381-C383 WeakPolarHBondContact OD1-CB 3.15Å; N381-C383 PolarHBondContact OD1-N 2.75Å; N381-L384 HydrophobicContact CB-CB 4.15Å; N381-L384 HydrophobicContact CB-CD1 3.96Å; N381-L384 HydrophobicContact CB-CG 3.94Å; N381-L384 PolarHBondContact O-N 3.45Å; N381-T385 PolarHBondContact O-N 3.42Å; N381-T385 VanDerWaalsContact O-N 3.1Å; N381-T385 PolarHBondContact O-OG1 3.32Å
382	P	80.4	Confident	74	Confident	98 Å²	98	92.8 Å²	92.8	64%	0.636	50%	0.501	S	S	*	.	H	α-helix	trans	-57.6	-24.7	-179.7	24.1	-34.7	0	0	0	112.4	Y380 A386	Y380-P382 WeakPolarHBondContact O-CD 3.39Å; P382-A386 VanDerWaalsContact O-CB 3.22Å; P382-A386 WeakPolarHBondContact O-CB 3.45Å; P382-A386 PolarHBondContact O-N 2.95Å
383	C	85.4	Confident	75.7	Confident	93 Å²	93	91.5 Å²	91.5	63%	0.628	50%	0.497	S	S	*	.	H	α-helix	trans	-70	-38.9	174.1	-57.8	0	0	0	0	112.5	N381 L387	N381-C383 PolarHBondContact O-N 3.45Å; N381-C383 VanDerWaalsContact OD1-CB 3.26Å; N381-C383 WeakPolarHBondContact OD1-CB 3.15Å; N381-C383 PolarHBondContact OD1-N 2.75Å; C383-L387 WeakPolarHBondContact O-CB 3.49Å; C383-L387 PolarHBondContact O-N 2.92Å
384	L	82.4	Confident	77.4	Confident	83 Å²	83	92.9 Å²	92.9	44%	0.435	50%	0.498	S	S	.	.	H	α-helix	trans	-69.5	-41.6	176.1	-68.5	179.2	0	0	0	110.7	N381 A386 L387 D388	N381-L384 HydrophobicContact CB-CB 4.15Å; N381-L384 HydrophobicContact CB-CD1 3.96Å; N381-L384 HydrophobicContact CB-CG 3.94Å; N381-L384 PolarHBondContact O-N 3.45Å; L384-A386 PolarHBondContact O-N 3.03Å; L384-L387 PolarHBondContact O-N 3.26Å; L384-D388 WeakPolarHBondContact O-CB 3.46Å; L384-D388 PolarHBondContact O-N 2.89Å
385	T	80.9	Confident	79.3	Confident	65 Å²	65	94 Å²	94	40%	0.399	50%	0.503	S	S	.	.	H	α-helix	trans	-62.6	-41.8	174.4	-46.7	0	0	0	0	111.8	N381 D388 N389	N381-T385 PolarHBondContact O-N 3.42Å; N381-T385 VanDerWaalsContact O-N 3.1Å; N381-T385 PolarHBondContact O-OG1 3.32Å; T385-D388 PolarHBondContact O-N 3.48Å; T385-N389 WeakPolarHBondContact O-CB 3.5Å; T385-N389 VanDerWaalsContact O-CG 3.24Å; T385-N389 PolarHBondContact O-N 2.93Å; T385-N389 PolarHBondContact O-ND2 2.85Å
386	A	83.1	Confident	81.1	Confident	59 Å²	59	93.1 Å²	93.1	49%	0.488	50%	0.498	S	S	.	.	H	α-helix	trans	-63.7	-41.7	175.6	0	0	0	0	0	112	P382 L384 M390	P382-A386 VanDerWaalsContact O-CB 3.22Å; P382-A386 WeakPolarHBondContact O-CB 3.45Å; P382-A386 PolarHBondContact O-N 2.95Å; L384-A386 PolarHBondContact O-N 3.03Å; A386-M390 WeakPolarHBondContact O-CB 3.38Å; A386-M390 PolarHBondContact O-N 2.83Å
387	L	88.2	Confident	82.7	Confident	84 Å²	84	94.8 Å²	94.8	44%	0.44	50%	0.503	S	S	.	.	H	α-helix	trans	-63.6	-47.1	175.8	178.7	61.8	0	0	0	111.5	C383 L384 N389 M390 L391	C383-L387 WeakPolarHBondContact O-CB 3.49Å; C383-L387 PolarHBondContact O-N 2.92Å; L384-L387 PolarHBondContact O-N 3.26Å; L387-N389 PolarHBondContact O-N 2.84Å; L387-M390 HydrophobicContact CD1-CE 3.76Å; L387-M390 PolarHBondContact O-N 3.15Å; L387-L391 HydrophobicContact CD1-CD1 4.19Å; L387-L391 HydrophobicContact CD1-CG 4.28Å; L387-L391 HydrophobicContact CG-CD1 4.07Å; L387-L391 WeakPolarHBondContact O-CB 3.18Å; L387-L391 VanDerWaalsContact O-CG 3.31Å; L387-L391 WeakPolarHBondContact O-CG 3.43Å; L387-L391 PolarHBondContact O-N 2.86Å
