G4VTQ6_SCHMA Loading...

WW domain-containing protein

AlphaFold DB , UniProt , Accession G4VTQ6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 721 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.7	Very low	39.9	Very low	239 Å²	239	179.1 Å²	179.1	100%	1.177	85%	0.852	S	S	*	*				0	129.7	0	-50.5	178.3	93.2	0	0	106.4
2	S	33.7	Very low	39.4	Very low	113 Å²	113	173.3 Å²	173.3	79%	0.79	84%	0.837	S	S	*	*			cis	149.1	135.9	-5.9	-85.9	0	0	0	0	104.4
3	S	37.5	Very low	39.3	Very low	110 Å²	110	164.8 Å²	164.8	77%	0.769	80%	0.801	S	S	*	*			trans	66.6	119.2	-178.5	-166.2	0	0	0	0	117.4
4	R	49.1	Very low	39.1	Very low	248 Å²	248	161.8 Å²	161.8	94%	0.936	79%	0.791	S	S	*	*			trans	-149.7	143.7	133.3	-109.1	174.2	-168.7	-162.8	1.3	109
5	H	46.3	Very low	39.1	Very low	165 Å²	165	159.1 Å²	159.1	76%	0.764	78%	0.782	S	S	*	*			trans	-84	168.5	-171.8	-102.6	-74.4	0	0	0	113.8
6	D	37.9	Very low	39.1	Very low	131 Å²	131	157.8 Å²	157.8	70%	0.701	77%	0.773	S	S	*	*			trans	-31.5	150.4	166.5	-50.7	-97	0	0	0	117.1
7	R	46.5	Very low	38.8	Very low	246 Å²	246	153 Å²	153	93%	0.928	77%	0.774	S	S	*	*				-159.4	138.5	125.6	-112.3	170.8	-170.7	-174.3	2.4	112.3
8	D	37.6	Very low	38.4	Very low	146 Å²	146	153.7 Å²	153.7	78%	0.781	78%	0.778	S	S	*	*			trans	-58.4	149.7	174.3	-57.7	-102.5	0	0	0	113.6
9	R	40.3	Very low	38.2	Very low	249 Å²	249	150.6 Å²	150.6	94%	0.94	78%	0.779	S	S	*	*				-155.8	132.5	127.7	-113.6	165	-174.7	179.8	0.2	111.9
10	R	34.4	Very low	37.8	Very low	242 Å²	242	148.9 Å²	148.9	91%	0.913	78%	0.78	S	S	*	*			trans	-79.8	146.2	177.3	-59.8	177.8	178.7	-149.3	-1	111.1
11	A	35.2	Very low	37.5	Very low	81 Å²	81	147.4 Å²	147.4	67%	0.669	78%	0.781	S	S	*	*			trans	-151.1	127.7	148.3	0	0	0	0	0	108.4
12	T	33.1	Very low	37	Very low	110 Å²	110	142.9 Å²	142.9	68%	0.675	77%	0.767	S	S	*	*			trans	-78.8	176.7	165.3	40.7	0	0	0	0	109.2	R721	T12-R721 WeakPolarHBondContact O-CB 3.22Å
13	V	39	Very low	37	Very low	62 Å²	62	143.2 Å²	143.2	38%	0.376	76%	0.764	S	S	.	*				-165.8	160.3	61.7	-178.3	0	0	0	0	110.3	R720 R721	V13-R720 CarbonylContact O-C 3.54Å; V13-R721 PolarHBondContact N-O 3.13Å; V13-R721 CarbonylContact O-C 3.55Å; V13-R721 VanDerWaalsContact O-C 3.28Å; V13-R721 PolarHBondContact O-N 3.09Å; V13-R721 VanDerWaalsContact O-O 3.13Å
14	D	36.4	Very low	36.8	Very low	123 Å²	123	145.5 Å²	145.5	66%	0.658	76%	0.763	S	S	*	*			trans	-91.1	161.5	-175.5	-57	-85.6	0	0	0	116	R720	D14-R720 WeakPolarHBondContact O-CA 3.4Å; D14-R720 PolarHBondContact O-N 3.38Å
15	D	38.8	Very low	36.1	Very low	121 Å²	121	145 Å²	145	65%	0.647	76%	0.762	S	S	*	*				107	159.2	127	-129.3	-7.9	0	0	0	124.1	R720	D15-R720 WeakPolarHBondContact O-CG 3.46Å; D15-R720 PolarHBondContact O-NE 3.43Å
16	E	38.6	Very low	35.7	Very low	138 Å²	138	142.3 Å²	142.3	65%	0.645	76%	0.757	S	S	*	*			trans	69	141	164	-62.5	-149.4	125.7	0	0	122.1	R720	E16-R720 PolarHBondContact O-NH2 2.89Å
17	G	34.2	Very low	35.3	Very low	77 Å²	77	142.8 Å²	142.8	79%	0.794	76%	0.76	S	S	*	*			trans	146.7	78.9	173.9	0	0	0	0	0	114.8
18	I	32.8	Very low	34.9	Very low	165 Å²	165	136.8 Å²	136.8	85%	0.846	75%	0.751	S	S	*	*			trans	-82	141.6	-176.5	-61.1	169.1	0	0	0	112.9
19	A	34.4	Very low	34.8	Very low	96 Å²	96	136.8 Å²	136.8	79%	0.793	75%	0.751	S	S	*	*			trans	-144.9	127.4	151.5	0	0	0	0	0	110.2
20	S	29	Very low	34.7	Very low	115 Å²	115	130 Å²	130	80%	0.804	74%	0.742	S	S	*	*			trans	-98.5	129.7	176.6	59.9	0	0	0	0	111.5
21	C	32.7	Very low	35	Very low	119 Å²	119	124.8 Å²	124.8	80%	0.804	74%	0.737	S	S	*	*			trans	-127.9	125.4	171	-69.7	0	0	0	0	109.4
22	V	29.6	Very low	35.3	Very low	144 Å²	144	126.5 Å²	126.5	87%	0.873	74%	0.741	S	S	*	*			trans	-77.8	133.4	169.8	176	0	0	0	0	108.4
23	T	34.7	Very low	35.6	Very low	119 Å²	119	132.9 Å²	132.9	73%	0.73	75%	0.752	S	S	*	*			trans	-131	114.6	171.3	-48.6	0	0	0	0	110
24	E	33	Very low	35.4	Very low	159 Å²	159	138.2 Å²	138.2	74%	0.743	77%	0.773	S	S	*	*			trans	-72	135.1	171.8	-59	173.3	118.6	0	0	110.1	V26	E24-V26 HydrophobicContact CB-CG2 4.4Å; E24-V26 PolarHBondContact O-N 2.95Å; E24-V26 VanDerWaalsContact O-N 3.11Å
25	Y	33.2	Very low	35.4	Very low	236 Å²	236	142.6 Å²	142.6	93%	0.925	79%	0.787	S	S	*	*			trans	-82.7	88	166.7	-101.2	-82.4	0	0	0	110
26	V	37.3	Very low	35.2	Very low	109 Å²	109	141.8 Å²	141.8	66%	0.661	79%	0.791	S	S	*	*			trans	-62.6	142.2	177.2	175.8	0	0	0	0	111.1	E24	E24-V26 HydrophobicContact CB-CG2 4.4Å; E24-V26 PolarHBondContact O-N 2.95Å; E24-V26 VanDerWaalsContact O-N 3.11Å
27	N	31.2	Very low	35	Very low	142 Å²	142	147 Å²	147	76%	0.759	81%	0.805	S	S	*	*			trans	-66.7	128.1	178.3	-168.5	33.1	0	0	0	111.2
28	V	37.2	Very low	35.2	Very low	120 Å²	120	148.4 Å²	148.4	73%	0.727	80%	0.802	S	S	*	*			trans	-102.3	92.1	-177.4	-176.5	0	0	0	0	110.6	S30	V28-S30 PolarHBondContact O-N 2.8Å
29	D	35.1	Very low	35.2	Very low	146 Å²	146	149.2 Å²	149.2	78%	0.781	80%	0.803	S	S	*	*			trans	-61.1	129	168.8	-98.7	-48.1	0	0	0	111.1
30	S	38.8	Very low	35.2	Very low	107 Å²	107	151.1 Å²	151.1	75%	0.748	80%	0.804	S	S	*	*			trans	-112.9	113.5	178.8	-67.7	0	0	0	0	110.4	V28	V28-S30 PolarHBondContact O-N 2.8Å
31	T	40.1	Very low	35.6	Very low	132 Å²	132	152.8 Å²	152.8	81%	0.81	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-79.4	134.7	-165.7	-8.8	0	0	0	0	113.1
32	P	42.3	Very low	36	Very low	117 Å²	117	152.9 Å²	152.9	76%	0.76	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-76.3	122.9	166.2	30.6	-32	0	0	0	110.3
33	R	38.8	Very low	36.3	Very low	243 Å²	243	151.5 Å²	151.5	92%	0.917	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-73.2	138	173.1	-82.5	-172.3	169.9	-160.5	-2.3	111.4
34	Q	34.9	Very low	36.7	Very low	175 Å²	175	149.7 Å²	149.7	82%	0.818	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-70.4	149.9	171	-65.1	174.1	-23.2	0	0	111.8
35	F	37.8	Very low	36.8	Very low	214 Å²	214	151.1 Å²	151.1	94%	0.939	81%	0.81	S	S	*	*			trans	-138.9	134.9	152.4	-105.8	-82.2	0	0	0	108.6
36	S	34.7	Very low	37	Very low	105 Å²	105	145.8 Å²	145.8	73%	0.734	81%	0.807	S	S	*	*			trans	-144.4	107.9	-166.9	47.6	0	0	0	0	113.3
37	R	34	Very low	36.8	Very low	247 Å²	247	149.6 Å²	149.6	93%	0.932	82%	0.818	S	S	*	*			trans	-172	143.2	164.1	-119.4	175.4	166.3	-176.2	-4.1	108.4
38	S	37.1	Very low	36.9	Very low	106 Å²	106	151.5 Å²	151.5	74%	0.741	83%	0.827	S	S	*	*			cis	-148.2	172.1	-7.2	-144.3	0	0	0	0	110.1
39	Q	33	Very low	36.6	Very low	183 Å²	183	150.5 Å²	150.5	86%	0.855	83%	0.825	S	S	*	*			trans	-70.3	155.9	175.2	-60.5	168	-10.9	0	0	113
40	V	35.8	Very low	36.5	Very low	135 Å²	135	150.4 Å²	150.4	82%	0.818	83%	0.83	S	S	*	*				-163.6	142.8	122.9	141.3	0	0	0	0	108.7
41	I	36.3	Very low	36.3	Very low	151 Å²	151	153.6 Å²	153.6	77%	0.774	83%	0.833	S	S	*	*			trans	-132.8	144.7	171.2	-58.5	165.8	0	0	0	106.7
42	P	42	Very low	35.9	Very low	120 Å²	120	152.9 Å²	152.9	78%	0.779	83%	0.831	S	S	*	*			trans	-131.3	149.7	133.4	35.6	-26.6	0	0	0	113
43	S	35.8	Very low	35.9	Very low	115 Å²	115	153.5 Å²	153.5	80%	0.804	84%	0.835	S	S	*	*			trans	-86.9	152.8	-176	-49.9	0	0	0	0	112.7
44	G	43.1	Very low	35.7	Very low	81 Å²	81	149.7 Å²	149.7	84%	0.835	83%	0.832	S	S	*	*			trans	-136.6	119	166.4	0	0	0	0	0	110.5
45	Q	35.3	Very low	35.3	Very low	189 Å²	189	147.1 Å²	147.1	88%	0.883	83%	0.832	S	S	*	*			trans	-92.4	145.7	178.2	-63.6	177.3	-4.1	0	0	111.1
46	S	37.1	Very low	35.3	Very low	125 Å²	125	142.8 Å²	142.8	87%	0.874	83%	0.825	S	S	*	*				-163.9	142.6	128.7	-83.9	0	0	0	0	110.6
47	Q	33.5	Very low	35.1	Very low	188 Å²	188	146.2 Å²	146.2	88%	0.879	83%	0.83	S	S	*	*			trans	-94.6	151.9	174	-55.5	172	7	0	0	109.3
48	L	33.4	Very low	35.1	Very low	183 Å²	183	141.9 Å²	141.9	96%	0.958	82%	0.823	S	S	*	*			trans	-159.8	150.9	134.8	-112.5	148.8	0	0	0	110.8
49	S	29.3	Very low	34.7	Very low	98 Å²	98	141.9 Å²	141.9	69%	0.685	82%	0.823	S	S	*	*			trans	-118.3	142.1	-169.1	174.6	0	0	0	0	110.8
50	T	34.4	Very low	34.8	Very low	144 Å²	144	144.2 Å²	144.2	88%	0.883	82%	0.824	S	S	*	*			trans	-151.3	143.5	149.1	-9.9	0	0	0	0	111.8
51	Q	33.1	Very low	34.6	Very low	174 Å²	174	145 Å²	145	81%	0.813	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-90.3	162.5	176.3	-80.6	-179.2	-27.8	0	0	112.3
52	P	32.8	Very low	34.7	Very low	117 Å²	117	146.3 Å²	146.3	76%	0.76	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-81.9	149.6	174.3	34.1	-35.5	0	0	0	112.8
53	P	42.7	Very low	34.4	Very low	130 Å²	130	145.8 Å²	145.8	84%	0.844	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-88.7	157.7	171	35.2	-33.7	0	0	0	113.2
54	L	34	Very low	34.6	Very low	163 Å²	163	148.3 Å²	148.3	85%	0.853	83%	0.827	S	S	*	*			trans	-115.3	144.1	176.1	-79.5	160.7	0	0	0	110.9
55	C	27.1	Very low	34.3	Very low	122 Å²	122	151 Å²	151	82%	0.824	82%	0.822	S	S	*	*			trans	65.5	174.5	157.2	-85.7	0	0	0	0	116.3
56	P	36.6	Very low	34.3	Very low	122 Å²	122	148.5 Å²	148.5	79%	0.792	82%	0.824	S	S	*	*			cis	-127.1	-172.9	12	43.2	-27.4	0	0	0	116.8
57	Q	30.2	Very low	34.2	Very low	178 Å²	178	145.7 Å²	145.7	83%	0.832	82%	0.815	S	S	*	*			trans	-68	149.3	178.8	-56.8	169.2	-33.8	0	0	113.6
58	I	34.7	Very low	34.3	Very low	155 Å²	155	144.3 Å²	144.3	80%	0.795	81%	0.813	S	S	*	*			trans	-141.9	125.2	144.4	-61.2	-175.3	0	0	0	108.6	R60	I58-R60 HydrophobicContact CG2-CG 4.49Å
59	S	28.2	Very low	34.3	Very low	107 Å²	107	139.6 Å²	139.6	75%	0.748	80%	0.8	S	S	*	*			trans	-86.9	142.1	165.1	-59.7	0	0	0	0	110.6
60	R	35.4	Very low	34.5	Very low	232 Å²	232	141 Å²	141	88%	0.875	81%	0.808	S	S	*	*			trans	-144.2	123	155.4	-75.6	-165.4	174.2	151.3	1.6	110.7	I58	I58-R60 HydrophobicContact CG2-CG 4.49Å
61	D	32.5	Very low	34.6	Very low	150 Å²	150	139 Å²	139	80%	0.802	80%	0.801	S	S	*	*			trans	-72.3	144.1	169.9	-46.4	-91.4	0	0	0	110.7
62	L	38.1	Very low	34.7	Very low	179 Å²	179	137.2 Å²	137.2	94%	0.937	80%	0.802	S	S	*	*			trans	-134.2	113.2	150.2	-84.5	-178	0	0	0	109.6
63	N	35.8	Very low	34.9	Very low	110 Å²	110	140.3 Å²	140.3	59%	0.588	80%	0.803	S	S	*	*			trans	-71.1	146.5	176.4	176.8	16.4	0	0	0	111.2
64	N	40.1	Very low	34.6	Very low	168 Å²	168	140.8 Å²	140.8	90%	0.898	80%	0.799	S	S	*	*			trans	-152.2	109.4	154.1	-94.9	-36.8	0	0	0	109.9
65	N	36.2	Very low	34.9	Very low	138 Å²	138	139.2 Å²	139.2	74%	0.738	79%	0.79	S	S	*	*			trans	-94.7	150.9	178.1	-78.6	-32.2	0	0	0	112.3
66	C	34.1	Very low	35	Very low	136 Å²	136	140.9 Å²	140.9	92%	0.919	79%	0.791	S	S	*	*			trans	171.1	124.1	146.3	-90.8	0	0	0	0	104.9
67	G	35.8	Very low	35.3	Very low	66 Å²	66	144.6 Å²	144.6	68%	0.68	80%	0.795	S	S	*	*			cis	104.8	130.6	45.5	0	0	0	0	0	107
68	D	36	Very low	35.5	Very low	159 Å²	159	144.7 Å²	144.7	85%	0.85	79%	0.792	S	S	*	*			cis	-147.9	142.8	2.4	-82.2	-49.5	0	0	0	107.2
69	A	32.8	Very low	35.8	Very low	83 Å²	83	142.5 Å²	142.5	69%	0.686	79%	0.791	S	S	*	*				89.5	144.1	60.4	0	0	0	0	0	114.6
70	C	34	Very low	36.2	Very low	127 Å²	127	145.8 Å²	145.8	86%	0.858	79%	0.794	S	S	*	*			trans	68.4	133.1	-176.7	-63.8	0	0	0	0	115.9
71	S	36.8	Very low	36.3	Very low	104 Å²	104	137.6 Å²	137.6	73%	0.727	78%	0.781	S	S	*	*			cis	-157.1	177.9	1.6	-88.9	0	0	0	0	108.4
72	T	35.8	Very low	36.5	Very low	135 Å²	135	139.5 Å²	139.5	83%	0.828	79%	0.785	S	S	*	*			cis	-135.8	-120.9	18.3	-42.6	0	0	0	0	112.1
73	K	36.5	Very low	36.5	Very low	182 Å²	182	135.7 Å²	135.7	79%	0.791	77%	0.774	S	S	*	*			trans	-158.8	171.3	-168.5	-61.9	-174.7	-179.8	176.8	0	113.3
74	N	36.4	Very low	36.5	Very low	140 Å²	140	136.5 Å²	136.5	75%	0.749	78%	0.783	S	S	*	*			trans	95	140.6	157.8	-57.1	-16.5	0	0	0	117.3
75	I	39.2	Very low	36.1	Very low	130 Å²	130	133.4 Å²	133.4	67%	0.667	77%	0.774	S	S	*	*			cis	-154.4	145.6	-11.2	-111.6	160.9	0	0	0	108.2	F77	I75-F77 HydrophobicContact CG2-CD2 3.89Å; I75-F77 HydrophobicContact CG2-CE2 4.11Å
76	D	30.5	Very low	36.3	Very low	157 Å²	157	136 Å²	136	84%	0.84	78%	0.782	S	S	*	*			trans	-83.7	148.7	171.3	-81.1	-62.8	0	0	0	112.8
77	F	41.4	Very low	36.3	Very low	201 Å²	201	136.7 Å²	136.7	88%	0.882	78%	0.776	S	S	*	*			trans	-142.5	146.2	158.6	-101.1	-79.5	0	0	0	112.2	I75	I75-F77 HydrophobicContact CG2-CD2 3.89Å; I75-F77 HydrophobicContact CG2-CE2 4.11Å
78	K	35.2	Very low	36.3	Very low	179 Å²	179	141.5 Å²	141.5	78%	0.778	79%	0.786	S	S	*	*			trans	-148.7	123.1	-163.6	174.8	-175.3	175.1	-177.7	0	112.6
79	S	40.7	Very low	36	Very low	109 Å²	109	138.7 Å²	138.7	76%	0.762	78%	0.778	S	S	*	*			trans	-161.8	120.5	168.5	50.1	0	0	0	0	108.6
80	H	36.8	Very low	36.3	Very low	177 Å²	177	144 Å²	144	82%	0.819	79%	0.786	S	S	*	*				81.1	136.7	62.1	-85.2	-85.6	0	0	0	114.8
81	G	36.8	Very low	35.9	Very low	59 Å²	59	143.8 Å²	143.8	61%	0.608	78%	0.784	S	S	*	*			trans	110	104.3	-169.4	0	0	0	0	0	110.5
82	E	38.4	Very low	35.8	Very low	190 Å²	190	148 Å²	148	89%	0.888	79%	0.79	S	S	*	*				74.8	135.7	57.4	-62.3	179.2	138.8	0	0	112.9
83	S	37.8	Very low	35.4	Very low	99 Å²	99	148.3 Å²	148.3	69%	0.692	79%	0.785	S	S	*	*			cis	-170	158.1	-4.8	49	0	0	0	0	111.6
84	V	35.5	Very low	35.2	Very low	128 Å²	128	149.4 Å²	149.4	78%	0.776	79%	0.79	S	S	*	*			trans	48.5	106.8	146	173.8	0	0	0	0	117.8
85	S	31.5	Very low	34.9	Very low	103 Å²	103	147.2 Å²	147.2	72%	0.72	79%	0.786	S	S	*	*				66.1	115.3	73.7	169.4	0	0	0	0	116
86	E	40.4	Very low	34.6	Very low	191 Å²	191	149 Å²	149	89%	0.893	80%	0.797	S	S	*	*			trans	-166.1	153.9	133.8	-114.6	170.5	-160.3	0	0	113.1
87	D	33.2	Very low	34.6	Very low	151 Å²	151	149.2 Å²	149.2	81%	0.807	80%	0.795	S	S	*	*			trans	-81.1	158.2	175	-97.7	-55.8	0	0	0	112.1
88	L	35.9	Very low	34.5	Very low	168 Å²	168	145.4 Å²	145.4	88%	0.88	79%	0.79	S	S	*	*				177.7	154.5	119.2	-96.9	164.4	0	0	0	114
89	S	31.5	Very low	34.5	Very low	99 Å²	99	145.2 Å²	145.2	69%	0.692	79%	0.792	S	S	*	*			trans	-87.4	153.8	-178.5	57	0	0	0	0	113.8
90	K	37.3	Very low	34.4	Very low	195 Å²	195	147.2 Å²	147.2	85%	0.848	80%	0.8	S	S	*	*			trans	-162.3	130.8	154.5	-105.7	141.3	-169.4	170.2	0	111.7