388	D	88.4	Confident	84.5	Confident	71 Å²	71	92.7 Å²	92.7	38%	0.38	50%	0.495	S	S	.	.	H	α-helix	trans	-60	-45.7	177.1	179.9	54.2	0	0	0	111.4	L384 T385 M390 L391 K392	L384-D388 WeakPolarHBondContact O-CB 3.46Å; L384-D388 PolarHBondContact O-N 2.89Å; T385-D388 PolarHBondContact O-N 3.48Å; D388-M390 PolarHBondContact O-N 3.33Å; D388-L391 PolarHBondContact O-N 3.28Å; D388-K392 WeakPolarHBondContact O-CB 3.27Å; D388-K392 VanDerWaalsContact O-CG 3.3Å; D388-K392 WeakPolarHBondContact O-CG 3.44Å; D388-K392 PolarHBondContact O-N 3.48Å; D388-K392 WeakPolarHBondContact OD1-CE 3.27Å; D388-K392 IonicContact OD1-NZ 3.82Å; D388-K392 WeakPolarHBondContact OD2-CE 3.47Å; D388-K392 IonicContact OD2-NZ 2.67Å; D388-K392 PolarHBondContact OD2-NZ 2.84Å
389	N	87.7	Confident	86.1	Confident	76 Å²	76	96.1 Å²	96.1	41%	0.406	50%	0.5	S	S	.	.	H	α-helix	trans	-62.6	-41.7	175.7	-74.9	-20.8	0	0	0	112.5	T385 L387 K392 Q393	T385-N389 WeakPolarHBondContact O-CB 3.5Å; T385-N389 VanDerWaalsContact O-CG 3.24Å; T385-N389 PolarHBondContact O-N 2.93Å; T385-N389 PolarHBondContact O-ND2 2.85Å; L387-N389 PolarHBondContact O-N 2.84Å; N389-K392 PolarHBondContact O-N 2.96Å; N389-Q393 WeakPolarHBondContact O-CB 3.35Å; N389-Q393 VanDerWaalsContact O-CG 3.27Å; N389-Q393 WeakPolarHBondContact O-CG 3.5Å; N389-Q393 PolarHBondContact O-N 3.24Å
390	M	93.8	Very high	87.5	Confident	105 Å²	105	97.3 Å²	97.3	52%	0.517	50%	0.5	S	S	.	.	H	α-helix	trans	-63.8	-43.6	176.4	-175.1	-173.6	71	0	0	111.3	A386 L387 D388 Q393 Q394	A386-M390 WeakPolarHBondContact O-CB 3.38Å; A386-M390 PolarHBondContact O-N 2.83Å; L387-M390 HydrophobicContact CD1-CE 3.76Å; L387-M390 PolarHBondContact O-N 3.15Å; D388-M390 PolarHBondContact O-N 3.33Å; M390-Q393 PolarHBondContact O-N 3.04Å; M390-Q394 WeakPolarHBondContact O-CB 3.4Å; M390-Q394 PolarHBondContact O-N 3.46Å
391	L	94.7	Very high	89.1	Confident	77 Å²	77	93.9 Å²	93.9	40%	0.403	49%	0.489	S	S	.	.	H	α-helix	trans	-64.3	-44.3	176.9	-72.3	171.2	0	0	0	111.3	L387 D388 Q393 Q394 I395	L387-L391 HydrophobicContact CD1-CD1 4.19Å; L387-L391 HydrophobicContact CD1-CG 4.28Å; L387-L391 HydrophobicContact CG-CD1 4.07Å; L387-L391 WeakPolarHBondContact O-CB 3.18Å; L387-L391 VanDerWaalsContact O-CG 3.31Å; L387-L391 WeakPolarHBondContact O-CG 3.43Å; L387-L391 PolarHBondContact O-N 2.86Å; D388-L391 PolarHBondContact O-N 3.28Å; L391-Q393 VanDerWaalsContact C-N 3.34Å; L391-Q393 PolarHBondContact O-N 3.44Å; L391-Q394 PolarHBondContact O-N 2.75Å; L391-I395 VanDerWaalsContact O-CG1 3.27Å; L391-I395 WeakPolarHBondContact O-CG1 3.11Å; L391-I395 PolarHBondContact O-N 2.9Å
392	K	93.6	Very high	90.1	Very high	106 Å²	106	95.3 Å²	95.3	46%	0.461	50%	0.496	S	S	.	.	H	α-helix	trans	-58.1	-45.5	174.1	-77	170.9	175.2	168.2	0	111.8	D388 N389 I395 N396	D388-K392 WeakPolarHBondContact O-CB 3.27Å; D388-K392 VanDerWaalsContact O-CG 3.3Å; D388-K392 WeakPolarHBondContact O-CG 3.44Å; D388-K392 PolarHBondContact O-N 3.48Å; D388-K392 WeakPolarHBondContact OD1-CE 3.27Å; D388-K392 IonicContact OD1-NZ 3.82Å; D388-K392 WeakPolarHBondContact OD2-CE 3.47Å; D388-K392 IonicContact OD2-NZ 2.67Å; D388-K392 PolarHBondContact OD2-NZ 2.84Å; N389-K392 PolarHBondContact O-N 2.96Å; K392-I395 PolarHBondContact O-N 2.92Å; K392-N396 WeakPolarHBondContact O-CB 3.41Å; K392-N396 PolarHBondContact O-N 3.36Å; K392-N396 PolarHBondContact O-ND2 2.83Å
393	Q	93.7	Very high	90.7	Very high	129 Å²	129	92.9 Å²	92.9	60%	0.603	48%	0.48	S	S	*	.	H	α-helix	trans	-61.8	-44.1	175.7	-74.7	175.4	5.9	0	0	111.8	N389 M390 L391 I395 N396 L397	N389-Q393 WeakPolarHBondContact O-CB 3.35Å; N389-Q393 VanDerWaalsContact O-CG 3.27Å; N389-Q393 WeakPolarHBondContact O-CG 3.5Å; N389-Q393 PolarHBondContact O-N 3.24Å; M390-Q393 PolarHBondContact O-N 3.04Å; L391-Q393 VanDerWaalsContact C-N 3.34Å; L391-Q393 PolarHBondContact O-N 3.44Å; Q393-I395 PolarHBondContact O-N 3.39Å; Q393-N396 PolarHBondContact O-N 2.93Å; Q393-L397 WeakPolarHBondContact O-CG 3.32Å; Q393-L397 PolarHBondContact O-N 2.72Å
394	Q	93.5	Very high	91.1	Very high	115 Å²	115	92.3 Å²	92.3	54%	0.537	47%	0.473	S	S	.	.	H	α-helix	trans	-63.7	-40.6	178.2	-171.5	176.6	4.6	0	0	112.1	M390 L391 L397 T398	M390-Q394 WeakPolarHBondContact O-CB 3.4Å; M390-Q394 PolarHBondContact O-N 3.46Å; L391-Q394 PolarHBondContact O-N 2.75Å; Q394-L397 PolarHBondContact O-N 2.94Å; Q394-T398 WeakPolarHBondContact O-CB 3.45Å; Q394-T398 PolarHBondContact O-N 2.94Å; Q394-T398 PolarHBondContact O-OG1 3.12Å
395	I	94.1	Very high	91.7	Very high	97 Å²	97	92.4 Å²	92.4	50%	0.497	47%	0.472	S	S	.	.	H	α-helix	trans	-62.9	-45.4	175.4	-70.6	165.6	0	0	0	110.5	L391 K392 Q393 T398 R399	L391-I395 VanDerWaalsContact O-CG1 3.27Å; L391-I395 WeakPolarHBondContact O-CG1 3.11Å; L391-I395 PolarHBondContact O-N 2.9Å; K392-I395 PolarHBondContact O-N 2.92Å; Q393-I395 PolarHBondContact O-N 3.39Å; I395-T398 PolarHBondContact O-N 2.85Å; I395-R399 WeakPolarHBondContact O-CB 3.46Å; I395-R399 PolarHBondContact O-N 3.46Å
396	N	93.7	Very high	92.2	Very high	82 Å²	82	97.7 Å²	97.7	44%	0.439	48%	0.484	S	S	.	.	H	α-helix	trans	-62.8	-45.7	178.2	-74.6	-19.3	0	0	0	111.8	K392 Q393 T398 R399 E400	K392-N396 WeakPolarHBondContact O-CB 3.41Å; K392-N396 PolarHBondContact O-N 3.36Å; K392-N396 PolarHBondContact O-ND2 2.83Å; Q393-N396 PolarHBondContact O-N 2.93Å; N396-T398 VanDerWaalsContact C-N 3.3Å; N396-T398 PolarHBondContact O-N 2.75Å; N396-R399 WeakPolarHBondContact O-CB 3.48Å; N396-R399 PolarHBondContact O-N 3.17Å; N396-R399 PolarHBondContact OD1-NH1 3Å; N396-E400 WeakPolarHBondContact O-CG 3.32Å; N396-E400 PolarHBondContact O-N 3.39Å
397	L	92.3	Very high	92.8	Very high	126 Å²	126	99.3 Å²	99.3	66%	0.66	49%	0.485	S	S	*	.	H	α-helix	trans	-59.9	-40.8	175.1	-72	171.5	0	0	0	112.2	Q393 Q394 E400 F401	Q393-L397 WeakPolarHBondContact O-CG 3.32Å; Q393-L397 PolarHBondContact O-N 2.72Å; Q394-L397 PolarHBondContact O-N 2.94Å; L397-E400 PolarHBondContact O-N 2.86Å; L397-F401 WeakPolarHBondContact O-CB 3.49Å; L397-F401 PolarHBondContact O-N 2.86Å
398	T	92.6	Very high	93	Very high	70 Å²	70	99.5 Å²	99.5	43%	0.429	49%	0.486	S	S	.	.	H	α-helix	trans	-66.7	-38.9	178.1	-53.9	0	0	0	0	111.3	Q394 I395 N396 F401 L402	Q394-T398 WeakPolarHBondContact O-CB 3.45Å; Q394-T398 PolarHBondContact O-N 2.94Å; Q394-T398 PolarHBondContact O-OG1 3.12Å; I395-T398 PolarHBondContact O-N 2.85Å; N396-T398 VanDerWaalsContact C-N 3.3Å; N396-T398 PolarHBondContact O-N 2.75Å; T398-F401 PolarHBondContact O-N 3.2Å; T398-L402 HydrophobicContact CG2-CD1 4.15Å; T398-L402 WeakPolarHBondContact O-CB 3.31Å; T398-L402 WeakPolarHBondContact O-CG 3.39Å; T398-L402 PolarHBondContact O-N 2.74Å