91	C	27.2	Very low	34.5	Very low	122 Å²	122	142.5 Å²	142.5	82%	0.824	80%	0.799	S	S	*	*			trans	-84	146.8	170.5	-54.3	0	0	0	0	110.3
92	F	33.3	Very low	34.3	Very low	193 Å²	193	145.1 Å²	145.1	85%	0.846	81%	0.808	S	S	*	*			trans	-136.7	133.3	156.7	-95.6	-80.3	0	0	0	110.6
93	I	28.2	Very low	34.5	Very low	142 Å²	142	144.9 Å²	144.9	73%	0.728	80%	0.804	S	S	*	*			trans	-100.3	137.6	173.6	-64.9	165.9	0	0	0	107.1
94	F	32.6	Very low	34.5	Very low	204 Å²	204	148 Å²	148	90%	0.895	81%	0.807	S	S	*	*			trans	-143.9	137.9	147.1	-102.8	-72	0	0	0	111.5
95	S	28.9	Very low	34.6	Very low	94 Å²	94	147.8 Å²	147.8	66%	0.657	80%	0.801	S	S	*	*			trans	-86.5	160.4	-174.4	-48.3	0	0	0	0	112.2
96	N	33.8	Very low	34.8	Very low	169 Å²	169	152 Å²	152	90%	0.904	81%	0.807	S	S	*	*			trans	-158.8	142.9	130.8	-99.5	-34.7	0	0	0	112
97	M	30.1	Very low	34.6	Very low	160 Å²	160	146.2 Å²	146.2	79%	0.788	80%	0.798	S	S	*	*			trans	-143.2	150.7	179.6	-108.2	-82.9	-175.2	0	0	107.2
98	P	39.1	Very low	34.9	Very low	122 Å²	122	147.1 Å²	147.1	79%	0.792	80%	0.797	S	S	*	*			trans	-130.1	143.2	134.4	34.7	-25.8	0	0	0	112.7
99	Q	35.3	Very low	34.9	Very low	175 Å²	175	144.3 Å²	144.3	82%	0.818	78%	0.783	S	S	*	*			trans	-82.7	165.8	172	-59.6	172.7	-6.9	0	0	111.1
100	V	37.9	Very low	35.2	Very low	151 Å²	151	149.8 Å²	149.8	92%	0.915	79%	0.79	S	S	*	*				165.3	135.9	120.3	155.7	0	0	0	0	109.1
101	G	39.1	Very low	35.1	Very low	78 Å²	78	151.9 Å²	151.9	80%	0.804	79%	0.793	S	S	*	*			trans	152.2	49.2	172.4	0	0	0	0	0	117.2
102	S	32.6	Very low	35.3	Very low	114 Å²	114	152.3 Å²	152.3	80%	0.797	79%	0.792	S	S	*	*			trans	-107	135.7	-173.8	52.4	0	0	0	0	115.1
103	K	44.1	Very low	35.2	Very low	185 Å²	185	148.3 Å²	148.3	80%	0.804	79%	0.788	S	S	*	*			trans	-170.8	118.9	155.2	-101.4	154.4	-175.7	-177.2	0	108.2
104	Q	38.1	Very low	35.5	Very low	164 Å²	164	150.8 Å²	150.8	77%	0.766	80%	0.796	S	S	*	*				86.1	133.6	69.2	-84.8	-163.1	-34.1	0	0	113.4
105	I	36.1	Very low	35.6	Very low	123 Å²	123	146.7 Å²	146.7	63%	0.631	79%	0.793	S	S	*	*			cis	-147.6	169.2	-14.5	-48.9	103.8	0	0	0	108.6
106	F	37	Very low	35.7	Very low	193 Å²	193	148.6 Å²	148.6	85%	0.846	80%	0.8	S	S	*	*			trans	80.5	144.1	166.5	-65.6	-78.3	0	0	0	116.2
107	G	34.5	Very low	35.9	Very low	69 Å²	69	149.9 Å²	149.9	71%	0.711	80%	0.797	S	S	*	*			cis	123.2	129.6	12.5	0	0	0	0	0	108.8
108	E	40.4	Very low	36.1	Very low	170 Å²	170	153.2 Å²	153.2	79%	0.794	80%	0.801	S	S	*	*			cis	-145.3	169.3	15.1	-62.5	-170.6	107.3	0	0	113.3
109	N	36.7	Very low	36.1	Very low	109 Å²	109	153.6 Å²	153.6	58%	0.583	80%	0.803	S	S	*	*			trans	11.6	135.8	146.3	-47.9	-46.8	0	0	0	119.1
110	Y	37.2	Very low	36	Very low	214 Å²	214	150.2 Å²	150.2	84%	0.839	80%	0.799	S	S	*	*				-171.1	154.7	63.3	-98.8	-72.3	0	0	0	116
111	R	34.3	Very low	35.6	Very low	238 Å²	238	152.1 Å²	152.1	90%	0.898	80%	0.798	S	S	*	*			trans	69.2	95.4	146.7	-151.3	173	-127.8	-155.1	2.1	120.6
112	T	31.3	Very low	35.2	Very low	132 Å²	132	153.2 Å²	153.2	81%	0.81	79%	0.794	S	S	*	*			trans	-54.9	137.8	160	-31.1	0	0	0	0	113.7
113	S	32.1	Very low	35.1	Very low	108 Å²	108	155.1 Å²	155.1	76%	0.755	79%	0.793	S	S	*	*			trans	176.3	93.8	139.8	-81.4	0	0	0	0	112.8
114	H	34.1	Very low	34.5	Very low	195 Å²	195	151.4 Å²	151.4	90%	0.903	79%	0.789	S	S	*	*			trans	-136.8	126.2	158.8	-89.9	-75.6	0	0	0	110.7
115	S	35.2	Very low	34	Very low	118 Å²	118	150.9 Å²	150.9	83%	0.825	79%	0.791	S	S	*	*			trans	-83.5	136.3	-178.4	-176	0	0	0	0	111.2	K117	S115-K117 PolarHBondContact O-N 2.92Å
116	V	31.6	Very low	33.8	Very low	134 Å²	134	151.6 Å²	151.6	81%	0.812	80%	0.795	S	S	*	*			trans	-76.2	116.7	178.5	178.3	0	0	0	0	110
117	K	37	Very low	33.4	Very low	196 Å²	196	147.4 Å²	147.4	85%	0.852	79%	0.789	S	S	*	*			trans	-126.3	121.1	162.9	-95.8	-175	173	-179.7	0	110.6	S115	S115-K117 PolarHBondContact O-N 2.92Å
118	R	33.9	Very low	33.3	Very low	230 Å²	230	151.5 Å²	151.5	87%	0.868	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-69.3	138.2	169.9	-59	172.2	-179	150.2	-2.6	109.3
119	P	39.5	Very low	32.7	Very low	129 Å²	129	149 Å²	149	84%	0.838	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-74.2	118.9	153.8	30.8	-28.6	0	0	0	108.2
120	S	33.3	Very low	32.6	Very low	104 Å²	104	149.7 Å²	149.7	73%	0.727	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-78.2	138.3	169.5	51	0	0	0	0	110.2
121	E	28.5	Very low	32.3	Very low	191 Å²	191	143.9 Å²	143.9	89%	0.893	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-62.1	137.4	169.5	-58.9	179	147.8	0	0	110.6
122	S	32.2	Very low	32.5	Very low	102 Å²	102	142.7 Å²	142.7	71%	0.713	81%	0.807	S	S	*	*			trans	-135.8	105.5	172.1	58	0	0	0	0	111	C124	S122-C124 PolarHBondContact O-N 3.4Å
123	I	29.9	Very low	32.5	Very low	154 Å²	154	147.2 Å²	147.2	79%	0.79	81%	0.809	S	S	*	*			trans	-77	105.3	175.9	-61.9	168.9	0	0	0	108.6	L125	I123-L125 HydrophobicContact CG2-CG 4.28Å; I123-L125 PolarHBondContact O-N 3.18Å
124	C	30.6	Very low	32.8	Very low	107 Å²	107	150.1 Å²	150.1	72%	0.723	82%	0.816	S	S	*	*			trans	-91.7	87	173.1	-80.2	0	0	0	0	111.6	S122 I126	S122-C124 PolarHBondContact O-N 3.4Å; C124-I126 PolarHBondContact O-N 2.85Å
125	L	29	Very low	32.7	Very low	153 Å²	153	146.3 Å²	146.3	80%	0.801	81%	0.81	S	S	*	*			trans	-70.1	116	159.5	-71.4	169.9	0	0	0	109	I123	I123-L125 HydrophobicContact CG2-CG 4.28Å; I123-L125 PolarHBondContact O-N 3.18Å
126	I	31.8	Very low	32.8	Very low	138 Å²	138	146.9 Å²	146.9	71%	0.708	81%	0.813	S	S	*	*			trans	-108.3	97.4	172.2	-58.7	-179.1	0	0	0	109.2	C124	C124-I126 PolarHBondContact O-N 2.85Å
127	S	27.2	Very low	33	Very low	105 Å²	105	146 Å²	146	73%	0.734	81%	0.81	S	S	*	*			trans	-114.3	84.9	169.5	-62.7	0	0	0	0	109.5	S129	S127-S129 PolarHBondContact O-N 3.24Å
128	N	32.6	Very low	33	Very low	155 Å²	155	144 Å²	144	83%	0.829	81%	0.813	S	S	*	*			trans	-88.6	85.3	178.8	-81	-7.9	0	0	0	111.6
129	S	27.8	Very low	33	Very low	117 Å²	117	136.5 Å²	136.5	82%	0.818	81%	0.808	S	S	*	*			trans	-91.8	118.7	159	56.6	0	0	0	0	109.7	S127	S127-S129 PolarHBondContact O-N 3.24Å
130	S	35.5	Very low	32.7	Very low	124 Å²	124	138.5 Å²	138.5	87%	0.867	81%	0.806	S	S	*	*			trans	-136.7	126.2	168.8	-172.4	0	0	0	0	109.8
131	A	30.6	Very low	32.9	Very low	91 Å²	91	140.6 Å²	140.6	75%	0.752	81%	0.809	S	S	*	*			trans	-99.2	152	-174.6	0	0	0	0	0	111.6
132	K	38.5	Very low	33.3	Very low	213 Å²	213	139.5 Å²	139.5	93%	0.926	80%	0.804	S	S	*	*			trans	-131.9	130.1	152.6	-97.3	-178.6	175.2	178.4	0	109.6
133	R	31.9	Very low	33.6	Very low	227 Å²	227	141.2 Å²	141.2	86%	0.857	82%	0.815	S	S	*	*			trans	-85.8	153.9	173.8	-72.4	173.6	-87.3	165.1	-7.2	109.4
134	N	38.6	Very low	33.7	Very low	170 Å²	170	143.2 Å²	143.2	91%	0.909	82%	0.821	S	S	*	*			trans	-142.4	152.2	144.7	-101.8	-7.5	0	0	0	107.7
135	C	32.4	Very low	34	Very low	114 Å²	114	147.1 Å²	147.1	77%	0.77	83%	0.828	S	S	*	*			trans	-115.6	151.9	-168.9	-54	0	0	0	0	111.5
136	C	36.6	Very low	34.3	Very low	131 Å²	131	147.9 Å²	147.9	89%	0.885	83%	0.828	S	S	*	*			trans	-163.8	134.4	144.4	-101.2	0	0	0	0	109.4
137	P	36.2	Very low	34.3	Very low	115 Å²	115	145 Å²	145	75%	0.747	82%	0.82	S	S	*	*			trans	-110.8	-166.5	175.4	39.9	-30.4	0	0	0	112.9
138	V	35.6	Very low	34.8	Very low	153 Å²	153	148.6 Å²	148.6	93%	0.927	83%	0.825	S	S	*	*			trans	93.4	132.1	172.5	-172.5	0	0	0	0	115.9
139	G	35.1	Very low	34.8	Very low	73 Å²	73	148.9 Å²	148.9	75%	0.753	82%	0.821	S	S	*	*			trans	148.7	107.5	176.3	0	0	0	0	0	110.9
140	Q	31.9	Very low	35.4	Very low	171 Å²	171	149.2 Å²	149.2	80%	0.799	82%	0.821	S	S	*	*			trans	-106.1	164.3	173.6	-77.2	176.2	-113.6	0	0	110.6
141	D	38.8	Very low	35.1	Very low	148 Å²	148	148.2 Å²	148.2	79%	0.791	81%	0.813	S	S	*	*			trans	154.4	101.2	143.4	-75.2	-5	0	0	0	106.2
142	E	36.4	Very low	35.4	Very low	169 Å²	169	150 Å²	150	79%	0.79	82%	0.815	S	S	*	*				71.2	109.8	79.9	-72.3	-159	170.9	0	0	114.3
143	C	37.6	Very low	35.1	Very low	138 Å²	138	144.3 Å²	144.3	93%	0.932	80%	0.802	S	S	*	*			trans	-178	125.8	134.4	-99.9	0	0	0	0	109.5
144	E	32.4	Very low	35.3	Very low	196 Å²	196	140.3 Å²	140.3	92%	0.916	80%	0.798	S	S	*	*			trans	-103.1	140	170.8	-63.4	-178.7	107.2	0	0	110
145	E	37.9	Very low	35.2	Very low	189 Å²	189	139.4 Å²	139.4	88%	0.883	79%	0.793	S	S	*	*			trans	-169.4	159.3	150.3	-117.1	-172.9	163.5	0	0	110.5
146	Q	34.7	Very low	35.3	Very low	168 Å²	168	142.3 Å²	142.3	79%	0.785	80%	0.795	S	S	*	*				-151.4	142.2	-68.8	177.9	158.5	1.4	0	0	107.5
147	S	32.3	Very low	35.1	Very low	78 Å²	78	140.7 Å²	140.7	55%	0.545	78%	0.784	S	S	.	*			trans	-8.9	140.1	173.5	55.8	0	0	0	0	120.9
148	H	37.1	Very low	35	Very low	180 Å²	180	143 Å²	143	83%	0.833	79%	0.79	S	S	*	*				-177	128	108.6	-98.8	-68.2	0	0	0	114.7
149	E	33.7	Very low	34.6	Very low	161 Å²	161	140.9 Å²	140.9	75%	0.752	78%	0.782	S	S	*	*			trans	-96.9	165.1	144.1	-73.2	-159	153.7	0	0	109.1
150	P	39.4	Very low	34.7	Very low	125 Å²	125	145.8 Å²	145.8	81%	0.812	79%	0.79	S	S	*	*				-143.7	164.3	96	39	-24.9	0	0	0	115.8
151	S	29	Very low	34.9	Very low	102 Å²	102	141 Å²	141	71%	0.713	79%	0.787	S	S	*	*			trans	-98.4	138.7	174.8	-73.3	0	0	0	0	114.1
152	T	37.1	Very low	34.9	Very low	129 Å²	129	139 Å²	139	79%	0.791	79%	0.785	S	S	*	*			trans	-153.3	117.6	163.1	44.4	0	0	0	0	107.8
153	S	33.1	Very low	34.8	Very low	94 Å²	94	142.8 Å²	142.8	66%	0.657	79%	0.791	S	S	*	*				80.8	110	60.8	75.1	0	0	0	0	115.2
154	N	35.1	Very low	34.4	Very low	143 Å²	143	139.3 Å²	139.3	77%	0.765	78%	0.779	S	S	*	*				146.8	152.7	129.2	-80.9	-12.5	0	0	0	116.3
155	N	36.8	Very low	34.4	Very low	151 Å²	151	140.3 Å²	140.3	81%	0.807	78%	0.781	S	S	*	*			trans	70.7	117.4	162.9	-53.6	-22	0	0	0	116.7
156	H	33.9	Very low	34	Very low	174 Å²	174	138 Å²	138	81%	0.806	77%	0.774	S	S	*	*			cis	98.6	142.8	24.8	-159.9	-55.4	0	0	0	113.4
157	C	33.5	Very low	34.1	Very low	98 Å²	98	138 Å²	138	66%	0.662	78%	0.779	S	S	*	*			trans	80.5	142.6	-176.3	-59.8	0	0	0	0	114.8
158	D	33.9	Very low	33.9	Very low	162 Å²	162	139.5 Å²	139.5	87%	0.866	79%	0.79	S	S	*	*			cis	-136	168.3	5.8	-96.3	-48.1	0	0	0	113.4
159	S	27.6	Very low	33.8	Very low	109 Å²	109	137 Å²	137	76%	0.762	79%	0.793	S	S	*	*			trans	-148.4	119.4	177.3	178.6	0	0	0	0	112.7
160	L	37.4	Very low	33.6	Very low	177 Å²	177	135.7 Å²	135.7	93%	0.927	79%	0.786	S	S	*	*			trans	-153.7	109.2	171.6	-82.3	-176.1	0	0	0	114.1
161	G	34.8	Very low	33.4	Very low	70 Å²	70	138 Å²	138	72%	0.722	79%	0.79	S	S	*	*			trans	69.7	164.4	138.7	0	0	0	0	0	120.7
162	S	38.7	Very low	33.4	Very low	107 Å²	107	141.6 Å²	141.6	75%	0.748	79%	0.788	S	S	*	*			cis	-165.2	137.1	-9	-80.9	0	0	0	0	111.2
163	R	34.5	Very low	33.4	Very low	247 Å²	247	143.3 Å²	143.3	93%	0.932	79%	0.791	S	S	*	*			trans	62	143.8	162.8	-56.8	170.2	-179.7	179.7	-1.8	116.7
164	G	29	Very low	33.4	Very low	65 Å²	65	143.5 Å²	143.5	67%	0.67	80%	0.798	S	S	*	*			cis	115.7	100.4	-3.7	0	0	0	0	0	113.7
165	F	32.3	Very low	33.1	Very low	217 Å²	217	141.2 Å²	141.2	95%	0.952	80%	0.799	S	S	*	*			trans	-151.6	148.2	161.3	-97.9	-72.7	0	0	0	109.7
166	D	31.3	Very low	33.1	Very low	141 Å²	141	146.1 Å²	146.1	75%	0.754	81%	0.806	S	S	*	*			trans	-146	137.2	-176.1	176.3	16	0	0	0	108.5
167	L	35.5	Very low	33	Very low	168 Å²	168	149.1 Å²	149.1	88%	0.88	81%	0.81	S	S	*	*			trans	-152.9	99.6	177.8	-96.6	178	0	0	0	111.3
168	S	28.1	Very low	33.2	Very low	110 Å²	110	149.6 Å²	149.6	77%	0.769	81%	0.814	S	S	*	*			trans	-73.8	150.8	166.8	-69.2	0	0	0	0	112.2
169	S	34.7	Very low	33	Very low	128 Å²	128	150.1 Å²	150.1	90%	0.895	81%	0.812	S	S	*	*			trans	-144.1	138.1	154.4	54.4	0	0	0	0	110.8
170	E	29.5	Very low	33.3	Very low	133 Å²	133	149.1 Å²	149.1	62%	0.621	80%	0.804	S	S	*	*			trans	-127.9	125.5	-166.7	-177.3	-158.2	-179.7	0	0	109.4	R172	E170-R172 IonicContact OE1-CZ 3.17Å; E170-R172 IonicContact OE1-NE 2.69Å; E170-R172 PolarHBondContact OE1-NE 2.96Å; E170-R172 IonicContact OE1-NH2 2.78Å; E170-R172 PolarHBondContact OE1-NH2 2.88Å; E170-R172 IonicContact OE2-CZ 3.78Å; E170-R172 IonicContact OE2-NE 3.88Å; E170-R172 IonicContact OE2-NH2 3.3Å; E170-R172 PolarHBondContact OE2-NH2 3.4Å
171	I	35.2	Very low	33.2	Very low	173 Å²	173	148.5 Å²	148.5	89%	0.887	80%	0.797	S	S	*	*			trans	-132.8	121.1	170	-60.8	-175.9	0	0	0	110.5
172	R	29.6	Very low	33	Very low	178 Å²	178	150 Å²	150	67%	0.672	80%	0.796	S	S	*	*			trans	-94.9	167.7	174.4	-48.8	169.3	-167.2	155	12.9	109.1	E170	E170-R172 IonicContact OE1-CZ 3.17Å; E170-R172 IonicContact OE1-NE 2.69Å; E170-R172 PolarHBondContact OE1-NE 2.96Å; E170-R172 IonicContact OE1-NH2 2.78Å; E170-R172 PolarHBondContact OE1-NH2 2.88Å; E170-R172 IonicContact OE2-CZ 3.78Å; E170-R172 IonicContact OE2-NE 3.88Å; E170-R172 IonicContact OE2-NH2 3.3Å; E170-R172 PolarHBondContact OE2-NH2 3.4Å
173	I	37.4	Very low	32.6	Very low	165 Å²	165	152.8 Å²	152.8	85%	0.846	80%	0.802	S	S	*	*				170.3	130.9	122.9	-89.7	158.8	0	0	0	114
174	A	33.6	Very low	32.5	Very low	98 Å²	98	146.2 Å²	146.2	81%	0.81	79%	0.791	S	S	*	*			trans	57.4	142.7	153.5	0	0	0	0	0	122.8
175	A	27	Very low	32.8	Very low	95 Å²	95	151.3 Å²	151.3	79%	0.785	80%	0.802	S	S	*	*			trans	-116	172.9	168.8	0	0	0	0	0	111
176	R	37.8	Very low	32.5	Very low	254 Å²	254	144.9 Å²	144.9	96%	0.958	79%	0.789	S	S	*	*			trans	-135.3	146.9	161.1	-73.3	-166.3	173.5	-160.8	-2.1	111.1
177	R	32.2	Very low	32.7	Very low	237 Å²	237	146.6 Å²	146.6	89%	0.894	79%	0.792	S	S	*	*			trans	-104.8	144	179.8	-76.4	174.5	162.8	162.5	-9	111.3
178	S	36.3	Very low	32.3	Very low	107 Å²	107	145.2 Å²	145.2	75%	0.748	79%	0.785	S	S	*	*			trans	-177.2	122.1	149.2	55.5	0	0	0	0	106
179	E	31.3	Very low	32.6	Very low	174 Å²	174	148.5 Å²	148.5	81%	0.813	79%	0.793	S	S	*	*				51.5	128.3	58.2	-67.3	173.1	-163.3	0	0	111.5
180	S	32.9	Very low	32.3	Very low	87 Å²	87	147.8 Å²	147.8	61%	0.608	78%	0.784	S	S	*	*			cis	-165.6	-174	8.3	40.1	0	0	0	0	111.4