399	R	92.9	Very high	93.3	Very high	142 Å²	142	102.2 Å²	102.2	54%	0.536	50%	0.496	S	S	.	.	H	α-helix	trans	-62.1	-48.6	175	-172.6	-176.2	-68.5	147.1	-2.7	111.1	I395 N396 F401 L402 T403	I395-R399 WeakPolarHBondContact O-CB 3.46Å; I395-R399 PolarHBondContact O-N 3.46Å; N396-R399 WeakPolarHBondContact O-CB 3.48Å; N396-R399 PolarHBondContact O-N 3.17Å; N396-R399 PolarHBondContact OD1-NH1 3Å; R399-F401 VanDerWaalsContact C-N 3.33Å; R399-F401 PolarHBondContact O-N 3.41Å; R399-L402 PolarHBondContact O-N 3.4Å; R399-T403 WeakPolarHBondContact O-CG2 3.48Å; R399-T403 PolarHBondContact O-N 3.5Å; R399-T403 PolarHBondContact O-OG1 2.95Å
400	E	92.8	Very high	93.6	Very high	116 Å²	116	103.1 Å²	103.1	54%	0.542	50%	0.497	S	S	.	.	H	α-helix	trans	-63.5	-37.3	177.8	-71.4	-53.3	130.7	0	0	113	N396 L397 T403 T404	N396-E400 WeakPolarHBondContact O-CG 3.32Å; N396-E400 PolarHBondContact O-N 3.39Å; L397-E400 PolarHBondContact O-N 2.86Å; E400-T403 VanDerWaalsContact CA-OG1 3.31Å; E400-T403 WeakPolarHBondContact CA-OG1 3.35Å; E400-T403 PolarHBondContact O-OG1 2.84Å; E400-T404 WeakPolarHBondContact O-CB 3.33Å; E400-T404 PolarHBondContact O-N 3.18Å; E400-T404 PolarHBondContact O-OG1 2.98Å
401	F	94.4	Very high	93.5	Very high	124 Å²	124	102.5 Å²	102.5	54%	0.544	50%	0.5	S	S	.	.	H	α-helix	trans	-64	-46.2	173.6	178.8	-99.7	0	0	0	111.3	L397 T398 R399 T404 Q405	L397-F401 WeakPolarHBondContact O-CB 3.49Å; L397-F401 PolarHBondContact O-N 2.86Å; T398-F401 PolarHBondContact O-N 3.2Å; R399-F401 VanDerWaalsContact C-N 3.33Å; R399-F401 PolarHBondContact O-N 3.41Å; F401-T404 PolarHBondContact O-N 2.8Å; F401-Q405 HydrophobicContact CD1-CG 4.13Å; F401-Q405 HydrophobicContact CE1-CG 3.71Å; F401-Q405 HydrophobicContact CE2-CG 4.17Å; F401-Q405 HydrophobicContact CZ-CG 3.73Å; F401-Q405 VanDerWaalsContact CZ-NE2 3.33Å; F401-Q405 VanDerWaalsContact O-CG 3.32Å; F401-Q405 WeakPolarHBondContact O-CG 3.35Å; F401-Q405 PolarHBondContact O-N 3.32Å
402	L	94.3	Very high	93.5	Very high	83 Å²	83	102.9 Å²	102.9	44%	0.435	50%	0.501	S	S	.	.	H	α-helix	trans	-65	-39.7	179.2	-75.5	167.9	0	0	0	112.7	T398 R399 Q405 R406	T398-L402 HydrophobicContact CG2-CD1 4.15Å; T398-L402 WeakPolarHBondContact O-CB 3.31Å; T398-L402 WeakPolarHBondContact O-CG 3.39Å; T398-L402 PolarHBondContact O-N 2.74Å; R399-L402 PolarHBondContact O-N 3.4Å; L402-Q405 PolarHBondContact O-N 2.94Å; L402-R406 WeakPolarHBondContact O-CB 3.42Å; L402-R406 WeakPolarHBondContact O-CG 3.39Å; L402-R406 PolarHBondContact O-N 3Å
403	T	93.4	Very high	93.4	Very high	48 Å²	48	99.9 Å²	99.9	29%	0.294	49%	0.494	S	S	.	.	H	α-helix	trans	-63.5	-44.5	174.7	52.9	0	0	0	0	110.6	R399 E400 Q405 R406 N407	R399-T403 WeakPolarHBondContact O-CG2 3.48Å; R399-T403 PolarHBondContact O-N 3.5Å; R399-T403 PolarHBondContact O-OG1 2.95Å; E400-T403 VanDerWaalsContact CA-OG1 3.31Å; E400-T403 WeakPolarHBondContact CA-OG1 3.35Å; E400-T403 PolarHBondContact O-OG1 2.84Å; T403-Q405 PolarHBondContact O-N 3.2Å; T403-R406 PolarHBondContact O-N 3.31Å; T403-N407 WeakPolarHBondContact O-CB 3.5Å; T403-N407 PolarHBondContact O-N 2.84Å; T403-N407 PolarHBondContact O-ND2 2.86Å; T403-N407 PolarHBondContact O-OD1 2.64Å
404	T	93	Very high	93.2	Very high	81 Å²	81	99.3 Å²	99.3	50%	0.497	49%	0.49	S	S	.	.	H	α-helix	trans	-61.4	-43.2	176.5	-55.7	0	0	0	0	111.8	E400 F401 N407 L408	E400-T404 WeakPolarHBondContact O-CB 3.33Å; E400-T404 PolarHBondContact O-N 3.18Å; E400-T404 PolarHBondContact O-OG1 2.98Å; F401-T404 PolarHBondContact O-N 2.8Å; T404-N407 PolarHBondContact O-N 3.07Å; T404-L408 WeakPolarHBondContact O-CB 3.47Å; T404-L408 PolarHBondContact O-N 2.84Å
405	Q	94.4	Very high	92.9	Very high	85 Å²	85	96.1 Å²	96.1	40%	0.397	48%	0.483	S	S	.	.	H	α-helix	trans	-64	-41.3	176.2	-73.3	-64.1	-17.6	0	0	112.3	F401 L402 T403 L408 H409	F401-Q405 HydrophobicContact CD1-CG 4.13Å; F401-Q405 HydrophobicContact CE1-CG 3.71Å; F401-Q405 HydrophobicContact CE2-CG 4.17Å; F401-Q405 HydrophobicContact CZ-CG 3.73Å; F401-Q405 VanDerWaalsContact CZ-NE2 3.33Å; F401-Q405 VanDerWaalsContact O-CG 3.32Å; F401-Q405 WeakPolarHBondContact O-CG 3.35Å; F401-Q405 PolarHBondContact O-N 3.32Å; L402-Q405 PolarHBondContact O-N 2.94Å; T403-Q405 PolarHBondContact O-N 3.2Å; Q405-L408 PolarHBondContact O-N 2.98Å; Q405-H409 WeakPolarHBondContact O-CB 3.48Å; Q405-H409 PolarHBondContact O-N 2.9Å
406	R	92.6	Very high	92.6	Very high	175 Å²	175	96.1 Å²	96.1	66%	0.66	48%	0.483	S	S	*	.	H	α-helix	trans	-62.4	-44.6	174.9	-76	176.1	-179.3	160.3	0.7	111.6	L402 T403 L408 H409 E410	L402-R406 WeakPolarHBondContact O-CB 3.42Å; L402-R406 WeakPolarHBondContact O-CG 3.39Å; L402-R406 PolarHBondContact O-N 3Å; T403-R406 PolarHBondContact O-N 3.31Å; R406-L408 VanDerWaalsContact C-N 3.34Å; R406-L408 PolarHBondContact O-N 3.44Å; R406-H409 PolarHBondContact O-N 2.88Å; R406-E410 WeakPolarHBondContact O-CB 3.34Å; R406-E410 PolarHBondContact O-N 3.1Å
407	N	94	Very high	92.1	Very high	93 Å²	93	95.3 Å²	95.3	50%	0.497	48%	0.483	S	S	.	.	H	α-helix	trans	-62.6	-41.8	177.6	-69.1	-12.6	0	0	0	111.8	T403 T404 E410 T411	T403-N407 WeakPolarHBondContact O-CB 3.5Å; T403-N407 PolarHBondContact O-N 2.84Å; T403-N407 PolarHBondContact O-ND2 2.86Å; T403-N407 PolarHBondContact O-OD1 2.64Å; T404-N407 PolarHBondContact O-N 3.07Å; N407-E410 PolarHBondContact O-N 3.22Å; N407-T411 WeakPolarHBondContact O-CB 3.39Å; N407-T411 PolarHBondContact O-N 2.96Å; N407-T411 PolarHBondContact O-OG1 3.33Å
408	L	93.8	Very high	91.6	Very high	89 Å²	89	95.7 Å²	95.7	47%	0.466	48%	0.482	S	S	.	.	H	α-helix	trans	-63.8	-46.7	175.1	-179.6	144.6	0	0	0	111.1	T404 Q405 R406 E410 T411 I412	T404-L408 WeakPolarHBondContact O-CB 3.47Å; T404-L408 PolarHBondContact O-N 2.84Å; Q405-L408 PolarHBondContact O-N 2.98Å; R406-L408 VanDerWaalsContact C-N 3.34Å; R406-L408 PolarHBondContact O-N 3.44Å; L408-E410 VanDerWaalsContact C-N 3.34Å; L408-E410 PolarHBondContact O-N 3.47Å; L408-T411 PolarHBondContact O-N 3.48Å; L408-I412 HydrophobicContact CD2-CD1 3.45Å; L408-I412 VanDerWaalsContact CD2-CD1 3.45Å; L408-I412 HydrophobicContact CD2-CG1 4.4Å; L408-I412 HydrophobicContact CG-CD1 4.07Å; L408-I412 WeakPolarHBondContact O-CG1 3.32Å; L408-I412 PolarHBondContact O-N 3.31Å