181	H	35.2	Very low	32.4	Very low	165 Å²	165	152.8 Å²	152.8	76%	0.764	80%	0.799	S	S	*	*			trans	74.8	94.4	160.3	-52.6	-55.1	0	0	0	120.9
182	S	30	Very low	32.2	Very low	100 Å²	100	148.8 Å²	148.8	70%	0.699	79%	0.791	S	S	*	*			trans	-7.8	135.7	131.6	54.7	0	0	0	0	119.5
183	L	32.2	Very low	32.4	Very low	167 Å²	167	148.5 Å²	148.5	87%	0.874	80%	0.802	S	S	*	*				-174.6	157.1	101.2	-92	173.3	0	0	0	110.8
184	P	31.6	Very low	32.1	Very low	109 Å²	109	144.5 Å²	144.5	71%	0.708	80%	0.802	S	S	*	*			trans	-101.4	155.7	-174.3	38.3	-33.2	0	0	0	114.1
185	L	34.2	Very low	31.9	Very low	172 Å²	172	146.1 Å²	146.1	90%	0.901	80%	0.802	S	S	*	*			trans	-148.1	149.5	156.6	-130.8	105.2	0	0	0	110.8
186	A	27.7	Very low	32.2	Very low	82 Å²	82	149 Å²	149	68%	0.678	80%	0.802	S	S	*	*			trans	-92	170.8	-174.1	0	0	0	0	0	113.1
187	H	33.9	Very low	32	Very low	177 Å²	177	143.9 Å²	143.9	82%	0.819	79%	0.794	S	S	*	*				-163.1	153.9	129.7	-101.8	-65.1	0	0	0	111.8
188	N	27.9	Very low	31.9	Very low	139 Å²	139	141 Å²	141	74%	0.743	79%	0.79	S	S	*	*			trans	-73	156.9	-169.4	-55.2	-51	0	0	0	114.3
189	L	33.5	Very low	31.9	Very low	179 Å²	179	145.7 Å²	145.7	94%	0.937	80%	0.798	S	S	*	*			trans	-149.8	128	131.7	-111.3	172.2	0	0	0	110
190	T	28.2	Very low	32.2	Very low	112 Å²	112	142.9 Å²	142.9	69%	0.687	80%	0.795	S	S	*	*			trans	-99	132.6	-169.4	-52.1	0	0	0	0	111.6
191	Y	33.2	Very low	32.2	Very low	239 Å²	239	147.1 Å²	147.1	94%	0.937	81%	0.81	S	S	*	*			trans	-143.7	139.3	150.7	-109.7	-85.1	0	0	0	109.1
192	A	29.7	Very low	32.3	Very low	89 Å²	89	142.8 Å²	142.8	74%	0.736	81%	0.81	S	S	*	*			trans	-103.7	131.5	-165.8	0	0	0	0	0	113.2
193	L	34.5	Very low	32.4	Very low	171 Å²	171	142.8 Å²	142.8	90%	0.895	82%	0.816	S	S	*	*			trans	-133.3	142.5	155	-81.8	173	0	0	0	108.2
194	G	32	Very low	32.5	Very low	82 Å²	82	142 Å²	142	85%	0.845	81%	0.812	S	S	*	*			trans	-78.1	142.8	-171.1	0	0	0	0	0	113.7
195	V	27.7	Very low	32.6	Very low	132 Å²	132	145.7 Å²	145.7	80%	0.8	82%	0.817	S	S	*	*			trans	-103.9	121.2	179.2	177.2	0	0	0	0	110.9
196	I	34.6	Very low	32.5	Very low	154 Å²	154	146.3 Å²	146.3	79%	0.79	82%	0.82	S	S	*	*			trans	-152	125.7	161.6	-51.6	179.6	0	0	0	104.7
197	N	32.7	Very low	33	Very low	147 Å²	147	151.1 Å²	151.1	79%	0.786	83%	0.826	S	S	*	*			cis	-142.5	160.8	-2.8	-113.3	-6.4	0	0	0	108.9
198	E	31.5	Very low	33.1	Very low	177 Å²	177	151.8 Å²	151.8	83%	0.827	83%	0.829	S	S	*	*			trans	-77.5	152.7	169.8	-60.9	179.1	152.6	0	0	112.2
199	F	35.8	Very low	33.4	Very low	206 Å²	206	151.8 Å²	151.8	90%	0.904	83%	0.829	S	S	*	*			trans	-140.3	130.9	152.5	-115.1	-88.3	0	0	0	108
200	P	38	Very low	33.6	Very low	115 Å²	115	153.1 Å²	153.1	75%	0.747	83%	0.827	S	S	*	*			trans	-83.8	158.9	-168.1	33	-36.9	0	0	0	113.9	G202	P200-G202 PolarHBondContact O-N 2.87Å
201	D	33.1	Very low	33.9	Very low	176 Å²	176	158.2 Å²	158.2	94%	0.941	84%	0.836	S	S	*	*			trans	-56.2	129.7	171.8	-89.6	-60	0	0	0	112.7
202	G	36.4	Very low	33.9	Very low	73 Å²	73	158 Å²	158	75%	0.753	83%	0.833	S	S	*	*			trans	-140.1	95.2	174.9	0	0	0	0	0	109.9	P200	P200-G202 PolarHBondContact O-N 2.87Å
203	A	31.5	Very low	34.1	Very low	101 Å²	101	159.2 Å²	159.2	84%	0.835	84%	0.836	S	S	*	*			trans	-65	141.9	-174.8	0	0	0	0	0	112.9
204	L	34.7	Very low	34	Very low	150 Å²	150	159 Å²	159	79%	0.785	83%	0.831	S	S	*	*			trans	-166.6	115.4	144.8	-108	168.2	0	0	0	113.1
205	K	33.6	Very low	34.1	Very low	186 Å²	186	166.6 Å²	166.6	81%	0.809	83%	0.834	S	S	*	*			trans	47	96.5	154.4	-70.3	173.3	-179	175.5	0	118.4
206	L	33.1	Very low	34.6	Very low	186 Å²	186	169.1 Å²	169.1	97%	0.974	83%	0.834	S	S	*	*			trans	-48.7	136.8	142.5	-85.9	161.5	0	0	0	110.2
207	K	38.6	Very low	34.5	Very low	183 Å²	183	166.7 Å²	166.7	80%	0.796	83%	0.831	S	S	*	*			trans	-134.7	113.7	169.9	-165.1	-179.6	-174.5	-174.8	0	108.1	N209	K207-N209 PolarHBondContact O-N 2.8Å
208	E	34.8	Very low	34.8	Very low	191 Å²	191	165.4 Å²	165.4	89%	0.893	83%	0.831	S	S	*	*			trans	-61.4	121	-178.9	-64.4	175.5	94.6	0	0	111
209	N	35	Very low	35	Very low	138 Å²	138	162.7 Å²	162.7	74%	0.738	83%	0.826	S	S	*	*			trans	-108.3	92	168.2	-93.7	-14.9	0	0	0	109.5	K207 Y211	K207-N209 PolarHBondContact O-N 2.8Å; N209-Y211 VanDerWaalsContact C-N 3.33Å; N209-Y211 PolarHBondContact O-N 2.9Å
210	K	37.1	Very low	34.7	Very low	207 Å²	207	163.7 Å²	163.7	90%	0.9	83%	0.825	S	S	*	*			trans	-68	77.7	-178	-169.9	173.9	-173	168.3	0	111.6	R212	K210-R212 PolarHBondContact O-N 2.88Å
211	Y	33.8	Very low	34.5	Very low	220 Å²	220	168 Å²	168	86%	0.863	83%	0.828	S	S	*	*			trans	-71.5	93.6	-179.6	-111.8	-78.2	0	0	0	111.9	N209	N209-Y211 VanDerWaalsContact C-N 3.33Å; N209-Y211 PolarHBondContact O-N 2.9Å
212	R	34.7	Very low	34.5	Very low	234 Å²	234	168 Å²	168	88%	0.883	82%	0.823	S	S	*	*			trans	-70.9	146.6	171	-156.7	-179.7	-167.5	-163.1	3.8	109.9	K210 E214	K210-R212 PolarHBondContact O-N 2.88Å; R212-E214 PolarHBondContact O-N 2.84Å
213	S	32.7	Very low	34.3	Very low	115 Å²	115	168.9 Å²	168.9	80%	0.804	82%	0.823	S	S	*	*			trans	-73.3	115.4	-175.4	-172.2	0	0	0	0	112.8
214	E	32.1	Very low	34.6	Very low	166 Å²	166	172.4 Å²	172.4	78%	0.776	82%	0.821	S	S	*	*			trans	-139.2	105	149.9	-81.8	-163.1	-151.7	0	0	109.5	R212	R212-E214 PolarHBondContact O-N 2.84Å
215	R	34.4	Very low	34.6	Very low	241 Å²	241	170.8 Å²	170.8	91%	0.909	82%	0.823	S	S	*	*			trans	-127.8	99.2	161.9	-79.7	-167.2	176.2	-172.2	1.2	109.6
216	K	37.7	Very low	34.9	Very low	185 Å²	185	167.7 Å²	167.7	80%	0.804	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-58.7	142.9	163.7	-64.3	174.9	-178.2	176.4	0	108.5
217	S	33.6	Very low	36	Very low	104 Å²	104	161.3 Å²	161.3	73%	0.727	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-64.5	147.4	-176.7	43.3	0	0	0	0	111.9	V219	S217-V219 PolarHBondContact O-N 3.11Å
218	P	37.7	Very low	36.6	Very low	120 Å²	120	159.8 Å²	159.8	78%	0.779	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-65.6	131.8	165.1	-14.5	29.4	0	0	0	109.5
219	V	37	Very low	37.9	Very low	119 Å²	119	153.6 Å²	153.6	72%	0.721	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-66.3	131.7	169.3	177	0	0	0	0	108.6	S217 Y221	S217-V219 PolarHBondContact O-N 3.11Å; V219-Y221 PolarHBondContact O-N 3.41Å
220	Y	28.5	Very low	39	Very low	228 Å²	228	151.8 Å²	151.8	89%	0.894	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-64.5	119.8	170.5	-97.9	-105.9	0	0	0	109.2
221	Y	34.3	Very low	40	Very low	204 Å²	204	145.3 Å²	145.3	80%	0.8	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-84.2	130.8	164.7	-90.2	-86.6	0	0	0	109.9	V219	V219-Y221 PolarHBondContact O-N 3.41Å
222	E	33.1	Very low	41	Very low	178 Å²	178	139.7 Å²	139.7	83%	0.832	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-68.1	156.5	-176.8	-163.6	168.5	-167.1	0	0	111.9	H224	E222-H224 PolarHBondContact O-N 3.44Å
223	A	33.1	Very low	41.9	Very low	91 Å²	91	135.2 Å²	135.2	75%	0.752	70%	0.697	S	S	*	*			trans	-71.4	103.8	-175.5	0	0	0	0	0	111.2	S225	A223-S225 PolarHBondContact O-N 3.38Å
224	H	37.2	Very low	42.6	Very low	174 Å²	174	133.4 Å²	133.4	81%	0.806	69%	0.689	S	S	*	*			trans	-61.5	101.1	173.8	-80.9	-77.5	0	0	0	111.6	E222 L226	E222-H224 PolarHBondContact O-N 3.44Å; H224-L226 PolarHBondContact O-N 3.38Å; H224-L226 VanDerWaalsContact O-N 3.13Å
225	S	34.7	Very low	43.5	Very low	117 Å²	117	133.2 Å²	133.2	82%	0.818	69%	0.685	S	S	*	*			trans	-60	108.5	166.5	-66.6	0	0	0	0	110.1	A223 S227	A223-S225 PolarHBondContact O-N 3.38Å; S225-S227 PolarHBondContact O-N 2.94Å
226	L	40.5	Very low	44.2	Very low	121 Å²	121	128.8 Å²	128.8	63%	0.634	67%	0.672	S	S	*	*			trans	-56	129.1	174.7	-81.2	166.2	0	0	0	110.6	H224 E230 I231	H224-L226 PolarHBondContact O-N 3.38Å; H224-L226 VanDerWaalsContact O-N 3.13Å; L226-E230 HydrophobicContact CD2-CB 4.16Å; L226-I231 HydrophobicContact CB-CD1 4.44Å; L226-I231 HydrophobicContact CB-CG1 4.38Å
227	S	55.4	Low	44.4	Very low	51 Å²	51	127.5 Å²	127.5	36%	0.357	67%	0.674	S	S	.	*			trans	-69.9	153.6	178.6	71	0	0	0	0	111.4	S225 A229 E230 I231	S225-S227 PolarHBondContact O-N 2.94Å; S227-A229 PolarHBondContact O-N 2.96Å; S227-A229 VanDerWaalsContact O-N 3.14Å; S227-E230 VanDerWaalsContact CB-OE2 3.25Å; S227-E230 WeakPolarHBondContact CB-OE2 3.4Å; S227-E230 PolarHBondContact N-OE2 2.95Å; S227-E230 PolarHBondContact O-N 3.27Å; S227-E230 VanDerWaalsContact O-N 3.11Å; S227-E230 WeakPolarHBondContact OG-CG 3.42Å; S227-E230 PolarHBondContact OG-N 2.84Å; S227-E230 PolarHBondContact OG-OE2 3.5Å; S227-I231 WeakPolarHBondContact O-CG1 3.45Å; S227-I231 PolarHBondContact O-N 3.19Å; S227-I231 VanDerWaalsContact O-N 3.15Å
228	M	50.3	Low	44.6	Very low	152 Å²	152	125.8 Å²	125.8	75%	0.749	67%	0.672	S	S	*	*	H	α-helix	trans	-56.9	-29	173.6	-79.3	-69.8	-72.2	0	0	112.6	I231 E232	M228-I231 PolarHBondContact O-N 2.87Å; M228-E232 WeakPolarHBondContact O-CB 3.43Å; M228-E232 PolarHBondContact O-N 3.1Å
229	A	62.4	Low	44.7	Very low	61 Å²	61	128.7 Å²	128.7	50%	0.504	67%	0.673	S	S	.	*	H	α-helix	trans	-68.2	-40.6	176.9	0	0	0	0	0	112.7	S227 E232 Q233	S227-A229 PolarHBondContact O-N 2.96Å; S227-A229 VanDerWaalsContact O-N 3.14Å; A229-E232 PolarHBondContact O-N 3.01Å; A229-Q233 WeakPolarHBondContact O-CG 3.29Å; A229-Q233 PolarHBondContact O-N 3.02Å
230	E	57.7	Low	44.5	Very low	100 Å²	100	130.9 Å²	130.9	47%	0.467	68%	0.68	S	S	.	*	H	α-helix	trans	-68	-39.5	175.6	-68.7	159.7	109.4	0	0	111.2	L226 S227 E232 Q233 A234	L226-E230 HydrophobicContact CD2-CB 4.16Å; S227-E230 VanDerWaalsContact CB-OE2 3.25Å; S227-E230 WeakPolarHBondContact CB-OE2 3.4Å; S227-E230 PolarHBondContact N-OE2 2.95Å; S227-E230 PolarHBondContact O-N 3.27Å; S227-E230 VanDerWaalsContact O-N 3.11Å; S227-E230 WeakPolarHBondContact OG-CG 3.42Å; S227-E230 PolarHBondContact OG-N 2.84Å; S227-E230 PolarHBondContact OG-OE2 3.5Å; E230-E232 VanDerWaalsContact C-N 3.27Å; E230-E232 PolarHBondContact O-N 3.44Å; E230-Q233 PolarHBondContact O-N 3.4Å; E230-A234 WeakPolarHBondContact O-CB 3.49Å; E230-A234 PolarHBondContact O-N 3.33Å
231	I	58.9	Low	45.2	Very low	70 Å²	70	126.6 Å²	126.6	36%	0.359	67%	0.668	S	S	.	*	H	α-helix	trans	-63.9	-32.9	173.7	-63.4	170.6	0	0	0	111.1	L226 S227 M228 K235	L226-I231 HydrophobicContact CB-CD1 4.44Å; L226-I231 HydrophobicContact CB-CG1 4.38Å; S227-I231 WeakPolarHBondContact O-CG1 3.45Å; S227-I231 PolarHBondContact O-N 3.19Å; S227-I231 VanDerWaalsContact O-N 3.15Å; M228-I231 PolarHBondContact O-N 2.87Å; I231-K235 WeakPolarHBondContact O-CG 3.34Å; I231-K235 PolarHBondContact O-N 3.38Å
232	E	55.9	Low	45.2	Very low	102 Å²	102	124.5 Å²	124.5	48%	0.477	67%	0.671	S	S	.	*	H	α-helix	trans	-78.4	-36.9	176	-156.9	-169.6	131.2	0	0	113	M228 A229 E230 A234 K235 K236	M228-E232 WeakPolarHBondContact O-CB 3.43Å; M228-E232 PolarHBondContact O-N 3.1Å; A229-E232 PolarHBondContact O-N 3.01Å; E230-E232 VanDerWaalsContact C-N 3.27Å; E230-E232 PolarHBondContact O-N 3.44Å; E232-A234 VanDerWaalsContact C-N 3.35Å; E232-K235 WeakPolarHBondContact O-CB 3.46Å; E232-K235 PolarHBondContact O-N 2.84Å; E232-K235 VanDerWaalsContact O-N 3.15Å; E232-K236 PolarHBondContact O-N 3.11Å; E232-K236 WeakPolarHBondContact OE1-CE 3.39Å; E232-K236 IonicContact OE1-NZ 3.1Å; E232-K236 PolarHBondContact OE1-NZ 2.69Å
233	Q	52.8	Low	45.4	Very low	141 Å²	141	123 Å²	123	66%	0.659	67%	0.668	S	S	*	*	H	α-helix	trans	-63.4	-41	171.5	-72.7	-169.9	15.2	0	0	111.5	A229 E230 K235 K236 L237	A229-Q233 WeakPolarHBondContact O-CG 3.29Å; A229-Q233 PolarHBondContact O-N 3.02Å; E230-Q233 PolarHBondContact O-N 3.4Å; Q233-K235 PolarHBondContact O-N 3.44Å; Q233-K236 PolarHBondContact O-N 2.84Å; Q233-L237 PolarHBondContact O-N 3.27Å
234	A	47.1	Very low	45.5	Very low	77 Å²	77	125 Å²	125	64%	0.636	67%	0.665	S	S	*	*	H	α-helix	trans	-60	-26.7	173.4	0	0	0	0	0	113.3	E230 E232	E230-A234 WeakPolarHBondContact O-CB 3.49Å; E230-A234 PolarHBondContact O-N 3.33Å; E232-A234 VanDerWaalsContact C-N 3.35Å
235	K	51.9	Low	45.3	Very low	161 Å²	161	122.3 Å²	122.3	70%	0.7	66%	0.663	S	S	*	*	H	α-helix	trans	-80.3	-19.5	172.8	-73.6	171.4	178.9	173	0	113.8	I231 E232 Q233	I231-K235 WeakPolarHBondContact O-CG 3.34Å; I231-K235 PolarHBondContact O-N 3.38Å; E232-K235 WeakPolarHBondContact O-CB 3.46Å; E232-K235 PolarHBondContact O-N 2.84Å; E232-K235 VanDerWaalsContact O-N 3.15Å; Q233-K235 PolarHBondContact O-N 3.44Å
236	K	47.9	Very low	45.2	Very low	148 Å²	148	125.1 Å²	125.1	64%	0.643	66%	0.661	S	S	*	*	H	α-helix	trans	-86.5	-20.8	-177.7	-79.8	167.9	171.3	161	0	114.1	E232 Q233 G238	E232-K236 PolarHBondContact O-N 3.11Å; E232-K236 WeakPolarHBondContact OE1-CE 3.39Å; E232-K236 IonicContact OE1-NZ 3.1Å; E232-K236 PolarHBondContact OE1-NZ 2.69Å; Q233-K236 PolarHBondContact O-N 2.84Å; K236-G238 VanDerWaalsContact C-N 3.3Å; K236-G238 PolarHBondContact O-N 3.34Å
237	L	42.4	Very low	45	Very low	159 Å²	159	129.2 Å²	129.2	83%	0.832	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	14.6	174.3	-75.1	164.8	0	0	0	114.4	Q233 K239	Q233-L237 PolarHBondContact O-N 3.27Å; L237-K239 VanDerWaalsContact C-N 3.27Å; L237-K239 PolarHBondContact O-N 3.12Å
238	G	37.3	Very low	43.9	Very low	68 Å²	68	132.2 Å²	132.2	70%	0.701	70%	0.695	S	S	*	*			trans	-82.7	18.4	-178.8	0	0	0	0	0	116.1	K236	K236-G238 VanDerWaalsContact C-N 3.3Å; K236-G238 PolarHBondContact O-N 3.34Å
239	K	39.3	Very low	42.9	Very low	181 Å²	181	130.7 Å²	130.7	79%	0.787	70%	0.696	S	S	*	*			trans	-142	98.3	-177.6	-65.4	179.8	-175.7	176.1	0	110	L237	L237-K239 VanDerWaalsContact C-N 3.27Å; L237-K239 PolarHBondContact O-N 3.12Å
240	D	34.3	Very low	41.5	Very low	165 Å²	165	135.6 Å²	135.6	88%	0.882	71%	0.713	S	S	*	*			trans	163	72.6	149.1	-84.1	-14.5	0	0	0	110.6
241	E	42.9	Very low	40.4	Very low	137 Å²	137	136.3 Å²	136.3	64%	0.64	73%	0.729	S	S	*	*			trans	-130.2	91.9	164.4	-79.2	-158.1	168	0	0	111.1	L243 S638	E241-L243 VanDerWaalsContact C-N 3.3Å; E241-L243 PolarHBondContact O-N 2.9Å; E241-S638 WeakPolarHBondContact OE1-CB 3.25Å