409	H	94.3	Very high	90.9	Very high	128 Å²	128	96 Å²	96	59%	0.593	49%	0.486	S	S	*	.	H	α-helix	trans	-60.8	-42.2	176.9	-177.4	-87.8	0	0	0	111.9	Q405 R406 I412 S413	Q405-H409 WeakPolarHBondContact O-CB 3.48Å; Q405-H409 PolarHBondContact O-N 2.9Å; R406-H409 PolarHBondContact O-N 2.88Å; H409-I412 PolarHBondContact O-N 2.95Å; H409-S413 PolarHBondContact CE1-OG 3.45Å; H409-S413 VanDerWaalsContact O-CB 3.23Å; H409-S413 WeakPolarHBondContact O-CB 3.28Å; H409-S413 PolarHBondContact O-N 2.95Å; H409-S413 PolarHBondContact O-OG 2.89Å
410	E	93.1	Very high	90.1	Very high	94 Å²	94	93.3 Å²	93.3	44%	0.439	49%	0.485	S	S	.	.	H	α-helix	trans	-63.5	-43.2	175.7	-172	-177.3	163.2	0	0	111.5	R406 N407 L408 S413 K414	R406-E410 WeakPolarHBondContact O-CB 3.34Å; R406-E410 PolarHBondContact O-N 3.1Å; N407-E410 PolarHBondContact O-N 3.22Å; L408-E410 VanDerWaalsContact C-N 3.34Å; L408-E410 PolarHBondContact O-N 3.47Å; E410-S413 PolarHBondContact O-N 3.44Å; E410-K414 HydrophobicContact CG-CD 4.37Å; E410-K414 WeakPolarHBondContact O-CB 3.5Å; E410-K414 WeakPolarHBondContact O-CG 3.23Å; E410-K414 PolarHBondContact O-N 3.38Å; E410-K414 WeakPolarHBondContact OE1-CE 3.45Å; E410-K414 IonicContact OE1-NZ 2.64Å; E410-K414 PolarHBondContact OE1-NZ 3.28Å
411	T	93.3	Very high	88.9	Confident	93 Å²	93	92.7 Å²	92.7	57%	0.571	48%	0.484	S	S	*	.	H	α-helix	trans	-62.9	-46.2	178.1	-57.6	0	0	0	0	111.4	N407 L408 K414 A415	N407-T411 WeakPolarHBondContact O-CB 3.39Å; N407-T411 PolarHBondContact O-N 2.96Å; N407-T411 PolarHBondContact O-OG1 3.33Å; L408-T411 PolarHBondContact O-N 3.48Å; T411-K414 PolarHBondContact O-N 2.97Å; T411-A415 WeakPolarHBondContact O-CB 3.35Å; T411-A415 PolarHBondContact O-N 3.3Å
412	I	93.6	Very high	87.2	Confident	84 Å²	84	91.3 Å²	91.3	43%	0.431	49%	0.486	S	S	.	.	H	α-helix	trans	-63.7	-44	175.7	-67.9	174.3	0	0	0	110.4	L408 H409 K414 A415 I416	L408-I412 HydrophobicContact CD2-CD1 3.45Å; L408-I412 VanDerWaalsContact CD2-CD1 3.45Å; L408-I412 HydrophobicContact CD2-CG1 4.4Å; L408-I412 HydrophobicContact CG-CD1 4.07Å; L408-I412 WeakPolarHBondContact O-CG1 3.32Å; L408-I412 PolarHBondContact O-N 3.31Å; H409-I412 PolarHBondContact O-N 2.95Å; I412-K414 VanDerWaalsContact C-N 3.32Å; I412-K414 PolarHBondContact O-N 2.73Å; I412-A415 PolarHBondContact O-N 2.85Å; I412-I416 HydrophobicContact CG2-CD1 3.62Å; I412-I416 HydrophobicContact CG2-CG1 4.21Å; I412-I416 WeakPolarHBondContact O-CB 3.12Å; I412-I416 VanDerWaalsContact O-CG1 3.32Å; I412-I416 WeakPolarHBondContact O-CG1 2.98Å; I412-I416 PolarHBondContact O-N 2.87Å
413	S	92.2	Very high	85.5	Confident	44 Å²	44	95.5 Å²	95.5	31%	0.308	50%	0.501	S	S	.	.	H	α-helix	trans	-61	-41.1	178.4	-62.9	0	0	0	0	111.8	H409 E410 S417	H409-S413 PolarHBondContact CE1-OG 3.45Å; H409-S413 VanDerWaalsContact O-CB 3.23Å; H409-S413 WeakPolarHBondContact O-CB 3.28Å; H409-S413 PolarHBondContact O-N 2.95Å; H409-S413 PolarHBondContact O-OG 2.89Å; E410-S413 PolarHBondContact O-N 3.44Å; S413-S417 VanDerWaalsContact O-CB 3.29Å; S413-S417 WeakPolarHBondContact O-CB 3.47Å; S413-S417 PolarHBondContact O-N 3.14Å; S413-S417 PolarHBondContact O-OG 3.37Å
414	K	89	Confident	83.8	Confident	117 Å²	117	99.6 Å²	99.6	51%	0.509	52%	0.521	S	S	.	.	H	α-helix	trans	-63.9	-45.7	173.7	-75.9	176.1	-176.3	168.7	0	111.6	E410 T411 I412 S417 Q418	E410-K414 HydrophobicContact CG-CD 4.37Å; E410-K414 WeakPolarHBondContact O-CB 3.5Å; E410-K414 WeakPolarHBondContact O-CG 3.23Å; E410-K414 PolarHBondContact O-N 3.38Å; E410-K414 WeakPolarHBondContact OE1-CE 3.45Å; E410-K414 IonicContact OE1-NZ 2.64Å; E410-K414 PolarHBondContact OE1-NZ 3.28Å; T411-K414 PolarHBondContact O-N 2.97Å; I412-K414 VanDerWaalsContact C-N 3.32Å; I412-K414 PolarHBondContact O-N 2.73Å; K414-S417 PolarHBondContact O-N 2.81Å; K414-Q418 WeakPolarHBondContact O-CG 3.36Å; K414-Q418 PolarHBondContact O-N 2.99Å
415	A	87.2	Confident	81.9	Confident	48 Å²	48	104.8 Å²	104.8	40%	0.397	53%	0.533	S	S	.	.	H	α-helix	trans	-61.6	-46.3	177.6	0	0	0	0	0	111.9	T411 I412 S417 Q418 C419	T411-A415 WeakPolarHBondContact O-CB 3.35Å; T411-A415 PolarHBondContact O-N 3.3Å; I412-A415 PolarHBondContact O-N 2.85Å; A415-S417 PolarHBondContact O-N 3.47Å; A415-Q418 PolarHBondContact O-N 2.85Å; A415-C419 PolarHBondContact O-N 3.06Å; A415-C419 PolarHBondContact O-SG 2.86Å
416	I	88.6	Confident	79.4	Confident	97 Å²	97	111.7 Å²	111.7	50%	0.497	57%	0.573	S	S	.	*	H	α-helix	trans	-61.8	-44.9	176	-67.6	170.8	0	0	0	110.5	I412 Q418 C419 V420	I412-I416 HydrophobicContact CG2-CD1 3.62Å; I412-I416 HydrophobicContact CG2-CG1 4.21Å; I412-I416 WeakPolarHBondContact O-CB 3.12Å; I412-I416 VanDerWaalsContact O-CG1 3.32Å; I412-I416 WeakPolarHBondContact O-CG1 2.98Å; I412-I416 PolarHBondContact O-N 2.87Å; I416-Q418 VanDerWaalsContact C-N 3.31Å; I416-Q418 PolarHBondContact O-N 2.85Å; I416-C419 WeakPolarHBondContact O-CB 3.36Å; I416-C419 PolarHBondContact O-N 2.86Å; I416-C419 VanDerWaalsContact O-N 3.1Å; I416-V420 HydrophobicContact CG2-CG2 4.23Å; I416-V420 WeakPolarHBondContact O-CG2 3.29Å; I416-V420 PolarHBondContact O-N 3.04Å
417	S	83.4	Confident	78.8	Confident	64 Å²	64	108.5 Å²	108.5	45%	0.448	57%	0.568	S	S	.	*	H	α-helix	trans	-60.1	-41.4	178.7	-61.3	0	0	0	0	111.6	S413 K414 A415 V420 I421	S413-S417 VanDerWaalsContact O-CB 3.29Å; S413-S417 WeakPolarHBondContact O-CB 3.47Å; S413-S417 PolarHBondContact O-N 3.14Å; S413-S417 PolarHBondContact O-OG 3.37Å; K414-S417 PolarHBondContact O-N 2.81Å; A415-S417 PolarHBondContact O-N 3.47Å; S417-V420 PolarHBondContact O-N 3.37Å; S417-I421 WeakPolarHBondContact O-CD1 3.45Å; S417-I421 WeakPolarHBondContact O-CG1 3.22Å; S417-I421 PolarHBondContact O-N 3.3Å
418	Q	80.8	Confident	78	Confident	135 Å²	135	109.3 Å²	109.3	63%	0.631	57%	0.572	S	S	*	*	H	α-helix	trans	-64.1	-40.5	173.7	-71.1	175.7	-0.3	0	0	112.1	K414 A415 I416 V420 T422	K414-Q418 WeakPolarHBondContact O-CG 3.36Å; K414-Q418 PolarHBondContact O-N 2.99Å; A415-Q418 PolarHBondContact O-N 2.85Å; I416-Q418 VanDerWaalsContact C-N 3.31Å; I416-Q418 PolarHBondContact O-N 2.85Å; Q418-V420 VanDerWaalsContact C-N 3.34Å; Q418-V420 PolarHBondContact O-N 3.44Å; Q418-T422 WeakPolarHBondContact O-CB 3.27Å; Q418-T422 VanDerWaalsContact O-CG2 3.27Å; Q418-T422 WeakPolarHBondContact O-CG2 3.45Å; Q418-T422 PolarHBondContact O-N 3.34Å; Q418-T422 VanDerWaalsContact O-N 3.08Å; Q418-T422 PolarHBondContact O-OG1 2.89Å