242	N	34.1	Very low	39.1	Very low	161 Å²	161	143.1 Å²	143.1	86%	0.861	76%	0.756	S	S	*	*			trans	-78	75.8	168.9	-84.7	-34.5	0	0	0	110.9
243	L	38.1	Very low	38.1	Very low	145 Å²	145	144.4 Å²	144.4	76%	0.759	78%	0.776	S	S	*	*			trans	-127.9	97.6	166.4	-77.8	175.4	0	0	0	109.9	E241 P245	E241-L243 VanDerWaalsContact C-N 3.3Å; E241-L243 PolarHBondContact O-N 2.9Å; L243-P245 WeakPolarHBondContact O-CD 3.23Å
244	I	33.7	Very low	37.1	Very low	134 Å²	134	149 Å²	149	69%	0.687	79%	0.787	S	S	*	*			trans	-79	126	-169.7	-56.8	167.6	0	0	0	111.7	F246	I244-F246 HydrophobicContact CG2-CD2 3.66Å; I244-F246 HydrophobicContact CG2-CE2 3.97Å; I244-F246 HydrophobicContact CG2-CG 4.41Å
245	P	34	Very low	36.4	Very low	118 Å²	118	149.6 Å²	149.6	77%	0.766	79%	0.792	S	S	*	*			trans	-99	114.4	149.8	33.5	-23.2	0	0	0	109.4	L243 F247	L243-P245 WeakPolarHBondContact O-CD 3.23Å; P245-F247 PolarHBondContact O-N 3.3Å
246	F	32.3	Very low	35.6	Very low	176 Å²	176	147.3 Å²	147.3	77%	0.772	79%	0.794	S	S	*	*			trans	-68.9	124.7	172	-93.6	-98.1	0	0	0	110.4	I244	I244-F246 HydrophobicContact CG2-CD2 3.66Å; I244-F246 HydrophobicContact CG2-CE2 3.97Å; I244-F246 HydrophobicContact CG2-CG 4.41Å
247	F	35.3	Very low	34.8	Very low	207 Å²	207	146 Å²	146	91%	0.908	80%	0.804	S	S	*	*			trans	-158	157.7	133.7	-94.2	-63.5	0	0	0	109.3	P245	P245-F247 PolarHBondContact O-N 3.3Å
248	S	33	Very low	34.4	Very low	114 Å²	114	144.1 Å²	144.1	80%	0.797	80%	0.804	S	S	*	*			trans	-73.5	151.6	-152.5	-56.2	0	0	0	0	116.3
249	P	29	Very low	34	Very low	120 Å²	120	145.5 Å²	145.5	78%	0.779	81%	0.808	S	S	*	*			trans	-90.5	158.4	179.5	37	-35.9	0	0	0	113.1
250	L	33.2	Very low	33.9	Very low	164 Å²	164	143.8 Å²	143.8	86%	0.859	81%	0.813	S	S	*	*			trans	-159.3	149.8	151.9	-113	166.9	0	0	0	112.9
251	S	35.8	Very low	33.9	Very low	114 Å²	114	141.2 Å²	141.2	80%	0.797	81%	0.808	S	S	*	*			trans	60.6	118.6	164.6	-62	0	0	0	0	120.1
252	K	30.7	Very low	33.5	Very low	214 Å²	214	140.4 Å²	140.4	93%	0.93	82%	0.815	S	S	*	*			trans	-104.9	144.4	175	-58.3	164.8	-178.6	169.1	0	110.8
253	S	34.8	Very low	33.6	Very low	129 Å²	129	141.9 Å²	141.9	90%	0.902	82%	0.816	S	S	*	*			trans	-145	167.7	149.4	77.5	0	0	0	0	109.7
254	R	32.1	Very low	33.3	Very low	236 Å²	236	140.5 Å²	140.5	89%	0.891	82%	0.819	S	S	*	*			trans	-146.5	101	-154.8	-177.5	-169.8	176.4	-174.4	-1.1	115.3
255	A	32.2	Very low	33.3	Very low	90 Å²	90	139.2 Å²	139.2	74%	0.744	82%	0.822	S	S	*	*			trans	60.9	-179.7	148.1	0	0	0	0	0	117.2
256	P	35.3	Very low	33.1	Very low	114 Å²	114	144.2 Å²	144.2	74%	0.74	83%	0.827	S	S	*	*			cis	-132.2	158.9	-7.4	40.4	-23.7	0	0	0	117.7
257	S	30.8	Very low	33.3	Very low	120 Å²	120	139.4 Å²	139.4	84%	0.839	83%	0.827	S	S	*	*			trans	31.7	112.4	141.9	-50.4	0	0	0	0	124.3
258	S	34.9	Very low	33	Very low	119 Å²	119	137.2 Å²	137.2	83%	0.832	83%	0.825	S	S	*	*				-159.4	147	120.5	58.9	0	0	0	0	108.9
259	A	29.1	Very low	32.9	Very low	97 Å²	97	137.1 Å²	137.1	80%	0.802	82%	0.824	S	S	*	*			cis	102.9	70.8	13.8	0	0	0	0	0	115.9
260	V	36.2	Very low	33	Very low	146 Å²	146	137.4 Å²	137.4	89%	0.885	82%	0.823	S	S	*	*			trans	-141.6	146.4	161	-176.1	0	0	0	0	108.9
261	S	34.4	Very low	33	Very low	111 Å²	111	135.4 Å²	135.4	78%	0.776	82%	0.818	S	S	*	*			trans	-96.5	164	-178.4	-76.8	0	0	0	0	113.5
262	P	33.9	Very low	32.7	Very low	120 Å²	120	135.2 Å²	135.2	78%	0.779	82%	0.816	S	S	*	*			trans	-92.9	152.9	178	36.6	-34.2	0	0	0	113.4
263	E	36.5	Very low	32.9	Very low	192 Å²	192	132.6 Å²	132.6	90%	0.897	81%	0.811	S	S	*	*			trans	-135.9	154.8	166.4	-70.4	-170.1	119.4	0	0	111.8
264	S	31.9	Very low	32.8	Very low	116 Å²	116	132 Å²	132	81%	0.811	81%	0.806	S	S	*	*			trans	-7.8	161.1	166.9	83.1	0	0	0	0	121.5
265	S	33.9	Very low	32.8	Very low	107 Å²	107	129.8 Å²	129.8	75%	0.748	80%	0.803	S	S	*	*			cis	-158.3	-179.3	21.3	69.7	0	0	0	0	114.6
266	Y	30.4	Very low	32.9	Very low	223 Å²	223	137.4 Å²	137.4	88%	0.875	81%	0.813	S	S	*	*			trans	-34.6	151.1	173.8	-76.1	-99.9	0	0	0	118.8
267	G	35.3	Very low	32.7	Very low	75 Å²	75	139.3 Å²	139.3	77%	0.773	82%	0.817	S	S	*	*			trans	-169.5	51.6	172.4	0	0	0	0	0	115.5
268	N	29.5	Very low	32.8	Very low	161 Å²	161	138.7 Å²	138.7	86%	0.861	81%	0.812	S	S	*	*			trans	-69.2	130.5	172.6	-82.2	-7.6	0	0	0	110.9
269	S	31.7	Very low	32.6	Very low	111 Å²	111	139.8 Å²	139.8	78%	0.776	81%	0.807	S	S	*	*			trans	-131.8	121.7	168	-173.6	0	0	0	0	109.8
270	V	31.1	Very low	32.7	Very low	127 Å²	127	144.6 Å²	144.6	77%	0.77	81%	0.811	S	S	*	*			trans	-115.9	120.9	179.4	177.8	0	0	0	0	108.1
271	V	33.4	Very low	32.4	Very low	122 Å²	122	145.4 Å²	145.4	74%	0.739	81%	0.808	S	S	*	*			trans	-104.3	101.1	175.9	-179.1	0	0	0	0	109.4	I273	V271-I273 HydrophobicContact CG1-CG1 4.41Å
272	S	29	Very low	32.3	Very low	109 Å²	109	143.4 Å²	143.4	76%	0.762	81%	0.805	S	S	*	*			trans	-78.4	131	172.3	-59.5	0	0	0	0	110.7
273	I	34.9	Very low	32.1	Very low	160 Å²	160	143 Å²	143	82%	0.821	81%	0.805	S	S	*	*			trans	-116.9	134	169.1	-61	-177.2	0	0	0	109	V271	V271-I273 HydrophobicContact CG1-CG1 4.41Å
274	S	32.1	Very low	32	Very low	116 Å²	116	138.3 Å²	138.3	81%	0.811	80%	0.799	S	S	*	*			trans	-94.9	152.2	-164.6	-168.3	0	0	0	0	113.9
275	K	32	Very low	32.2	Very low	190 Å²	190	137.1 Å²	137.1	83%	0.826	80%	0.797	S	S	*	*			trans	-80.6	144.9	174	-69.9	-178.7	176.1	-179.9	0	111.7
276	R	35.3	Very low	32.1	Very low	250 Å²	250	140.1 Å²	140.1	94%	0.943	80%	0.799	S	S	*	*			trans	-139.7	131.4	151.6	-77.7	-170.4	170.1	156.3	-1.9	110.4
277	N	30.4	Very low	32.3	Very low	154 Å²	154	141.3 Å²	141.3	82%	0.824	80%	0.802	S	S	*	*			trans	-112.3	130.8	172.8	-76.6	10.2	0	0	0	109.9
278	S	33.9	Very low	32	Very low	107 Å²	107	142.7 Å²	142.7	75%	0.748	80%	0.799	S	S	*	*			trans	-178.1	111	149	44.3	0	0	0	0	108.1
279	I	29.9	Very low	32.4	Very low	141 Å²	141	146.8 Å²	146.8	72%	0.723	80%	0.803	S	S	*	*				61.3	108.8	82.9	-57.8	160.2	0	0	0	112.5
280	F	32	Very low	32.3	Very low	199 Å²	199	148.3 Å²	148.3	87%	0.873	80%	0.802	S	S	*	*				-167.7	171.3	118.7	-114.6	-78.9	0	0	0	111.8
281	I	28.9	Very low	32.7	Very low	162 Å²	162	149 Å²	149	83%	0.831	81%	0.807	S	S	*	*			trans	-121	146.2	-162.5	-62.9	164.7	0	0	0	111.4
282	G	32.6	Very low	32.7	Very low	69 Å²	69	149.5 Å²	149.5	71%	0.711	81%	0.805	S	S	*	*			trans	-166.4	150.4	168.2	0	0	0	0	0	112.7
283	S	29.5	Very low	32.9	Very low	111 Å²	111	153.9 Å²	153.9	78%	0.776	81%	0.805	S	S	*	*			trans	-151.6	130.6	-176.3	-80.3	0	0	0	0	115
284	A	34.6	Very low	32.7	Very low	94 Å²	94	152.4 Å²	152.4	78%	0.777	80%	0.798	S	S	*	*			trans	-160.4	130.4	159	0	0	0	0	0	106.2
285	A	35.1	Very low	32.7	Very low	92 Å²	92	152.3 Å²	152.3	76%	0.76	80%	0.798	S	S	*	*				68.6	137.2	61.7	0	0	0	0	0	113.3
286	Q	32.8	Very low	32.6	Very low	169 Å²	169	149.5 Å²	149.5	79%	0.79	80%	0.801	S	S	*	*			cis	-179.8	130.1	-9.8	168.6	178	7.9	0	0	109.2
287	R	34.3	Very low	32.1	Very low	249 Å²	249	145.3 Å²	145.3	94%	0.94	80%	0.796	S	S	*	*			trans	171.4	155.8	152	-94.4	145.4	-154.5	-95.1	0.5	112.2
288	S	29.7	Very low	32.1	Very low	103 Å²	103	145 Å²	145	72%	0.72	79%	0.793	S	S	*	*			trans	-125.4	170.3	177.2	60.4	0	0	0	0	111.7
289	R	37.2	Very low	31.9	Very low	247 Å²	247	148.3 Å²	148.3	93%	0.932	80%	0.797	S	S	*	*			trans	-171.4	153.6	144.2	-107	165.4	-169	176.1	2.3	112
290	D	29.7	Very low	31.7	Very low	144 Å²	144	151 Å²	151	77%	0.77	81%	0.806	S	S	*	*			trans	-112.1	135.6	-165.1	-44.4	-97.6	0	0	0	112.8
291	V	38.9	Very low	31.6	Very low	142 Å²	142	145.9 Å²	145.9	86%	0.861	80%	0.801	S	S	*	*			trans	-151.4	124.2	153.4	-168.4	0	0	0	0	105.3
292	N	33.5	Very low	32	Very low	132 Å²	132	144.7 Å²	144.7	71%	0.706	80%	0.801	S	S	*	*			cis	120.1	113.1	8.6	-172	46.3	0	0	0	110.9
293	R	33.2	Very low	31.8	Very low	201 Å²	201	149.3 Å²	149.3	76%	0.758	81%	0.809	S	S	*	*			trans	80.2	116.5	158	-82.8	-174.4	159.1	160.2	2	123.8
294	D	31.9	Very low	31.9	Very low	128 Å²	128	149.1 Å²	149.1	68%	0.684	81%	0.808	S	S	*	*				97.7	149.4	117.9	-65.5	-15.5	0	0	0	123.1
295	S	31.4	Very low	31.8	Very low	115 Å²	115	149.6 Å²	149.6	80%	0.804	81%	0.806	S	S	*	*			trans	77.1	91.4	168.9	64.2	0	0	0	0	120
296	C	29.6	Very low	31.7	Very low	131 Å²	131	149 Å²	149	89%	0.885	81%	0.808	S	S	*	*				-169	131.4	110.1	-112.6	0	0	0	0	113.2
297	L	25.9	Very low	31.9	Very low	162 Å²	162	147.7 Å²	147.7	85%	0.848	81%	0.805	S	S	*	*			trans	-83.2	169.1	149.8	-70.6	125.5	0	0	0	106.8
298	I	29.3	Very low	31.9	Very low	146 Å²	146	143.8 Å²	143.8	75%	0.749	79%	0.791	S	S	*	*			cis	-152.6	148.8	40	-60.3	156	0	0	0	104.3
299	Q	30.4	Very low	32.4	Very low	178 Å²	178	142.3 Å²	142.3	83%	0.832	77%	0.774	S	S	*	*				-171.1	165.7	64.8	-156.9	137.4	-22.2	0	0	110.9
300	E	26.1	Very low	32.5	Very low	196 Å²	196	132.8 Å²	132.8	92%	0.916	75%	0.745	S	S	*	*			trans	-66.9	131.7	177.2	-66.5	175.8	118.1	0	0	112.5
301	A	30.1	Very low	32.8	Very low	93 Å²	93	128.8 Å²	128.8	77%	0.769	74%	0.738	S	S	*	*			trans	-107.9	132.2	165.9	0	0	0	0	0	109.2	D303	A301-D303 PolarHBondContact O-N 3.12Å
302	V	36.1	Very low	32.8	Very low	136 Å²	136	127.2 Å²	127.2	82%	0.824	73%	0.728	S	S	*	*			trans	-72	127.8	-177.5	177.3	0	0	0	0	110.6	S304	V302-S304 PolarHBondContact O-N 2.97Å
303	D	28.1	Very low	33	Very low	167 Å²	167	126.7 Å²	126.7	89%	0.893	73%	0.725	S	S	*	*			trans	-58.2	87.3	179	-91.6	-42.2	0	0	0	113.2	A301	A301-D303 PolarHBondContact O-N 3.12Å
304	S	31.3	Very low	33	Very low	107 Å²	107	124.8 Å²	124.8	75%	0.748	73%	0.729	S	S	*	*			trans	-99.1	87.8	164.4	-68.4	0	0	0	0	108.6	V302 G306	V302-S304 PolarHBondContact O-N 2.97Å; S304-G306 PolarHBondContact O-N 3.25Å
305	S	33.9	Very low	33.2	Very low	104 Å²	104	126.2 Å²	126.2	73%	0.727	74%	0.736	S	S	*	*			trans	-53.4	106.2	-176	54.3	0	0	0	0	112.1	I307	S305-I307 PolarHBondContact O-N 3.49Å
306	G	31.5	Very low	33.5	Very low	78 Å²	78	128.2 Å²	128.2	80%	0.804	74%	0.736	S	S	*	*			trans	-71.5	93.1	-178.4	0	0	0	0	0	111.9	S304 Y308	S304-G306 PolarHBondContact O-N 3.25Å; G306-Y308 PolarHBondContact O-N 2.6Å; G306-Y308 VanDerWaalsContact O-N 3.09Å
307	I	37.5	Very low	33.8	Very low	142 Å²	142	128.5 Å²	128.5	73%	0.728	73%	0.729	S	S	*	*			trans	-72	101.5	168.4	-59	176.7	0	0	0	107.6	S305 I309	S305-I307 PolarHBondContact O-N 3.49Å; I307-I309 HydrophobicContact CG2-CG1 4.31Å; I307-I309 PolarHBondContact O-N 3.1Å
308	Y	34.2	Very low	34.2	Very low	168 Å²	168	128.7 Å²	128.7	66%	0.659	73%	0.731	S	S	*	*			trans	-63.4	117.3	171.6	176.1	-111.6	0	0	0	109.7	G306 P310	G306-Y308 PolarHBondContact O-N 2.6Å; G306-Y308 VanDerWaalsContact O-N 3.09Å; Y308-P310 HydrophobicContact CD1-CG 4.13Å; Y308-P310 HydrophobicContact CE1-CB 4.44Å; Y308-P310 HydrophobicContact CE1-CG 3.78Å
309	I	41.3	Very low	34.7	Very low	71 Å²	71	125.8 Å²	125.8	36%	0.364	72%	0.723	S	S	.	*			trans	-107.6	106.5	175.8	-58.8	177.3	0	0	0	107.8	I307 G311 V312	I307-I309 HydrophobicContact CG2-CG1 4.31Å; I307-I309 PolarHBondContact O-N 3.1Å; I309-G311 PolarHBondContact O-N 3.38Å; I309-V312 HydrophobicContact CB-CG2 4.22Å; I309-V312 HydrophobicContact CG2-CG2 3.97Å; I309-V312 PolarHBondContact O-N 2.78Å
310	P	37.8	Very low	34.9	Very low	48 Å²	48	126.5 Å²	126.5	31%	0.312	73%	0.726	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.7	127.1	176.4	-24.4	34.4	0	0	0	111.1	Y308 P432	Y308-P310 HydrophobicContact CD1-CG 4.13Å; Y308-P310 HydrophobicContact CE1-CB 4.44Å; Y308-P310 HydrophobicContact CE1-CG 3.78Å; P310-P432 HydrophobicContact CB-CB 3.58Å; P310-P432 HydrophobicContact CB-CG 4.31Å; P310-P432 WeakPolarHBondContact O-CB 3.27Å; P310-P432 WeakPolarHBondContact O-CG 3.39Å
311	G	37.7	Very low	35.2	Very low	60 Å²	60	123.4 Å²	123.4	62%	0.619	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	100.8	9.9	-178.5	0	0	0	0	0	115.7	I309	I309-G311 PolarHBondContact O-N 3.38Å
312	V	37.7	Very low	35.5	Very low	109 Å²	109	127.7 Å²	127.7	66%	0.661	73%	0.729	S	S	*	*			trans	-113.3	49.6	166.7	-162.4	0	0	0	0	110.3	I309	I309-V312 HydrophobicContact CB-CG2 4.22Å; I309-V312 HydrophobicContact CG2-CG2 3.97Å; I309-V312 PolarHBondContact O-N 2.78Å
313	D	38.2	Very low	35.4	Very low	120 Å²	120	127.3 Å²	127.3	64%	0.642	73%	0.73	S	S	*	*			trans	-86.9	154.5	160.5	-56.7	-60.9	0	0	0	108.2
314	L	33.9	Very low	35.7	Very low	161 Å²	161	126.8 Å²	126.8	84%	0.843	73%	0.725	S	S	*	*	S	Bend	trans	72.4	73.7	-170.1	-49.4	173.4	0	0	0	115.4
315	L	34.4	Very low	35.6	Very low	159 Å²	159	128.1 Å²	128.1	83%	0.832	72%	0.724	S	S	*	*			trans	-170.5	55.7	141.2	-104.4	176.8	0	0	0	110.9
316	I	37.5	Very low	35.6	Very low	157 Å²	157	131.3 Å²	131.3	81%	0.805	73%	0.732	S	S	*	*	S	Bend	trans	-119.3	141.3	163.3	-61.2	177	0	0	0	105	D318	I316-D318 PolarHBondContact O-N 3.11Å
317	D	37.8	Very low	35.5	Very low	136 Å²	136	134.2 Å²	134.2	73%	0.727	73%	0.727	S	S	*	*			trans	-65.9	120.2	-179.4	-83.5	-66.6	0	0	0	111.1	S319	D317-S319 PolarHBondContact O-N 2.83Å
318	D	34.2	Very low	35.1	Very low	167 Å²	167	132.5 Å²	132.5	89%	0.893	73%	0.728	S	S	*	*			trans	-75.8	57.4	173	-73.9	-45.9	0	0	0	111	I316	I316-D318 PolarHBondContact O-N 3.11Å
319	S	39.8	Very low	35	Very low	84 Å²	84	135.4 Å²	135.4	59%	0.587	74%	0.738	S	S	*	*			trans	-125.2	127.9	173.5	58.4	0	0	0	0	110.9	D317	D317-S319 PolarHBondContact O-N 2.83Å
320	E	33.4	Very low	34.7	Very low	193 Å²	193	141.7 Å²	141.7	90%	0.902	76%	0.763	S	S	*	*	S	Bend	trans	68.7	55.7	170.7	-55.5	-172.4	-168.1	0	0	117.4
321	C	33.8	Very low	34.4	Very low	131 Å²	131	144.4 Å²	144.4	89%	0.885	78%	0.783	S	S	*	*			trans	-148.2	113.1	151.4	-96.6	0	0	0	0	111.8
322	E	36.2	Very low	34.3	Very low	184 Å²	184	152.1 Å²	152.1	86%	0.86	79%	0.794	S	S	*	*			trans	-79.8	142.1	169.1	-70.3	-146.1	142.4	0	0	111.6	I324	E322-I324 PolarHBondContact O-N 2.82Å; E322-I324 VanDerWaalsContact O-N 3.11Å
323	P	33.6	Very low	34.3	Very low	128 Å²	128	153.5 Å²	153.5	83%	0.831	80%	0.803	S	S	*	*			trans	-78.9	95	-178.8	31.7	-34.4	0	0	0	111.7