419	C	77.9	Confident	77.1	Confident	77 Å²	77	110.4 Å²	110.4	52%	0.52	58%	0.578	S	S	.	*	H	α-helix	trans	-66.1	-32.7	175.7	-67.8	0	0	0	0	113.4	A415 I416 T422	A415-C419 PolarHBondContact O-N 3.06Å; A415-C419 PolarHBondContact O-SG 2.86Å; I416-C419 WeakPolarHBondContact O-CB 3.36Å; I416-C419 PolarHBondContact O-N 2.86Å; I416-C419 VanDerWaalsContact O-N 3.1Å; C419-T422 WeakPolarHBondContact CA-OG1 3.44Å; C419-T422 PolarHBondContact O-OG1 3.08Å
420	V	76	Confident	76.1	Confident	85 Å²	85	109.4 Å²	109.4	52%	0.515	58%	0.577	S	S	.	*	H	α-helix	trans	-75.7	-43.8	178	173.7	0	0	0	0	110.7	I416 S417 Q418 T422 K423	I416-V420 HydrophobicContact CG2-CG2 4.23Å; I416-V420 WeakPolarHBondContact O-CG2 3.29Å; I416-V420 PolarHBondContact O-N 3.04Å; S417-V420 PolarHBondContact O-N 3.37Å; Q418-V420 VanDerWaalsContact C-N 3.34Å; Q418-V420 PolarHBondContact O-N 3.44Å; V420-T422 VanDerWaalsContact C-N 3.33Å; V420-T422 PolarHBondContact O-N 3Å; V420-K423 PolarHBondContact O-N 3.46Å
421	I	67.5	Low	75	Confident	102 Å²	102	110.4 Å²	110.4	52%	0.523	59%	0.585	S	S	.	*	H	α-helix	trans	-64.6	-39.6	179.5	-64	163.9	0	0	0	110.6	S417 K423 N424 Y425	S417-I421 WeakPolarHBondContact O-CD1 3.45Å; S417-I421 WeakPolarHBondContact O-CG1 3.22Å; S417-I421 PolarHBondContact O-N 3.3Å; I421-K423 VanDerWaalsContact C-N 3.3Å; I421-K423 PolarHBondContact O-N 3.38Å; I421-N424 PolarHBondContact O-N 3.33Å; I421-Y425 HydrophobicContact CG2-CD2 4.48Å; I421-Y425 HydrophobicContact CG2-CE2 3.98Å; I421-Y425 WeakPolarHBondContact O-CD2 3.33Å
422	T	60	Low	73.8	Confident	96 Å²	96	111.5 Å²	111.5	59%	0.589	59%	0.586	S	S	*	*	H	α-helix	trans	-67.5	-24.6	-178.9	47.1	0	0	0	0	114.2	Q418 C419 V420	Q418-T422 WeakPolarHBondContact O-CB 3.27Å; Q418-T422 VanDerWaalsContact O-CG2 3.27Å; Q418-T422 WeakPolarHBondContact O-CG2 3.45Å; Q418-T422 PolarHBondContact O-N 3.34Å; Q418-T422 VanDerWaalsContact O-N 3.08Å; Q418-T422 PolarHBondContact O-OG1 2.89Å; C419-T422 WeakPolarHBondContact CA-OG1 3.44Å; C419-T422 PolarHBondContact O-OG1 3.08Å; V420-T422 VanDerWaalsContact C-N 3.33Å; V420-T422 PolarHBondContact O-N 3Å
423	K	57.1	Low	72.4	Confident	170 Å²	170	113.5 Å²	113.5	74%	0.739	60%	0.598	S	S	*	*	H	α-helix	trans	-79.4	-18.6	178.8	-77.6	-174.6	178.1	-179.4	0	114.6	V420 I421	V420-K423 PolarHBondContact O-N 3.46Å; I421-K423 VanDerWaalsContact C-N 3.3Å; I421-K423 PolarHBondContact O-N 3.38Å
424	N	57.7	Low	70.8	Confident	134 Å²	134	118.8 Å²	118.8	72%	0.717	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	3.6	-178	-77.4	-21.1	0	0	0	114.2	I421	I421-N424 PolarHBondContact O-N 3.33Å
425	Y	53	Low	69.3	Low	191 Å²	191	119 Å²	119	75%	0.749	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.4	25.6	-179	-75.6	-74.4	0	0	0	114.6	I421	I421-Y425 HydrophobicContact CG2-CD2 4.48Å; I421-Y425 HydrophobicContact CG2-CE2 3.98Å; I421-Y425 WeakPolarHBondContact O-CD2 3.33Å
426	N	42.8	Very low	67.7	Low	229 Å²	229	125.5 Å²	125.5	100%	1.225	65%	0.65	S	S	*	*			trans	-119.4	0	171.4	-87.8	-17.1	0	0	0	112.6

Retrieved 426 of 426 residues in 250 ms (Link to these results)

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