324	I	33.5	Very low	34.3	Very low	155 Å²	155	153.4 Å²	153.4	80%	0.795	81%	0.809	S	S	*	*			trans	-79.7	129.6	172.2	-63	179.2	0	0	0	110.6	E322 L326	E322-I324 PolarHBondContact O-N 2.82Å; E322-I324 VanDerWaalsContact O-N 3.11Å; I324-L326 PolarHBondContact O-N 3.34Å
325	D	29.7	Very low	34.3	Very low	135 Å²	135	153.4 Å²	153.4	72%	0.722	81%	0.808	S	S	*	*			trans	-58.7	115.8	179.3	-75.5	-62.8	0	0	0	113.7
326	L	33.3	Very low	34.3	Very low	171 Å²	171	151.1 Å²	151.1	90%	0.895	81%	0.805	S	S	*	*			trans	-129.3	88	161.5	-81.9	179.1	0	0	0	111.8	I324	I324-L326 PolarHBondContact O-N 3.34Å
327	I	29.5	Very low	33.9	Very low	139 Å²	139	148.9 Å²	148.9	71%	0.713	80%	0.803	S	S	*	*			trans	-81.4	142.2	178.8	-66.8	168.7	0	0	0	111.3
328	S	30.4	Very low	34	Very low	106 Å²	106	148.4 Å²	148.4	74%	0.741	81%	0.808	S	S	*	*			trans	56.5	77.3	158.2	-65.1	0	0	0	0	120.1
329	R	32.4	Very low	34.2	Very low	229 Å²	229	149.9 Å²	149.9	86%	0.864	81%	0.806	S	S	*	*			trans	-142.2	135.3	132.4	-55.9	-175.1	-173.1	169.6	5.3	106.3
330	F	34	Very low	33.8	Very low	203 Å²	203	154 Å²	154	89%	0.89	82%	0.82	S	S	*	*			cis	-132.1	157.7	20	-75.1	-106	0	0	0	112.4
331	S	32.1	Very low	34.2	Very low	106 Å²	106	150.3 Å²	150.3	74%	0.741	81%	0.81	S	S	*	*			trans	-143.2	163.8	161.6	64.8	0	0	0	0	110.4
332	R	35.4	Very low	34.2	Very low	222 Å²	222	150.9 Å²	150.9	84%	0.838	80%	0.804	S	S	*	*			trans	84.9	139.6	-172.9	-53.5	-179.3	176.8	-138.4	-6.5	115.4
333	T	37.7	Very low	34.4	Very low	138 Å²	138	147.9 Å²	147.9	85%	0.847	80%	0.801	S	S	*	*			trans	-118.2	-154.4	-168.2	54	0	0	0	0	110.2
334	P	37.2	Very low	34.2	Very low	118 Å²	118	145.8 Å²	145.8	77%	0.766	80%	0.802	S	S	*	*				-118	168.5	-118.3	33.4	-13.1	0	0	0	114.9
335	I	35.4	Very low	34.3	Very low	161 Å²	161	143.6 Å²	143.6	83%	0.826	80%	0.8	S	S	*	*			trans	-138.1	126.8	174.3	-57.5	-176.7	0	0	0	112.6
336	S	32.6	Very low	34.5	Very low	110 Å²	110	142.4 Å²	142.4	77%	0.769	80%	0.799	S	S	*	*			trans	57	122.8	158.6	68	0	0	0	0	122.1
337	S	31	Very low	34.7	Very low	110 Å²	110	142.2 Å²	142.2	77%	0.769	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-71.5	153.3	156.8	-39	0	0	0	0	112.5
338	P	39.7	Very low	34.6	Very low	127 Å²	127	140 Å²	140	83%	0.825	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-74.7	149.6	165.5	32.1	-34	0	0	0	111.9
339	K	37.4	Very low	34.7	Very low	197 Å²	197	141 Å²	141	86%	0.857	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-84.9	158.1	176.3	-72.2	-178.7	175.1	-179.8	0	112.4
340	I	31.7	Very low	34.6	Very low	172 Å²	172	134.1 Å²	134.1	88%	0.882	79%	0.791	S	S	*	*			trans	-99.2	114.6	173.2	-61.6	170.5	0	0	0	109.3
341	V	40.7	Very low	34.6	Very low	115 Å²	115	132.7 Å²	132.7	70%	0.697	79%	0.792	S	S	*	*			trans	-161.8	133.9	178.7	175.3	0	0	0	0	105.9
342	D	34.9	Very low	34.8	Very low	143 Å²	143	132.3 Å²	132.3	77%	0.765	80%	0.795	S	S	*	*			cis	-152.3	170.6	-12.4	-114	-18.1	0	0	0	109.2
343	P	39.9	Very low	34.8	Very low	121 Å²	121	125.1 Å²	125.1	79%	0.786	79%	0.79	S	S	*	*			trans	-79.9	138.8	-173.9	32.2	-34.8	0	0	0	113.9
344	G	29.8	Very low	35	Very low	83 Å²	83	124.5 Å²	124.5	86%	0.856	79%	0.788	S	S	*	*			trans	-87.4	140.9	178.9	0	0	0	0	0	114.3
345	S	36.2	Very low	34.9	Very low	109 Å²	109	127 Å²	127	76%	0.762	79%	0.794	S	S	*	*			trans	-115	116.6	179	-170.6	0	0	0	0	113.8
346	T	33.9	Very low	34.7	Very low	111 Å²	111	124.7 Å²	124.7	68%	0.681	79%	0.793	S	S	*	*			trans	46.6	93.2	131.9	-30.3	0	0	0	0	121.4
347	I	36.1	Very low	34.7	Very low	166 Å²	166	124.5 Å²	124.5	85%	0.851	79%	0.791	S	S	*	*			trans	-149.5	118.1	137.5	-48.1	-179.9	0	0	0	105.7
348	S	27.7	Very low	34.7	Very low	93 Å²	93	123.5 Å²	123.5	65%	0.65	78%	0.784	S	S	*	*			cis	94.4	96	35.4	-67.7	0	0	0	0	115.4
349	C	32.6	Very low	34.5	Very low	126 Å²	126	125.3 Å²	125.3	85%	0.851	78%	0.781	S	S	*	*			trans	-178.3	122.7	152.7	-93.4	0	0	0	0	106.4
350	A	31.5	Very low	34.4	Very low	86 Å²	86	122.5 Å²	122.5	71%	0.711	77%	0.774	S	S	*	*			cis	64	127.7	41.3	0	0	0	0	0	111.9
351	L	34.1	Very low	34.5	Very low	173 Å²	173	122.2 Å²	122.2	91%	0.906	77%	0.767	S	S	*	*			cis	-138.9	-173.9	4.9	-70.9	95.4	0	0	0	108.8
352	A	36.1	Very low	34.1	Very low	98 Å²	98	122.2 Å²	122.2	81%	0.81	76%	0.763	S	S	*	*			cis	-150	-178.9	7.6	0	0	0	0	0	111.2
353	G	33.7	Very low	34	Very low	70 Å²	70	123 Å²	123	72%	0.722	76%	0.762	S	S	*	*			trans	-110	-136.8	-175.1	0	0	0	0	0	116.9
354	P	43.7	Very low	33.9	Very low	125 Å²	125	124.7 Å²	124.7	81%	0.812	76%	0.764	S	S	*	*				-136.5	161.7	-106.7	39.1	-23.1	0	0	0	117.7
355	L	33.3	Very low	34	Very low	170 Å²	170	127.6 Å²	127.6	89%	0.89	76%	0.76	S	S	*	*			trans	-142.3	138.2	162.8	-60.6	171.9	0	0	0	106.8
356	S	31.5	Very low	34.1	Very low	114 Å²	114	126.4 Å²	126.4	80%	0.797	75%	0.751	S	S	*	*			cis	98	130.3	20.3	-157.5	0	0	0	0	115.6
357	S	33.5	Very low	34.3	Very low	105 Å²	105	128.1 Å²	128.1	73%	0.734	76%	0.756	S	S	*	*			trans	63.9	103	173	-86.2	0	0	0	0	122.4
358	S	31.1	Very low	34.3	Very low	90 Å²	90	127.8 Å²	127.8	63%	0.629	76%	0.755	S	S	*	*				31.6	128.4	120.1	62.9	0	0	0	0	122.6
359	H	35.5	Very low	34.9	Very low	164 Å²	164	127.3 Å²	127.3	76%	0.759	76%	0.757	S	S	*	*			trans	-173.2	136.6	130.3	-96.4	-18.2	0	0	0	111.1
360	I	36.1	Very low	35.2	Very low	138 Å²	138	129.8 Å²	129.8	71%	0.708	76%	0.756	S	S	*	*				62.3	131	90.3	-70	-176.5	0	0	0	112.4
361	F	32.2	Very low	35.4	Very low	166 Å²	166	136.9 Å²	136.9	73%	0.728	77%	0.765	S	S	*	*			cis	-174.5	163	-12.6	-141.6	-50.5	0	0	0	107.5
362	N	34	Very low	35.5	Very low	115 Å²	115	139.8 Å²	139.8	62%	0.615	76%	0.764	S	S	*	*			trans	59.4	121	146.2	-88.1	-3.7	0	0	0	123.7
363	Q	31.9	Very low	35.8	Very low	161 Å²	161	140.7 Å²	140.7	75%	0.752	76%	0.759	S	S	*	*				80.5	164.8	113.4	-155	168.4	32.3	0	0	120.4
364	L	37.6	Very low	36.1	Very low	156 Å²	156	142.1 Å²	142.1	82%	0.817	76%	0.758	S	S	*	*			trans	74.3	110.5	-176.7	-50.8	176.8	0	0	0	113.5
365	D	32.8	Very low	35.8	Very low	144 Å²	144	141 Å²	141	77%	0.77	75%	0.753	S	S	*	*			cis	84.4	138.7	30	-153.6	-21	0	0	0	114.4
366	S	38.2	Very low	35.8	Very low	84 Å²	84	139.3 Å²	139.3	59%	0.587	75%	0.75	S	S	*	*			trans	72.1	96.7	158.2	-76.9	0	0	0	0	121.5
367	N	37	Very low	36.1	Very low	146 Å²	146	138.8 Å²	138.8	78%	0.781	75%	0.752	S	S	*	*				81.2	149.9	119	-73.5	-63.7	0	0	0	122.4
368	L	37.1	Very low	36.2	Very low	159 Å²	159	140.1 Å²	140.1	83%	0.832	76%	0.757	S	S	*	*			trans	102.1	124	138.8	-143.1	74.5	0	0	0	119.8
369	A	39.5	Very low	36.4	Very low	84 Å²	84	142 Å²	142	69%	0.694	77%	0.77	S	S	*	*			trans	67.7	160	152.2	0	0	0	0	0	119.5
370	Q	39.2	Very low	36.3	Very low	177 Å²	177	139.7 Å²	139.7	83%	0.827	77%	0.772	S	S	*	*			cis	-176	154	-28.8	-176.6	167.7	8.4	0	0	107.4
371	R	35.5	Very low	36.5	Very low	236 Å²	236	140.9 Å²	140.9	89%	0.891	78%	0.779	S	S	*	*			trans	95.8	131.7	-174.7	-65.9	-179.8	167.8	-169.2	-5	113.2
372	R	37	Very low	36.7	Very low	234 Å²	234	137.8 Å²	137.8	88%	0.883	78%	0.778	S	S	*	*			cis	63.3	118.2	25.1	-68.1	-172.2	171.6	-178.2	-2.1	113.5
373	T	41.4	Very low	36.7	Very low	117 Å²	117	137.2 Å²	137.2	72%	0.718	79%	0.789	S	S	*	*			cis	-156.8	172.3	38.9	51.2	0	0	0	0	112.7
374	S	39.9	Very low	37.1	Very low	100 Å²	100	135.9 Å²	135.9	70%	0.699	79%	0.792	S	S	*	*			trans	35.6	144.7	138.1	65	0	0	0	0	122.3
375	S	37.6	Very low	37	Very low	100 Å²	100	133.9 Å²	133.9	70%	0.699	79%	0.791	S	S	*	*			cis	178.9	154.1	-8.8	48.5	0	0	0	0	110
376	T	33.8	Very low	37.1	Very low	136 Å²	136	132 Å²	132	83%	0.834	80%	0.795	S	S	*	*			trans	51.6	104.4	151.9	-42.8	0	0	0	0	119.5
377	A	38.1	Very low	37.1	Very low	102 Å²	102	131.1 Å²	131.1	84%	0.843	80%	0.799	S	S	*	*			trans	-147.6	144.2	149.8	0	0	0	0	0	110
378	T	34.6	Very low	37.6	Very low	134 Å²	134	132 Å²	132	82%	0.822	80%	0.801	S	S	*	*			trans	-89.1	141	-176.7	46.5	0	0	0	0	112.6
379	S	35.8	Very low	38.3	Very low	130 Å²	130	132.4 Å²	132.4	91%	0.909	80%	0.798	S	S	*	*			trans	-164.3	141.8	157.3	-84.1	0	0	0	0	111.1
380	S	34	Very low	38.8	Very low	114 Å²	114	132.3 Å²	132.3	80%	0.797	79%	0.786	S	S	*	*			trans	-111.7	112.5	-177.7	54.5	0	0	0	0	111.8
381	L	40.1	Very low	40.1	Very low	164 Å²	164	127.3 Å²	127.3	86%	0.859	77%	0.771	S	S	*	*			trans	-133.6	114.3	162.3	-67.6	173.9	0	0	0	105.9
382	S	36.2	Very low	42.2	Very low	100 Å²	100	124.4 Å²	124.4	70%	0.699	76%	0.764	S	S	*	*				75.9	118.8	75	-165.7	0	0	0	0	111.6
383	A	33.1	Very low	43.9	Very low	104 Å²	104	116.5 Å²	116.5	86%	0.86	75%	0.749	S	S	*	*			trans	-71.5	131.3	-178.4	0	0	0	0	0	110.8
384	V	40.3	Very low	45.7	Very low	132 Å²	132	113.7 Å²	113.7	80%	0.8	73%	0.732	S	S	*	*			trans	-126.8	126.9	175.9	178.8	0	0	0	0	108.6	A386	V384-A386 PolarHBondContact O-N 2.88Å
385	S	35.1	Very low	47.7	Very low	115 Å²	115	114.7 Å²	114.7	80%	0.804	72%	0.723	S	S	*	*			trans	-63.2	122.5	-172.9	-47.5	0	0	0	0	112.4	G387	S385-G387 PolarHBondContact O-N 3.41Å
386	A	36.1	Very low	49.7	Very low	103 Å²	103	115 Å²	115	85%	0.851	71%	0.714	S	S	*	*			trans	-75.8	63.5	168.5	0	0	0	0	0	111	V384 M388	V384-A386 PolarHBondContact O-N 2.88Å; A386-M388 VanDerWaalsContact C-N 3.33Å; A386-M388 PolarHBondContact O-N 3.08Å
387	G	38.2	Very low	51.8	Low	66 Å²	66	117.7 Å²	117.7	68%	0.68	71%	0.709	S	S	*	*			trans	-65.3	90	172.6	0	0	0	0	0	110.2	S385 E389	S385-G387 PolarHBondContact O-N 3.41Å; G387-E389 PolarHBondContact O-N 3.37Å
388	M	48	Very low	53.5	Low	164 Å²	164	115.7 Å²	115.7	81%	0.808	69%	0.688	S	S	*	*			trans	-72.6	93.3	-171.6	-168.9	163.9	62.7	0	0	111.1	A386 L390	A386-M388 VanDerWaalsContact C-N 3.33Å; A386-M388 PolarHBondContact O-N 3.08Å; M388-L390 VanDerWaalsContact C-N 3.34Å; M388-L390 PolarHBondContact O-N 2.9Å
389	E	50.8	Low	55.5	Low	169 Å²	169	111.6 Å²	111.6	79%	0.79	67%	0.668	S	S	*	*			trans	-52.9	89.9	173	-91.1	-82.4	99.2	0	0	111	G387 S391	G387-E389 PolarHBondContact O-N 3.37Å; E389-S391 PolarHBondContact O-N 3.33Å
390	L	50.2	Low	57.5	Low	81 Å²	81	110.8 Å²	110.8	42%	0.424	65%	0.649	S	S	.	*			trans	-63.8	103.2	172.4	-74.8	168.4	0	0	0	108.5	M388 T394 K395	M388-L390 VanDerWaalsContact C-N 3.34Å; M388-L390 PolarHBondContact O-N 2.9Å; L390-T394 HydrophobicContact CD2-CG2 3.72Å; L390-K395 HydrophobicContact CB-CG 4.01Å; L390-K395 WeakPolarHBondContact O-CD 3.1Å; L390-K395 WeakPolarHBondContact O-CE 3.16Å
391	S	66.4	Low	59.5	Low	73 Å²	73	110.9 Å²	110.9	51%	0.51	64%	0.641	S	S	.	*			trans	-38.2	145	171.9	170.6	0	0	0	0	111.6	E389 A393 T394 K395	E389-S391 PolarHBondContact O-N 3.33Å; S391-A393 PolarHBondContact O-N 2.68Å; S391-A393 VanDerWaalsContact O-N 3.13Å; S391-T394 WeakPolarHBondContact O-CA 3.49Å; S391-T394 WeakPolarHBondContact O-CB 3.46Å; S391-T394 PolarHBondContact O-N 2.69Å; S391-K395 PolarHBondContact O-N 2.85Å
392	K	78.6	Confident	60.9	Low	175 Å²	175	112.2 Å²	112.2	76%	0.761	63%	0.634	S	S	*	*	H	α-helix	trans	-49.8	-42.5	-179.8	-165.5	176.5	-179.8	-176.4	0	111.6	T394 K395 E396	K392-T394 PolarHBondContact O-N 3.09Å; K392-K395 PolarHBondContact O-N 2.83Å; K392-E396 VanDerWaalsContact O-CB 3.22Å; K392-E396 WeakPolarHBondContact O-CB 3.37Å; K392-E396 PolarHBondContact O-N 2.96Å
393	A	74.5	Confident	62.6	Low	67 Å²	67	113.9 Å²	113.9	55%	0.554	63%	0.631	S	S	*	*	H	α-helix	trans	-63.7	-33.8	175.3	0	0	0	0	0	113.8	S391 R397	S391-A393 PolarHBondContact O-N 2.68Å; S391-A393 VanDerWaalsContact O-N 3.13Å; A393-R397 VanDerWaalsContact O-CB 3.29Å; A393-R397 WeakPolarHBondContact O-CB 3.45Å; A393-R397 PolarHBondContact O-N 2.94Å
394	T	79.3	Confident	64	Low	59 Å²	59	118.8 Å²	118.8	36%	0.362	63%	0.627	S	S	.	*	H	α-helix	trans	-75.9	-41.3	176.5	-44	0	0	0	0	111.5	L390 S391 K392 E396 R397 C398	L390-T394 HydrophobicContact CD2-CG2 3.72Å; S391-T394 WeakPolarHBondContact O-CA 3.49Å; S391-T394 WeakPolarHBondContact O-CB 3.46Å; S391-T394 PolarHBondContact O-N 2.69Å; K392-T394 PolarHBondContact O-N 3.09Å; T394-E396 VanDerWaalsContact C-N 3.29Å; T394-E396 PolarHBondContact O-N 3.5Å; T394-R397 PolarHBondContact O-N 2.79Å; T394-C398 WeakPolarHBondContact O-CB 3.4Å; T394-C398 PolarHBondContact O-N 3.11Å; T394-C398 PolarHBondContact O-SG 2.88Å; T394-C398 VanDerWaalsContact O-SG 3.38Å
395	K	81.9	Confident	64.8	Low	120 Å²	120	123.3 Å²	123.3	52%	0.522	63%	0.63	S	S	.	*	H	α-helix	trans	-58	-43.4	170.3	-81.5	171.8	178.2	158.2	0	110.8	L390 S391 K392 C398 A399	L390-K395 HydrophobicContact CB-CG 4.01Å; L390-K395 WeakPolarHBondContact O-CD 3.1Å; L390-K395 WeakPolarHBondContact O-CE 3.16Å; S391-K395 PolarHBondContact O-N 2.85Å; K392-K395 PolarHBondContact O-N 2.83Å; K395-C398 PolarHBondContact O-N 2.82Å; K395-A399 PolarHBondContact O-N 2.82Å
396	E	79.6	Confident	65.8	Low	107 Å²	107	127.9 Å²	127.9	50%	0.5	63%	0.629	S	S	.	*	H	α-helix	trans	-68.4	-42.3	178.5	-170.5	157.5	-154	0	0	112.7	K392 T394 C398 A399 Q400	K392-E396 VanDerWaalsContact O-CB 3.22Å; K392-E396 WeakPolarHBondContact O-CB 3.37Å; K392-E396 PolarHBondContact O-N 2.96Å; T394-E396 VanDerWaalsContact C-N 3.29Å; T394-E396 PolarHBondContact O-N 3.5Å; E396-C398 VanDerWaalsContact C-N 3.33Å; E396-C398 PolarHBondContact O-N 3.43Å; E396-A399 WeakPolarHBondContact O-CB 3.34Å; E396-A399 PolarHBondContact O-N 3Å; E396-A399 VanDerWaalsContact O-N 3.11Å; E396-Q400 WeakPolarHBondContact O-CG 3.37Å; E396-Q400 PolarHBondContact O-N 2.91Å
397	R	77.7	Confident	66.4	Low	193 Å²	193	126.5 Å²	126.5	73%	0.728	62%	0.618	S	S	*	*	H	α-helix	trans	-59.3	-41.6	171.4	-171.6	179.6	-177	-163.6	1.2	111.9	A393 T394 Q400 L401	A393-R397 VanDerWaalsContact O-CB 3.29Å; A393-R397 WeakPolarHBondContact O-CB 3.45Å; A393-R397 PolarHBondContact O-N 2.94Å; T394-R397 PolarHBondContact O-N 2.79Å; R397-Q400 PolarHBondContact O-N 3.5Å; R397-L401 WeakPolarHBondContact O-CB 3.4Å; R397-L401 PolarHBondContact O-N 2.69Å
398	C	72.1	Confident	66.6	Low	59 Å²	59	130.3 Å²	130.3	40%	0.399	62%	0.618	S	S	.	*	H	α-helix	trans	-66.7	-35	174.3	-73.4	0	0	0	0	112.7	T394 K395 E396 R402	T394-C398 WeakPolarHBondContact O-CB 3.4Å; T394-C398 PolarHBondContact O-N 3.11Å; T394-C398 PolarHBondContact O-SG 2.88Å; T394-C398 VanDerWaalsContact O-SG 3.38Å; K395-C398 PolarHBondContact O-N 2.82Å; E396-C398 VanDerWaalsContact C-N 3.33Å; E396-C398 PolarHBondContact O-N 3.43Å; C398-R402 WeakPolarHBondContact O-CG 3.36Å; C398-R402 PolarHBondContact O-N 3.3Å; C398-R402 VanDerWaalsContact O-N 3.1Å
399	A	78.4	Confident	66.4	Low	49 Å²	49	128.1 Å²	128.1	41%	0.405	62%	0.616	S	S	.	*	H	α-helix	trans	-67.6	-46.3	173.9	0	0	0	0	0	111.8	K395 E396 L401 R402 Q403	K395-A399 PolarHBondContact O-N 2.82Å; E396-A399 WeakPolarHBondContact O-CB 3.34Å; E396-A399 PolarHBondContact O-N 3Å; E396-A399 VanDerWaalsContact O-N 3.11Å; A399-L401 VanDerWaalsContact C-N 3.34Å; A399-L401 PolarHBondContact O-N 3.43Å; A399-R402 WeakPolarHBondContact O-CB 3.43Å; A399-R402 PolarHBondContact O-N 2.82Å; A399-Q403 PolarHBondContact O-N 3.37Å
400	Q	77.7	Confident	66.5	Low	112 Å²	112	124.8 Å²	124.8	52%	0.523	61%	0.607	S	S	.	*	H	α-helix	trans	-61.8	-38.8	175.3	-70.9	179.7	6.4	0	0	112.1	E396 R397 Q403 R404	E396-Q400 WeakPolarHBondContact O-CG 3.37Å; E396-Q400 PolarHBondContact O-N 2.91Å; R397-Q400 PolarHBondContact O-N 3.5Å; Q400-Q403 PolarHBondContact O-N 2.77Å; Q400-R404 PolarHBondContact O-N 3.29Å
401	L	75.3	Confident	66.1	Low	117 Å²	117	130.1 Å²	130.1	61%	0.613	63%	0.63	S	S	*	*	H	α-helix	trans	-64.9	-39.1	175.4	-160	76.5	0	0	0	111.8	R397 A399 R405	R397-L401 WeakPolarHBondContact O-CB 3.4Å; R397-L401 PolarHBondContact O-N 2.69Å; A399-L401 VanDerWaalsContact C-N 3.34Å; A399-L401 PolarHBondContact O-N 3.43Å; L401-R405 PolarHBondContact O-N 3.08Å; L401-R405 VanDerWaalsContact O-N 3.12Å
402	R	70.4	Confident	65	Low	192 Å²	192	133.6 Å²	133.6	73%	0.725	63%	0.632	S	S	*	*	H	α-helix	trans	-67.3	-35.9	173	-75.7	172.2	172.1	168.8	-2.4	112.5	C398 A399 R406	C398-R402 WeakPolarHBondContact O-CG 3.36Å; C398-R402 PolarHBondContact O-N 3.3Å; C398-R402 VanDerWaalsContact O-N 3.1Å; A399-R402 WeakPolarHBondContact O-CB 3.43Å; A399-R402 PolarHBondContact O-N 2.82Å; R402-R406 PolarHBondContact O-N 3.24Å
403	Q	69.9	Low	63.2	Low	134 Å²	134	133.7 Å²	133.7	63%	0.626	64%	0.635	S	S	*	*	H	α-helix	trans	-68.9	-46.3	173.3	-78.6	-178.4	-29.7	0	0	112.1	A399 Q400 R405 R406 A407	A399-Q403 PolarHBondContact O-N 3.37Å; Q400-Q403 PolarHBondContact O-N 2.77Å; Q403-R405 VanDerWaalsContact C-N 3.27Å; Q403-R405 PolarHBondContact O-N 2.69Å; Q403-R406 WeakPolarHBondContact O-CA 3.49Å; Q403-R406 WeakPolarHBondContact O-CB 3.36Å; Q403-R406 PolarHBondContact O-N 3.37Å; Q403-A407 PolarHBondContact O-N 3.21Å; Q403-A407 VanDerWaalsContact O-N 3.12Å
404	R	63.2	Low	61.6	Low	207 Å²	207	134.9 Å²	134.9	78%	0.781	64%	0.637	S	S	*	*	H	α-helix	trans	-57.4	-38.7	175.2	-89.2	-170.2	165.3	-156.8	-4.2	112.4	Q400 R406 A407	Q400-R404 PolarHBondContact O-N 3.29Å; R404-R406 PolarHBondContact O-N 2.76Å; R404-A407 PolarHBondContact O-N 2.98Å
405	R	56.4	Low	59.7	Low	228 Å²	228	137.6 Å²	137.6	86%	0.86	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-12.6	173	-82.3	-167.8	168.9	-150.3	-3.4	115.1	L401 Q403	L401-R405 PolarHBondContact O-N 3.08Å; L401-R405 VanDerWaalsContact O-N 3.12Å; Q403-R405 VanDerWaalsContact C-N 3.27Å; Q403-R405 PolarHBondContact O-N 2.69Å
406	R	56.2	Low	57.5	Low	211 Å²	211	137.3 Å²	137.3	80%	0.796	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	-15	171.3	-73.3	-176.9	176.8	-174.9	0.2	113.7	R402 Q403 R404	R402-R406 PolarHBondContact O-N 3.24Å; Q403-R406 WeakPolarHBondContact O-CA 3.49Å; Q403-R406 WeakPolarHBondContact O-CB 3.36Å; Q403-R406 PolarHBondContact O-N 3.37Å; R404-R406 PolarHBondContact O-N 2.76Å
407	A	49.8	Very low	55.4	Low	74 Å²	74	134.9 Å²	134.9	61%	0.612	66%	0.657	S	S	*	*	S	Bend	trans	-94.9	7.8	-169.5	0	0	0	0	0	114.6	Q403 R404 P409	Q403-A407 PolarHBondContact O-N 3.21Å; Q403-A407 VanDerWaalsContact O-N 3.12Å; R404-A407 PolarHBondContact O-N 2.98Å; A407-P409 WeakPolarHBondContact O-CD 3.32Å
408	Q	41.4	Very low	53.6	Low	146 Å²	146	131.4 Å²	131.4	68%	0.682	65%	0.653	S	S	*	*			trans	-116.1	84.7	175.2	-91.8	-74	0.1	0	0	109.8	T410	Q408-T410 PolarHBondContact O-N 2.86Å
409	P	45.4	Very low	52	Low	118 Å²	118	135.6 Å²	135.6	77%	0.766	67%	0.666	S	S	*	*			trans	-72.5	80	160.6	32.8	-32.1	0	0	0	107.8	A407 E411	A407-P409 WeakPolarHBondContact O-CD 3.32Å; P409-E411 PolarHBondContact O-N 2.89Å
410	T	51.5	Low	50.4	Low	98 Å²	98	137.1 Å²	137.1	60%	0.601	67%	0.667	S	S	*	*			trans	-57.3	126.4	166.1	-55.2	0	0	0	0	107.8	Q408 R412	Q408-T410 PolarHBondContact O-N 2.86Å; T410-R412 VanDerWaalsContact C-N 3.29Å; T410-R412 PolarHBondContact O-N 3.21Å
411	E	43.4	Very low	48.7	Very low	193 Å²	193	139.4 Å²	139.4	90%	0.902	68%	0.677	S	S	*	*			trans	-64.3	89.1	176.4	-170.4	177.3	172.4	0	0	109.2	P409 Q413	P409-E411 PolarHBondContact O-N 2.89Å; E411-Q413 PolarHBondContact O-N 2.99Å
412	R	41.7	Very low	47.5	Very low	147 Å²	147	136.1 Å²	136.1	56%	0.555	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-81.1	118.2	179.9	-73.5	-179.2	175.6	-166.9	-1.3	108.2	T410 A507	T410-R412 VanDerWaalsContact C-N 3.29Å; T410-R412 PolarHBondContact O-N 3.21Å; R412-A507 PolarHBondContact NH1-O 2.88Å
413	Q	41	Very low	46.5	Very low	176 Å²	176	128.2 Å²	128.2	82%	0.822	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-56.2	139.7	169.2	-70.5	-169.7	-29.2	0	0	109.9	E411 L415	E411-Q413 PolarHBondContact O-N 2.99Å; Q413-L415 PolarHBondContact O-N 3.44Å
414	P	41.2	Very low	45.7	Very low	92 Å²	92	131.2 Å²	131.2	60%	0.597	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-59.9	138.4	169.7	27	-33.6	0	0	0	108.9
415	L	39.9	Very low	45.3	Very low	117 Å²	117	127.1 Å²	127.1	61%	0.613	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-62	137.5	171.4	-69.6	173	0	0	0	108.3	Q413 A417	Q413-L415 PolarHBondContact O-N 3.44Å; L415-A417 PolarHBondContact O-N 3.44Å
416	P	35.4	Very low	45.3	Very low	114 Å²	114	117.2 Å²	117.2	74%	0.74	61%	0.607	S	S	*	*			trans	-60.9	114.5	170.9	26.3	-32.6	0	0	0	107.4	L418	P416-L418 PolarHBondContact O-N 2.93Å
417	A	36.4	Very low	45.4	Very low	55 Å²	55	112.3 Å²	112.3	46%	0.455	60%	0.601	S	S	.	*			trans	-48.3	107.9	-168.2	0	0	0	0	0	111	L415 H419	L415-A417 PolarHBondContact O-N 3.44Å; A417-H419 PolarHBondContact O-N 3.09Å; A417-H419 PolarHBondContact O-ND1 2.92Å; A417-H419 VanDerWaalsContact O-ND1 3.14Å
418	L	38.3	Very low	46	Very low	121 Å²	121	109.8 Å²	109.8	63%	0.634	58%	0.579	S	S	*	*			trans	-70.7	82.9	173.1	-88.2	171.5	0	0	0	107.3	P416 L420	P416-L418 PolarHBondContact O-N 2.93Å; L418-L420 PolarHBondContact O-N 2.77Å
419	H	39.1	Very low	47.2	Very low	147 Å²	147	106.8 Å²	106.8	68%	0.681	57%	0.572	S	S	*	*			trans	-61.3	75.2	153.3	-68.1	80.5	0	0	0	107.2	A417 H421	A417-H419 PolarHBondContact O-N 3.09Å; A417-H419 PolarHBondContact O-ND1 2.92Å; A417-H419 VanDerWaalsContact O-ND1 3.14Å; H419-H421 PolarHBondContact O-CD2 2.68Å; H419-H421 VanDerWaalsContact O-CD2 3.24Å; H419-H421 PolarHBondContact O-N 2.89Å
420	L	44.1	Very low	48.5	Very low	80 Å²	80	102.8 Å²	102.8	42%	0.419	54%	0.544	S	S	.	.			trans	-56.4	76.6	149.7	-91.7	161.1	0	0	0	105.7	L418 L422 Y475	L418-L420 PolarHBondContact O-N 2.77Å; L420-L422 WeakPolarHBondContact O-CD1 3.32Å; L420-L422 PolarHBondContact O-N 3.24Å; L420-Y475 HydrophobicContact CD1-CD2 4.44Å; L420-Y475 HydrophobicContact CD1-CE2 4.31Å
421	H	42.7	Very low	49.5	Very low	160 Å²	160	98.5 Å²	98.5	74%	0.741	52%	0.518	S	S	*	.			trans	-48.5	109.6	171	-74.8	-91	0	0	0	105.8	H419 S423 S428	H419-H421 PolarHBondContact O-CD2 2.68Å; H419-H421 VanDerWaalsContact O-CD2 3.24Å; H419-H421 PolarHBondContact O-N 2.89Å; H421-S423 PolarHBondContact O-N 3.03Å; H421-S428 PolarHBondContact O-OG 3Å
422	L	51	Low	50.9	Low	48 Å²	48	92.3 Å²	92.3	25%	0.251	50%	0.495	S	S	.	.			trans	-65.3	114.5	179.6	-70.5	89.8	0	0	0	105.5	L420 K424 S428 L430 Y460 P472	L420-L422 WeakPolarHBondContact O-CD1 3.32Å; L420-L422 PolarHBondContact O-N 3.24Å; L422-K424 PolarHBondContact O-N 3.25Å; L422-S428 WeakPolarHBondContact CA-OG 3.43Å; L422-L430 HydrophobicContact CD2-CD2 3.49Å; L422-L430 VanDerWaalsContact CD2-CD2 3.49Å; L422-Y460 HydrophobicContact CD2-CE1 4.24Å; L422-P472 HydrophobicContact CD1-CB 3.25Å; L422-P472 HydrophobicContact CD1-CG 3.8Å; L422-P472 HydrophobicContact CD2-CB 3.8Å; L422-P472 HydrophobicContact CG-CB 4.04Å
423	S	48.5	Very low	52.6	Low	27 Å²	27	87 Å²	87	19%	0.189	49%	0.486	C	S	.	.			trans	-52.9	140.9	-171.6	49.1	0	0	0	0	108.8	H421 D425 G426 T427 S428	H421-S423 PolarHBondContact O-N 3.03Å; S423-D425 PolarHBondContact O-N 3.49Å; S423-G426 PolarHBondContact O-N 2.82Å; S423-T427 WeakPolarHBondContact OG-CA 3.27Å; S423-T427 PolarHBondContact OG-N 2.79Å; S423-T427 PolarHBondContact OG-OG1 3.26Å; S423-S428 PolarHBondContact N-OG 3.33Å; S423-S428 PolarHBondContact OG-N 2.89Å; S423-S428 VanDerWaalsContact OG-N 3.17Å
424	K	52.4	Low	54.6	Low	196 Å²	196	80 Å²	80	85%	0.852	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-23.3	178.6	-159.2	172.2	-176.8	177.9	0	111.4	L422	L422-K424 PolarHBondContact O-N 3.25Å
425	D	56.1	Low	56.4	Low	122 Å²	122	80.3 Å²	80.3	65%	0.652	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-0.6	178.1	-27.9	-60.9	0	0	0	113.9	S423 T427	S423-D425 PolarHBondContact O-N 3.49Å; D425-T427 VanDerWaalsContact C-N 3.35Å; D425-T427 PolarHBondContact O-N 2.77Å
426	G	55.3	Low	58.4	Low	19 Å²	19	77.2 Å²	77.2	20%	0.196	43%	0.425	C	S	.	.	S	Bend	trans	75.5	11.8	173.8	0	0	0	0	0	116.4	S423 R436	S423-G426 PolarHBondContact O-N 2.82Å; G426-R436 PolarHBondContact O-NE 3.43Å; G426-R436 VanDerWaalsContact O-NE 3.1Å; G426-R436 PolarHBondContact O-NH2 3.24Å
427	T	58.8	Low	60.4	Low	109 Å²	109	72.3 Å²	72.3	67%	0.669	39%	0.394	S	S	*	.			trans	-86.5	-17	-173.5	50.9	0	0	0	0	115.8	S423 D425	S423-T427 WeakPolarHBondContact OG-CA 3.27Å; S423-T427 PolarHBondContact OG-N 2.79Å; S423-T427 PolarHBondContact OG-OG1 3.26Å; D425-T427 VanDerWaalsContact C-N 3.35Å; D425-T427 PolarHBondContact O-N 2.77Å
428	S	62.5	Low	62.2	Low	20 Å²	20	73.4 Å²	73.4	14%	0.14	40%	0.397	C	S	.	.	S	Bend	trans	-64.9	133.8	175.1	-54.8	0	0	0	0	111	H421 L422 S423 R436	H421-S428 PolarHBondContact O-OG 3Å; L422-S428 WeakPolarHBondContact CA-OG 3.43Å; S423-S428 PolarHBondContact N-OG 3.33Å; S423-S428 PolarHBondContact OG-N 2.89Å; S423-S428 VanDerWaalsContact OG-N 3.17Å; S428-R436 PolarHBondContact O-NH2 3.48Å
429	P	66.3	Low	63.6	Low	83 Å²	83	68.8 Å²	68.8	54%	0.539	37%	0.373	S	S	.	.			trans	-64.3	154.7	-176.2	30.2	-37	0	0	0	111.4	Y475	P429-Y475 VanDerWaalsContact C-OH 3.28Å; P429-Y475 WeakPolarHBondContact CB-OH 3.34Å; P429-Y475 PolarHBondContact O-OH 3.47Å
430	L	72.7	Confident	64.8	Low	35 Å²	35	67 Å²	67	18%	0.183	37%	0.372	C	S	.	.			trans	-106.4	153.8	178.9	-67.1	-178.4	0	0	0	111.8	L422 W434 R436 Y460 Y475	L422-L430 HydrophobicContact CD2-CD2 3.49Å; L422-L430 VanDerWaalsContact CD2-CD2 3.49Å; L430-W434 HydrophobicContact CB-CB 4.33Å; L430-W434 HydrophobicContact CD1-CB 4.44Å; L430-R436 HydrophobicContact CD1-CB 4.07Å; L430-Y460 HydrophobicContact CD1-CD1 4.05Å; L430-Y460 HydrophobicContact CD1-CE1 4.29Å; L430-Y460 HydrophobicContact CD2-CD1 4.07Å; L430-Y460 HydrophobicContact CD2-CE1 3.84Å; L430-Y475 PolarHBondContact N-OH 2.93Å; L430-Y475 PolarHBondContact O-OH 3.11Å
431	P	73.2	Confident	65.5	Low	8 Å²	8	71.9 Å²	71.9	5%	0.052	39%	0.39	C	S	.	.			trans	-56.1	145.1	167.3	-21.4	33.2	0	0	0	111.8	G433 W434 P473 V474 Y475	P431-G433 PolarHBondContact O-N 3.24Å; P431-W434 WeakPolarHBondContact O-CB 3.37Å; P431-W434 PolarHBondContact O-N 2.92Å; P431-W434 VanDerWaalsContact O-N 3.11Å; P431-P473 WeakPolarHBondContact CD-O 3.38Å; P431-P473 HydrophobicContact CG-CB 3.71Å; P431-P473 WeakPolarHBondContact CG-O 3.35Å; P431-V474 WeakPolarHBondContact CG-O 3.29Å; P431-Y475 VanDerWaalsContact CA-CE1 3.41Å; P431-Y475 HydrophobicContact CB-CD1 3.88Å; P431-Y475 HydrophobicContact CB-CE1 4.06Å; P431-Y475 HydrophobicContact CB-CG 4.43Å; P431-Y475 HydrophobicContact CG-CD1 3.8Å; P431-Y475 HydrophobicContact CG-CD2 4.19Å; P431-Y475 HydrophobicContact CG-CE1 4.05Å; P431-Y475 HydrophobicContact CG-CE2 4.38Å; P431-Y475 HydrophobicContact CG-CG 3.88Å
432	P	72.7	Confident	65.9	Low	63 Å²	63	72.8 Å²	72.8	41%	0.409	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	137.4	-174.8	-29.8	36	0	0	0	114.3	P310 W434	P310-P432 HydrophobicContact CB-CB 3.58Å; P310-P432 HydrophobicContact CB-CG 4.31Å; P310-P432 WeakPolarHBondContact O-CB 3.27Å; P310-P432 WeakPolarHBondContact O-CG 3.39Å; P432-W434 PolarHBondContact O-N 3.5Å
433	G	77.5	Confident	65.7	Low	36 Å²	36	75.3 Å²	75.3	37%	0.371	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	78	-4.3	-179	0	0	0	0	0	115.4	P431 H462 V463	P431-G433 PolarHBondContact O-N 3.24Å; G433-H462 VanDerWaalsContact C-ND1 3.33Å; G433-H462 CarbonylContact O-C 3.55Å; G433-H462 WeakPolarHBondContact O-CA 3.47Å; G433-H462 PolarHBondContact O-ND1 3.41Å; G433-V463 WeakPolarHBondContact O-CG2 3.34Å; G433-V463 PolarHBondContact O-N 2.9Å
434	W	81.9	Confident	65.7	Low	29 Å²	29	78.8 Å²	78.8	11%	0.11	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	139	168	-71	86.6	0	0	0	111.4	L430 P431 P432 H462 Q467 R469 P473	L430-W434 HydrophobicContact CB-CB 4.33Å; L430-W434 HydrophobicContact CD1-CB 4.44Å; P431-W434 WeakPolarHBondContact O-CB 3.37Å; P431-W434 PolarHBondContact O-N 2.92Å; P431-W434 VanDerWaalsContact O-N 3.11Å; P432-W434 PolarHBondContact O-N 3.5Å; W434-H462 HydrophobicContact CD2-CB 3.86Å; W434-H462 AromaticContact CE2-CD2 3.59Å; W434-H462 AromaticContact CE2-CG 3.79Å; W434-H462 HydrophobicContact CE3-CB 3.9Å; W434-H462 HydrophobicContact CH2-CB 3.84Å; W434-H462 HydrophobicContact CZ2-CB 3.8Å; W434-H462 AromaticContact CZ2-CD2 3.73Å; W434-H462 HydrophobicContact CZ3-CB 3.89Å; W434-H462 AromaticContact NE1-CD2 3.5Å; W434-H462 AromaticContact NE1-CG 3.92Å; W434-H462 AromaticContact NE1-NE2 3.88Å; W434-Q467 HydrophobicContact CH2-CB 4.37Å; W434-R469 VanDerWaalsContact CE2-NH2 3.34Å; W434-R469 HydrophobicContact CH2-CG 3.89Å; W434-R469 HydrophobicContact CZ3-CG 3.7Å; W434-P473 HydrophobicContact CB-CB 4.28Å; W434-P473 HydrophobicContact CB-CG 3.92Å; W434-P473 HydrophobicContact CD2-CB 4Å; W434-P473 HydrophobicContact CD2-CG 3.47Å; W434-P473 VanDerWaalsContact CD2-CG 3.47Å; W434-P473 HydrophobicContact CE3-CG 3.54Å; W434-P473 HydrophobicContact CG-CB 3.86Å; W434-P473 HydrophobicContact CG-CG 3.64Å; W434-P473 HydrophobicContact CZ3-CG 4.29Å
435	Q	80.6	Confident	65.2	Low	97 Å²	97	78 Å²	78	45%	0.453	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	147.8	174.2	-72.8	-171.9	11.4	0	0	111	Y460 Y461 V463	Q435-Y460 WeakPolarHBondContact O-CA 3.49Å; Q435-Y461 HydrophobicContact CB-CD1 3.9Å; Q435-Y461 HydrophobicContact CB-CE1 3.42Å; Q435-Y461 VanDerWaalsContact CB-CE1 3.42Å; Q435-Y461 HydrophobicContact CG-CE1 4.32Å; Q435-Y461 PolarHBondContact N-O 2.85Å; Q435-Y461 PolarHBondContact O-N 3.42Å; Q435-Y461 PolarHBondContact OE1-OH 2.84Å; Q435-V463 HydrophobicContact CG-CG2 3.84Å
436	R	81.8	Confident	64.3	Low	53 Å²	53	76.3 Å²	76.3	20%	0.2	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	125.3	175.2	-155.1	-176.1	-40.2	-91.1	-2.9	108.8	G426 S428 L430 Y458 Y460	G426-R436 PolarHBondContact O-NE 3.43Å; G426-R436 VanDerWaalsContact O-NE 3.1Å; G426-R436 PolarHBondContact O-NH2 3.24Å; S428-R436 PolarHBondContact O-NH2 3.48Å; L430-R436 HydrophobicContact CD1-CB 4.07Å; R436-Y458 VanDerWaalsContact CD-CG 3.48Å; R436-Y458 HydrophobicContact CG-CD1 3.75Å; R436-Y458 HydrophobicContact CG-CD2 4.38Å; R436-Y458 HydrophobicContact CG-CG 3.67Å; R436-Y460 HydrophobicContact CB-CD1 4.5Å; R436-Y460 HydrophobicContact CB-CE1 4.34Å; R436-Y460 HydrophobicContact CG-CD1 4.24Å; R436-Y460 HydrophobicContact CG-CE1 3.75Å; R436-Y460 VanDerWaalsContact NH1-CE1 3.31Å; R436-Y460 PolarHBondContact NH1-OH 2.92Å
437	A	76	Confident	63.5	Low	10 Å²	10	83.7 Å²	83.7	8%	0.083	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	136.8	176.2	0	0	0	0	0	110.3	Y458 Y459 Y461	A437-Y458 CarbonylContact O-C 3.55Å; A437-Y458 VanDerWaalsContact O-CA 3.23Å; A437-Y458 WeakPolarHBondContact O-CA 3.34Å; A437-Y458 WeakPolarHBondContact O-CB 3.33Å; A437-Y459 HydrophobicContact CB-CD1 4.08Å; A437-Y459 HydrophobicContact CB-CD2 4.07Å; A437-Y459 HydrophobicContact CB-CE1 3.61Å; A437-Y459 HydrophobicContact CB-CE2 3.6Å; A437-Y459 HydrophobicContact CB-CG 4.29Å; A437-Y459 PolarHBondContact N-O 3.44Å; A437-Y459 PolarHBondContact O-N 2.86Å; A437-Y461 HydrophobicContact CB-CD1 4.26Å
438	P	74.5	Confident	62.5	Low	79 Å²	79	87 Å²	87	51%	0.513	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	137.4	-179.5	28.3	-34.2	0	0	0	111.1	T440 Y459	P438-T440 VanDerWaalsContact C-N 3.31Å; P438-T440 HydrophobicContact CG-CG2 4.5Å; P438-T440 PolarHBondContact O-N 3.04Å; P438-Y459 WeakPolarHBondContact O-CE1 3.4Å
439	N	67	Low	61.4	Low	23 Å²	23	90.4 Å²	90.4	12%	0.123	51%	0.506	C	S	.	.			trans	-76.4	82.7	174.1	-173.4	3	0	0	0	109.8	K441 R442 Y456 A457 W470	N439-K441 PolarHBondContact O-N 2.84Å; N439-R442 WeakPolarHBondContact O-CB 3.25Å; N439-R442 PolarHBondContact O-N 2.83Å; N439-Y456 PolarHBondContact ND2-O 3.47Å; N439-Y456 VanDerWaalsContact ND2-O 3.07Å; N439-A457 WeakPolarHBondContact CB-O 3.48Å; N439-A457 PolarHBondContact N-O 3.22Å; N439-W470 HydrophobicContact CB-CZ3 4.22Å; N439-W470 WeakPolarHBondContact ND2-CZ3 3.27Å
440	T	65.4	Low	60	Low	109 Å²	109	90.4 Å²	90.4	67%	0.669	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-59.7	-18.9	-173.1	52.7	0	0	0	0	114.4	P438 R442 S443	P438-T440 VanDerWaalsContact C-N 3.31Å; P438-T440 HydrophobicContact CG-CG2 4.5Å; P438-T440 PolarHBondContact O-N 3.04Å; T440-R442 PolarHBondContact O-N 3.44Å; T440-R442 VanDerWaalsContact O-N 3.15Å; T440-S443 WeakPolarHBondContact O-CB 3.45Å; T440-S443 PolarHBondContact O-N 2.82Å
441	K	59.4	Low	58.5	Low	183 Å²	183	94.8 Å²	94.8	80%	0.796	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-58.9	-20.9	171.5	-66.3	-170.4	175.7	-172	0	113.5	N439 S443	N439-K441 PolarHBondContact O-N 2.84Å; K441-S443 VanDerWaalsContact C-N 3.27Å; K441-S443 PolarHBondContact O-N 3.04Å
442	R	50.3	Low	57	Low	180 Å²	180	99.8 Å²	99.8	68%	0.679	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-82.2	2.7	-179.3	-143	179	-154.8	-84.1	-2.8	114.2	N439 T440	N439-R442 WeakPolarHBondContact O-CB 3.25Å; N439-R442 PolarHBondContact O-N 2.83Å; T440-R442 PolarHBondContact O-N 3.44Å; T440-R442 VanDerWaalsContact O-N 3.15Å
443	S	47	Very low	55.8	Low	101 Å²	101	101.3 Å²	101.3	71%	0.706	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-101.1	-0.9	-170.7	-166	0	0	0	0	115	T440 K441	T440-S443 WeakPolarHBondContact O-CB 3.45Å; T440-S443 PolarHBondContact O-N 2.82Å; K441-S443 VanDerWaalsContact C-N 3.27Å; K441-S443 PolarHBondContact O-N 3.04Å
444	T	47.7	Very low	54.1	Low	99 Å²	99	101.5 Å²	101.5	61%	0.607	59%	0.594	S	S	*	*	S	Bend	trans	-147	139.6	-178.2	-44	0	0	0	0	108.8
445	E	43	Very low	52.8	Low	181 Å²	181	104.8 Å²	104.8	85%	0.846	62%	0.617	S	S	*	*			trans	57.8	102.4	177.4	-72.8	143	-129.9	0	0	115.4
446	G	36.4	Very low	51.7	Low	86 Å²	86	104.4 Å²	104.4	89%	0.887	61%	0.612	S	S	*	*			trans	-82.5	123.6	169.4	0	0	0	0	0	110.7
447	Q	39.4	Very low	51.1	Low	174 Å²	174	104.1 Å²	104.1	81%	0.813	62%	0.622	S	S	*	*			trans	-148.5	117.7	168.6	-153	166.4	10.7	0	0	109.5	S449	Q447-S449 PolarHBondContact O-N 2.93Å; Q447-S449 VanDerWaalsContact O-N 3.09Å
448	D	36.7	Very low	51	Low	179 Å²	179	107.2 Å²	107.2	96%	0.957	63%	0.632	S	S	*	*			trans	-68.9	105	176.2	-69.5	-61	0	0	0	109.8
449	S	41	Very low	51.3	Low	91 Å²	91	107.5 Å²	107.5	64%	0.636	62%	0.623	S	S	*	*			trans	-130.9	125.3	173.3	48.2	0	0	0	0	108.6	Q447 D451	Q447-S449 PolarHBondContact O-N 2.93Å; Q447-S449 VanDerWaalsContact O-N 3.09Å; S449-D451 PolarHBondContact O-N 3.33Å
450	G	36.1	Very low	52	Low	82 Å²	82	106.9 Å²	106.9	85%	0.845	62%	0.619	S	S	*	*			trans	-72.6	13.7	-157.4	0	0	0	0	0	117.6	S452	G450-S452 PolarHBondContact O-N 3.27Å
451	D	40.6	Very low	52.9	Low	128 Å²	128	104.6 Å²	104.6	68%	0.684	60%	0.599	S	S	*	*			trans	-77	120	-177.9	-70.3	-25.7	0	0	0	110.8	S449 S453 G454	S449-D451 PolarHBondContact O-N 3.33Å; D451-S453 PolarHBondContact O-N 3.33Å; D451-G454 PolarHBondContact O-N 3.24Å
452	S	42.5	Very low	54	Low	112 Å²	112	96.5 Å²	96.5	78%	0.783	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-65.8	9.8	-172.6	-65.6	0	0	0	0	115.8	G450 T455	G450-S452 PolarHBondContact O-N 3.27Å; S452-T455 PolarHBondContact O-OG1 2.88Å
453	S	46.7	Very low	55.3	Low	95 Å²	95	90.5 Å²	90.5	66%	0.664	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-79.7	-19.7	173.4	69.2	0	0	0	0	113.9	D451 T455	D451-S453 PolarHBondContact O-N 3.33Å; S453-T455 PolarHBondContact O-N 3.01Å; S453-T455 VanDerWaalsContact O-N 3.17Å
454	G	43.1	Very low	56.6	Low	41 Å²	41	94.6 Å²	94.6	42%	0.423	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-73.7	0.9	-178.8	0	0	0	0	0	116.1	D451	D451-G454 PolarHBondContact O-N 3.24Å
455	T	54.1	Low	58.1	Low	97 Å²	97	91.1 Å²	91.1	60%	0.595	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-73.3	-32.3	-164.8	-47.2	0	0	0	0	113.8	S452 S453	S452-T455 PolarHBondContact O-OG1 2.88Å; S453-T455 PolarHBondContact O-N 3.01Å; S453-T455 VanDerWaalsContact O-N 3.17Å
456	Y	57.9	Low	59.9	Low	89 Å²	89	91.4 Å²	91.4	35%	0.349	52%	0.519	S	S	.	.			trans	-96.9	120.1	-174.2	-63.9	-68.8	0	0	0	113.2	N439 Y458 W470 D471	N439-Y456 PolarHBondContact ND2-O 3.47Å; N439-Y456 VanDerWaalsContact ND2-O 3.07Å; Y456-Y458 WeakPolarHBondContact CB-O 3.4Å; Y456-Y458 PolarHBondContact O-N 3.46Å; Y456-W470 HydrophobicContact CD2-CB 3.9Å; Y456-W470 HydrophobicContact CE2-CB 4.28Å; Y456-D471 PolarHBondContact OH-OD1 2.86Å; Y456-D471 VanDerWaalsContact OH-OD1 3.04Å
457	A	67.6	Low	61.7	Low	48 Å²	48	91.1 Å²	91.1	40%	0.397	50%	0.495	S	S	.	.	S	Bend	trans	-70.6	-12.5	174.2	0	0	0	0	0	113.8	N439	N439-A457 WeakPolarHBondContact CB-O 3.48Å; N439-A457 PolarHBondContact N-O 3.22Å
458	Y	74.4	Confident	63.6	Low	74 Å²	74	87.7 Å²	87.7	29%	0.29	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	154.9	-178.2	-55.3	-80.5	0	0	0	110.1	R436 A437 Y456	R436-Y458 VanDerWaalsContact CD-CG 3.48Å; R436-Y458 HydrophobicContact CG-CD1 3.75Å; R436-Y458 HydrophobicContact CG-CD2 4.38Å; R436-Y458 HydrophobicContact CG-CG 3.67Å; A437-Y458 CarbonylContact O-C 3.55Å; A437-Y458 VanDerWaalsContact O-CA 3.23Å; A437-Y458 WeakPolarHBondContact O-CA 3.34Å; A437-Y458 WeakPolarHBondContact O-CB 3.33Å; Y456-Y458 WeakPolarHBondContact CB-O 3.4Å; Y456-Y458 PolarHBondContact O-N 3.46Å
459	Y	80	Confident	65.4	Low	85 Å²	85	83.1 Å²	83.1	33%	0.333	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	160.8	158.1	62.9	-80.7	0	0	0	109.4	A437 P438 T468	A437-Y459 HydrophobicContact CB-CD1 4.08Å; A437-Y459 HydrophobicContact CB-CD2 4.07Å; A437-Y459 HydrophobicContact CB-CE1 3.61Å; A437-Y459 HydrophobicContact CB-CE2 3.6Å; A437-Y459 HydrophobicContact CB-CG 4.29Å; A437-Y459 PolarHBondContact N-O 3.44Å; A437-Y459 PolarHBondContact O-N 2.86Å; P438-Y459 WeakPolarHBondContact O-CE1 3.4Å; Y459-T468 HydrophobicContact CD2-CG2 4.41Å
460	Y	83	Confident	67	Low	11 Å²	11	84.6 Å²	84.6	4%	0.043	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	129	179.6	-58.5	-84	0	0	0	109.1	L422 L430 Q435 R436 T468 R469 W470 D471 P472 P473	L422-Y460 HydrophobicContact CD2-CE1 4.24Å; L430-Y460 HydrophobicContact CD1-CD1 4.05Å; L430-Y460 HydrophobicContact CD1-CE1 4.29Å; L430-Y460 HydrophobicContact CD2-CD1 4.07Å; L430-Y460 HydrophobicContact CD2-CE1 3.84Å; Q435-Y460 WeakPolarHBondContact O-CA 3.49Å; R436-Y460 HydrophobicContact CB-CD1 4.5Å; R436-Y460 HydrophobicContact CB-CE1 4.34Å; R436-Y460 HydrophobicContact CG-CD1 4.24Å; R436-Y460 HydrophobicContact CG-CE1 3.75Å; R436-Y460 VanDerWaalsContact NH1-CE1 3.31Å; R436-Y460 PolarHBondContact NH1-OH 2.92Å; Y460-T468 CarbonylContact O-C 3.28Å; Y460-T468 VanDerWaalsContact O-CA 3.29Å; Y460-T468 WeakPolarHBondContact O-CA 3.38Å; Y460-R469 PolarHBondContact N-O 3.21Å; Y460-R469 PolarHBondContact O-N 3.14Å; Y460-W470 WeakPolarHBondContact CD2-O 3.39Å; Y460-W470 WeakPolarHBondContact CE2-O 3.39Å; Y460-D471 WeakPolarHBondContact CD2-O 3.29Å; Y460-P472 HydrophobicContact CE2-CB 4.08Å; Y460-P472 HydrophobicContact CE2-CG 3.95Å; Y460-P473 HydrophobicContact CD1-CG 4.05Å; Y460-P473 HydrophobicContact CG-CG 3.99Å
461	Y	84	Confident	68.7	Low	61 Å²	61	85.1 Å²	85.1	24%	0.239	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	140.7	175.7	90	-86.6	0	0	0	110.6	Q435 A437 V463 Q467	Q435-Y461 HydrophobicContact CB-CD1 3.9Å; Q435-Y461 HydrophobicContact CB-CE1 3.42Å; Q435-Y461 VanDerWaalsContact CB-CE1 3.42Å; Q435-Y461 HydrophobicContact CG-CE1 4.32Å; Q435-Y461 PolarHBondContact N-O 2.85Å; Q435-Y461 PolarHBondContact O-N 3.42Å; Q435-Y461 PolarHBondContact OE1-OH 2.84Å; A437-Y461 HydrophobicContact CB-CD1 4.26Å; Y461-V463 HydrophobicContact CE2-CB 4.41Å; Y461-V463 HydrophobicContact CE2-CG2 3.88Å; Y461-Q467 WeakPolarHBondContact CA-O 3.31Å
462	H	82	Confident	70	Confident	13 Å²	13	80.7 Å²	80.7	6%	0.06	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	118.7	176.1	-164.5	-9.5	0	0	0	109.5	G433 W434 R464 T465 R466 Q467	G433-H462 VanDerWaalsContact C-ND1 3.33Å; G433-H462 CarbonylContact O-C 3.55Å; G433-H462 WeakPolarHBondContact O-CA 3.47Å; G433-H462 PolarHBondContact O-ND1 3.41Å; W434-H462 HydrophobicContact CD2-CB 3.86Å; W434-H462 AromaticContact CE2-CD2 3.59Å; W434-H462 AromaticContact CE2-CG 3.79Å; W434-H462 HydrophobicContact CE3-CB 3.9Å; W434-H462 HydrophobicContact CH2-CB 3.84Å; W434-H462 HydrophobicContact CZ2-CB 3.8Å; W434-H462 AromaticContact CZ2-CD2 3.73Å; W434-H462 HydrophobicContact CZ3-CB 3.89Å; W434-H462 AromaticContact NE1-CD2 3.5Å; W434-H462 AromaticContact NE1-CG 3.92Å; W434-H462 AromaticContact NE1-NE2 3.88Å; H462-R464 VanDerWaalsContact C-N 3.31Å; H462-R464 PolarHBondContact O-N 3.25Å; H462-T465 HydrophobicContact CB-CG2 4.46Å; H462-T465 WeakPolarHBondContact CB-OG1 3.48Å; H462-T465 WeakPolarHBondContact CD2-CG2 3.21Å; H462-T465 PolarHBondContact CD2-OG1 3.22Å; H462-R466 VanDerWaalsContact O-CA 3.29Å; H462-R466 WeakPolarHBondContact O-CA 3.2Å; H462-R466 PolarHBondContact O-N 2.92Å; H462-Q467 PolarHBondContact N-O 2.73Å
463	V	78.5	Confident	71.2	Confident	53 Å²	53	75.5 Å²	75.5	32%	0.321	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-41.8	-172.8	-178.2	0	0	0	0	112.3	G433 Q435 Y461 R466	G433-V463 WeakPolarHBondContact O-CG2 3.34Å; G433-V463 PolarHBondContact O-N 2.9Å; Q435-V463 HydrophobicContact CG-CG2 3.84Å; Y461-V463 HydrophobicContact CE2-CB 4.41Å; Y461-V463 HydrophobicContact CE2-CG2 3.88Å; V463-R466 PolarHBondContact O-NE 3.2Å
464	R	73.4	Confident	72	Confident	187 Å²	187	75 Å²	75	71%	0.706	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-45.4	-178	176.2	174.8	162	130.8	-4.1	113.2	H462	H462-R464 VanDerWaalsContact C-N 3.31Å; H462-R464 PolarHBondContact O-N 3.25Å
465	T	80.5	Confident	72.9	Confident	27 Å²	27	74.5 Å²	74.5	17%	0.166	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-11.4	-171.2	81.2	0	0	0	0	112.8	H462 Q467 P497	H462-T465 HydrophobicContact CB-CG2 4.46Å; H462-T465 WeakPolarHBondContact CB-OG1 3.48Å; H462-T465 WeakPolarHBondContact CD2-CG2 3.21Å; H462-T465 PolarHBondContact CD2-OG1 3.22Å; T465-Q467 PolarHBondContact O-N 3.22Å; T465-Q467 WeakPolarHBondContact OG1-CB 3.48Å; T465-Q467 WeakPolarHBondContact OG1-CG 3.33Å; T465-Q467 PolarHBondContact OG1-N 3.02Å; T465-Q467 PolarHBondContact OG1-OE1 2.7Å; T465-P497 HydrophobicContact CG2-CB 3.97Å; T465-P497 HydrophobicContact CG2-CG 3.48Å; T465-P497 VanDerWaalsContact CG2-CG 3.48Å
466	R	80.5	Confident	72.8	Confident	187 Å²	187	73.1 Å²	73.1	71%	0.706	34%	0.343	S	S	*	.			trans	60	0.4	-174.4	-52.1	-57.9	-175.7	171.2	-1.4	115.4	H462 V463	H462-R466 VanDerWaalsContact O-CA 3.29Å; H462-R466 WeakPolarHBondContact O-CA 3.2Å; H462-R466 PolarHBondContact O-N 2.92Å; V463-R466 PolarHBondContact O-NE 3.2Å
467	Q	73.9	Confident	72.8	Confident	80 Å²	80	74.8 Å²	74.8	37%	0.374	35%	0.349	S	S	.	.			trans	-59.2	137.2	173.5	-68.4	165.5	-30.9	0	0	110.8	W434 Y461 H462 T465	W434-Q467 HydrophobicContact CH2-CB 4.37Å; Y461-Q467 WeakPolarHBondContact CA-O 3.31Å; H462-Q467 PolarHBondContact N-O 2.73Å; T465-Q467 PolarHBondContact O-N 3.22Å; T465-Q467 WeakPolarHBondContact OG1-CB 3.48Å; T465-Q467 WeakPolarHBondContact OG1-CG 3.33Å; T465-Q467 PolarHBondContact OG1-N 3.02Å; T465-Q467 PolarHBondContact OG1-OE1 2.7Å
468	T	78.7	Confident	72.1	Confident	101 Å²	101	73.8 Å²	73.8	62%	0.62	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.6	132.4	174.4	52.4	0	0	0	0	110.1	Y459 Y460	Y459-T468 HydrophobicContact CD2-CG2 4.41Å; Y460-T468 CarbonylContact O-C 3.28Å; Y460-T468 VanDerWaalsContact O-CA 3.29Å; Y460-T468 WeakPolarHBondContact O-CA 3.38Å
469	R	74.7	Confident	70.9	Confident	83 Å²	83	72.6 Å²	72.6	31%	0.313	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	152.5	171.5	51.2	174.8	159.1	177	-9.5	111.5	W434 Y460 D471	W434-R469 VanDerWaalsContact CE2-NH2 3.34Å; W434-R469 HydrophobicContact CH2-CG 3.89Å; W434-R469 HydrophobicContact CZ3-CG 3.7Å; Y460-R469 PolarHBondContact N-O 3.21Å; Y460-R469 PolarHBondContact O-N 3.14Å; R469-D471 WeakPolarHBondContact CD-O 3.36Å; R469-D471 WeakPolarHBondContact CG-O 3.34Å
470	W	74.8	Confident	69.3	Low	123 Å²	123	72.2 Å²	72.2	47%	0.466	35%	0.346	S	S	.	.	S	Bend	trans	-81.3	-41	173.2	-68	106.8	0	0	0	111	N439 Y456 Y460	N439-W470 HydrophobicContact CB-CZ3 4.22Å; N439-W470 WeakPolarHBondContact ND2-CZ3 3.27Å; Y456-W470 HydrophobicContact CD2-CB 3.9Å; Y456-W470 HydrophobicContact CE2-CB 4.28Å; Y460-W470 WeakPolarHBondContact CD2-O 3.39Å; Y460-W470 WeakPolarHBondContact CE2-O 3.39Å
471	D	72.5	Confident	67.8	Low	92 Å²	92	77.1 Å²	77.1	49%	0.492	38%	0.379	S	S	.	.	S	Bend	trans	-69.8	144	177.8	-56	-76	0	0	0	112.2	Y456 Y460 R469	Y456-D471 PolarHBondContact OH-OD1 2.86Å; Y456-D471 VanDerWaalsContact OH-OD1 3.04Å; Y460-D471 WeakPolarHBondContact CD2-O 3.29Å; R469-D471 WeakPolarHBondContact CD-O 3.36Å; R469-D471 WeakPolarHBondContact CG-O 3.34Å
472	P	67.5	Low	66.2	Low	36 Å²	36	79.3 Å²	79.3	23%	0.234	40%	0.399	C	S	.	.			trans	-62.5	142.5	-178.5	-25.8	35.7	0	0	0	115	L422 Y460 V474	L422-P472 HydrophobicContact CD1-CB 3.25Å; L422-P472 HydrophobicContact CD1-CG 3.8Å; L422-P472 HydrophobicContact CD2-CB 3.8Å; L422-P472 HydrophobicContact CG-CB 4.04Å; Y460-P472 HydrophobicContact CE2-CB 4.08Å; Y460-P472 HydrophobicContact CE2-CG 3.95Å; P472-V474 PolarHBondContact O-N 3.1Å; P472-V474 VanDerWaalsContact O-N 3.09Å
473	P	68.3	Low	64.7	Low	3 Å²	3	83.9 Å²	83.9	2%	0.019	42%	0.424	C	S	.	.			trans	-61.5	106.8	166	-27.8	37	0	0	0	113.2	P431 W434 Y460	P431-P473 WeakPolarHBondContact CD-O 3.38Å; P431-P473 HydrophobicContact CG-CB 3.71Å; P431-P473 WeakPolarHBondContact CG-O 3.35Å; W434-P473 HydrophobicContact CB-CB 4.28Å; W434-P473 HydrophobicContact CB-CG 3.92Å; W434-P473 HydrophobicContact CD2-CB 4Å; W434-P473 HydrophobicContact CD2-CG 3.47Å; W434-P473 VanDerWaalsContact CD2-CG 3.47Å; W434-P473 HydrophobicContact CE3-CG 3.54Å; W434-P473 HydrophobicContact CG-CB 3.86Å; W434-P473 HydrophobicContact CG-CG 3.64Å; W434-P473 HydrophobicContact CZ3-CG 4.29Å; Y460-P473 HydrophobicContact CD1-CG 4.05Å; Y460-P473 HydrophobicContact CG-CG 3.99Å
474	V	63.2	Low	62.9	Low	85 Å²	85	85.6 Å²	85.6	52%	0.515	43%	0.434	S	S	.	.			trans	-67.6	144.5	163.1	-173	0	0	0	0	109.4	P431 P472 D478 A479	P431-V474 WeakPolarHBondContact CG-O 3.29Å; P472-V474 PolarHBondContact O-N 3.1Å; P472-V474 VanDerWaalsContact O-N 3.09Å; V474-D478 VanDerWaalsContact CG1-C 3.49Å; V474-D478 HydrophobicContact CG1-CB 3.68Å; V474-A479 HydrophobicContact CG1-CB 4.45Å
475	Y	61.3	Low	61.4	Low	29 Å²	29	84.3 Å²	84.3	11%	0.114	44%	0.441	C	S	.	.			trans	-75.7	154.3	174.6	-76.3	-88.3	0	0	0	111.7	L420 P429 L430 P431 W477 D478 A479	L420-Y475 HydrophobicContact CD1-CD2 4.44Å; L420-Y475 HydrophobicContact CD1-CE2 4.31Å; P429-Y475 VanDerWaalsContact C-OH 3.28Å; P429-Y475 WeakPolarHBondContact CB-OH 3.34Å; P429-Y475 PolarHBondContact O-OH 3.47Å; L430-Y475 PolarHBondContact N-OH 2.93Å; L430-Y475 PolarHBondContact O-OH 3.11Å; P431-Y475 VanDerWaalsContact CA-CE1 3.41Å; P431-Y475 HydrophobicContact CB-CD1 3.88Å; P431-Y475 HydrophobicContact CB-CE1 4.06Å; P431-Y475 HydrophobicContact CB-CG 4.43Å; P431-Y475 HydrophobicContact CG-CD1 3.8Å; P431-Y475 HydrophobicContact CG-CD2 4.19Å; P431-Y475 HydrophobicContact CG-CE1 4.05Å; P431-Y475 HydrophobicContact CG-CE2 4.38Å; P431-Y475 HydrophobicContact CG-CG 3.88Å; Y475-W477 VanDerWaalsContact CB-CE2 3.43Å; Y475-W477 AromaticContact CD1-CE2 3.9Å; Y475-W477 AromaticContact CD1-CH2 3.32Å; Y475-W477 HydrophobicContact CD1-CH2 3.32Å; Y475-W477 AromaticContact CD1-CZ2 3.17Å; Y475-W477 HydrophobicContact CD1-CZ2 3.17Å; Y475-W477 HydrophobicContact CD1-CZ3 4.13Å; Y475-W477 HydrophobicContact CD2-CZ2 4.12Å; Y475-W477 AromaticContact CE1-CH2 3.78Å; Y475-W477 HydrophobicContact CE1-CH2 3.78Å; Y475-W477 AromaticContact CE1-CZ2 3.72Å; Y475-W477 HydrophobicContact CE1-CZ2 3.72Å; Y475-W477 AromaticContact CG-CE2 3.7Å; Y475-W477 HydrophobicContact CG-CH2 4.01Å; Y475-W477 AromaticContact CG-CZ2 3.4Å; Y475-W477 HydrophobicContact CG-CZ2 3.4Å; Y475-W477 AromaticContact CG-NE1 3.98Å; Y475-W477 PolarHBondContact O-N 2.96Å; Y475-D478 WeakPolarHBondContact CB-OD2 3.44Å; Y475-D478 PolarHBondContact O-N 2.69Å; Y475-A479 PolarHBondContact O-N 3.26Å; Y475-A479 VanDerWaalsContact O-N 3.16Å
476	P	53.1	Low	59.5	Low	68 Å²	68	89.8 Å²	89.8	44%	0.442	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-10.3	-178.9	-23.2	34.3	0	0	0	116.2	W500	P476-W500 HydrophobicContact CG-CZ3 4.38Å
477	W	56.5	Low	57.4	Low	125 Å²	125	83.2 Å²	83.2	47%	0.473	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	-12.3	175.5	57.9	69.3	0	0	0	113.4	Y475	Y475-W477 VanDerWaalsContact CB-CE2 3.43Å; Y475-W477 AromaticContact CD1-CE2 3.9Å; Y475-W477 AromaticContact CD1-CH2 3.32Å; Y475-W477 HydrophobicContact CD1-CH2 3.32Å; Y475-W477 AromaticContact CD1-CZ2 3.17Å; Y475-W477 HydrophobicContact CD1-CZ2 3.17Å; Y475-W477 HydrophobicContact CD1-CZ3 4.13Å; Y475-W477 HydrophobicContact CD2-CZ2 4.12Å; Y475-W477 AromaticContact CE1-CH2 3.78Å; Y475-W477 HydrophobicContact CE1-CH2 3.78Å; Y475-W477 AromaticContact CE1-CZ2 3.72Å; Y475-W477 HydrophobicContact CE1-CZ2 3.72Å; Y475-W477 AromaticContact CG-CE2 3.7Å; Y475-W477 HydrophobicContact CG-CH2 4.01Å; Y475-W477 AromaticContact CG-CZ2 3.4Å; Y475-W477 HydrophobicContact CG-CZ2 3.4Å; Y475-W477 AromaticContact CG-NE1 3.98Å; Y475-W477 PolarHBondContact O-N 2.96Å
478	D	52.7	Low	56	Low	26 Å²	26	89.1 Å²	89.1	14%	0.139	49%	0.486	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-9.2	175.6	-66.6	-41.1	0	0	0	111.4	V474 Y475 D480	V474-D478 VanDerWaalsContact CG1-C 3.49Å; V474-D478 HydrophobicContact CG1-CB 3.68Å; Y475-D478 WeakPolarHBondContact CB-OD2 3.44Å; Y475-D478 PolarHBondContact O-N 2.69Å; D478-D480 PolarHBondContact O-N 2.79Å
479	A	50.1	Low	54.2	Low	50 Å²	50	90.1 Å²	90.1	41%	0.413	49%	0.492	S	S	.	.	S	Bend	trans	-69.8	120.7	168.1	0	0	0	0	0	109.4	V474 Y475	V474-A479 HydrophobicContact CG1-CB 4.45Å; Y475-A479 PolarHBondContact O-N 3.26Å; Y475-A479 VanDerWaalsContact O-N 3.16Å
480	D	45.8	Very low	52.6	Low	77 Å²	77	89.7 Å²	89.7	41%	0.412	51%	0.514	S	S	.	.			trans	-63.7	132.5	179.2	-173.7	52.2	0	0	0	109.7	D478 T482 D483	D478-D480 PolarHBondContact O-N 2.79Å; D480-T482 PolarHBondContact O-N 3.02Å; D480-T482 WeakPolarHBondContact OD2-CB 3.4Å; D480-T482 PolarHBondContact OD2-OG1 2.93Å; D480-D483 HydrophobicContact CB-CB 4.26Å; D480-D483 VanDerWaalsContact O-CB 3.31Å; D480-D483 WeakPolarHBondContact O-CB 3.48Å; D480-D483 PolarHBondContact O-N 3.36Å
481	P	51.8	Low	51	Low	113 Å²	113	92.4 Å²	92.4	73%	0.734	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-13	-180	24.7	-35.7	0	0	0	113.8
482	T	51.5	Low	49.8	Very low	107 Å²	107	95.7 Å²	95.7	66%	0.656	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-12.1	171.7	-0.7	0	0	0	0	113.8	D480 T484	D480-T482 PolarHBondContact O-N 3.02Å; D480-T482 WeakPolarHBondContact OD2-CB 3.4Å; D480-T482 PolarHBondContact OD2-OG1 2.93Å; T482-T484 PolarHBondContact O-N 3.39Å; T482-T484 PolarHBondContact O-OG1 3.41Å
483	D	49.2	Very low	48.9	Very low	110 Å²	110	98 Å²	98	59%	0.588	56%	0.56	S	S	*	*			trans	-75.1	47.3	172.7	-163.5	24.9	0	0	0	111.4	D480 L485	D480-D483 HydrophobicContact CB-CB 4.26Å; D480-D483 VanDerWaalsContact O-CB 3.31Å; D480-D483 WeakPolarHBondContact O-CB 3.48Å; D480-D483 PolarHBondContact O-N 3.36Å; D483-L485 PolarHBondContact O-N 3.44Å
484	T	41.7	Very low	48	Very low	88 Å²	88	104.2 Å²	104.2	54%	0.54	60%	0.6	S	S	.	*			trans	-62.8	111.3	163	-16.3	0	0	0	0	106.7	T482 L486	T482-T484 PolarHBondContact O-N 3.39Å; T482-T484 PolarHBondContact O-OG1 3.41Å; T484-L486 HydrophobicContact CG2-CD1 4Å; T484-L486 HydrophobicContact CG2-CD2 4.44Å; T484-L486 HydrophobicContact CG2-CG 3.79Å; T484-L486 PolarHBondContact O-N 3.09Å
485	L	41.8	Very low	47.2	Very low	161 Å²	161	108 Å²	108	84%	0.843	61%	0.612	S	S	*	*			trans	-69.7	64.8	167.1	-69	175.7	0	0	0	110.3	D483 G487	D483-L485 PolarHBondContact O-N 3.44Å; L485-G487 PolarHBondContact O-N 3.04Å
486	L	39.3	Very low	46.3	Very low	142 Å²	142	108.2 Å²	108.2	74%	0.743	62%	0.619	S	S	*	*			trans	-75	54.2	167.5	-72.5	165.7	0	0	0	109.6	T484 E488	T484-L486 HydrophobicContact CG2-CD1 4Å; T484-L486 HydrophobicContact CG2-CD2 4.44Å; T484-L486 HydrophobicContact CG2-CG 3.79Å; T484-L486 PolarHBondContact O-N 3.09Å; L486-E488 PolarHBondContact O-N 2.94Å
487	G	37.5	Very low	46	Very low	48 Å²	48	107.5 Å²	107.5	50%	0.495	62%	0.615	S	S	.	*			trans	-65.1	119	155.4	0	0	0	0	0	107.1	L485 T489	L485-G487 PolarHBondContact O-N 3.04Å; G487-T489 CarbonylContact O-C 3.56Å; G487-T489 PolarHBondContact O-N 2.99Å
488	E	43.6	Very low	45.4	Very low	204 Å²	204	107 Å²	107	95%	0.953	61%	0.614	S	S	*	*	S	Bend	trans	-62.9	-13.9	-169.8	-61.7	177.3	113.2	0	0	113.6	L486 G490	L486-E488 PolarHBondContact O-N 2.94Å; E488-G490 VanDerWaalsContact C-N 3.32Å; E488-G490 PolarHBondContact O-N 2.97Å
489	T	41.8	Very low	44.8	Very low	122 Å²	122	111.6 Å²	111.6	75%	0.748	64%	0.638	S	S	*	*			trans	-71.1	83.1	164	50.6	0	0	0	0	110.8	G487 E491	G487-T489 CarbonylContact O-C 3.56Å; G487-T489 PolarHBondContact O-N 2.99Å; T489-E491 PolarHBondContact O-N 3.3Å
490	G	39.9	Very low	44.6	Very low	75 Å²	75	116.9 Å²	116.9	77%	0.773	65%	0.648	S	S	*	*			trans	-69.6	50.7	175.1	0	0	0	0	0	114.7	E488 D492	E488-G490 VanDerWaalsContact C-N 3.32Å; E488-G490 PolarHBondContact O-N 2.97Å; G490-D492 PolarHBondContact O-N 3.1Å
491	E	42.4	Very low	44.5	Very low	179 Å²	179	115.7 Å²	115.7	84%	0.836	65%	0.654	S	S	*	*			trans	-79.1	100	165	-62.6	-158.7	161	0	0	108.5	T489 D493	T489-E491 PolarHBondContact O-N 3.3Å; E491-D493 PolarHBondContact O-N 2.93Å
492	D	46.5	Very low	43.7	Very low	161 Å²	161	112.8 Å²	112.8	86%	0.861	64%	0.635	S	S	*	*			trans	-50.2	111.1	161.2	-93.3	-51.2	0	0	0	108.2	G490 P494	G490-D492 PolarHBondContact O-N 3.1Å; D492-P494 WeakPolarHBondContact O-CD 3.4Å
493	D	48.5	Very low	43.3	Very low	86 Å²	86	109.9 Å²	109.9	46%	0.46	62%	0.622	S	S	.	*			trans	-80.3	101.8	167.5	176.3	7	0	0	0	108.5	E491 E495 A496	E491-D493 PolarHBondContact O-N 2.93Å; D493-E495 PolarHBondContact O-N 3.06Å; D493-E495 VanDerWaalsContact OD1-CA 3.31Å; D493-E495 WeakPolarHBondContact OD1-CA 3.37Å; D493-E495 WeakPolarHBondContact OD1-CB 3.45Å; D493-E495 PolarHBondContact OD1-N 2.92Å; D493-A496 HydrophobicContact CB-CB 4.06Å; D493-A496 WeakPolarHBondContact O-CB 3.13Å; D493-A496 PolarHBondContact O-N 3.08Å; D493-A496 PolarHBondContact OD1-N 3.02Å; D493-A496 WeakPolarHBondContact OD2-CB 3.33Å; D493-A496 PolarHBondContact OD2-N 3.29Å
494	P	49.4	Very low	43.2	Very low	132 Å²	132	109.2 Å²	109.2	86%	0.857	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	-10.5	179	35.7	-38.7	0	0	0	112.1	D492	D492-P494 WeakPolarHBondContact O-CD 3.4Å
495	E	47.5	Very low	43.3	Very low	166 Å²	166	113.5 Å²	113.5	78%	0.776	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	-5	-178.7	-155.8	158.9	-119.4	0	0	111.9	D493 P497	D493-E495 PolarHBondContact O-N 3.06Å; D493-E495 VanDerWaalsContact OD1-CA 3.31Å; D493-E495 WeakPolarHBondContact OD1-CA 3.37Å; D493-E495 WeakPolarHBondContact OD1-CB 3.45Å; D493-E495 PolarHBondContact OD1-N 2.92Å; E495-P497 WeakPolarHBondContact O-CD 3.28Å; E495-P497 WeakPolarHBondContact O-CG 3.28Å
496	A	42.6	Very low	43.8	Very low	32 Å²	32	113.1 Å²	113.1	26%	0.264	62%	0.624	S	S	.	*			trans	-66.9	104.5	168.4	0	0	0	0	0	111.1	D493 Y498	D493-A496 HydrophobicContact CB-CB 4.06Å; D493-A496 WeakPolarHBondContact O-CB 3.13Å; D493-A496 PolarHBondContact O-N 3.08Å; D493-A496 PolarHBondContact OD1-N 3.02Å; D493-A496 WeakPolarHBondContact OD2-CB 3.33Å; D493-A496 PolarHBondContact OD2-N 3.29Å; A496-Y498 PolarHBondContact O-N 3.37Å
497	P	46.2	Very low	44.5	Very low	53 Å²	53	109 Å²	109	34%	0.344	61%	0.611	S	S	.	*	S	Bend	trans	-77	9.6	-162.3	-25.6	43.1	0	0	0	116.2	T465 E495	T465-P497 HydrophobicContact CG2-CB 3.97Å; T465-P497 HydrophobicContact CG2-CG 3.48Å; T465-P497 VanDerWaalsContact CG2-CG 3.48Å; E495-P497 WeakPolarHBondContact O-CD 3.28Å; E495-P497 WeakPolarHBondContact O-CG 3.28Å
498	Y	44	Very low	45.7	Very low	116 Å²	116	110.5 Å²	110.5	46%	0.455	61%	0.61	S	S	.	*	S	Bend	trans	-136.7	114.6	167.5	-70	-79.4	0	0	0	109.1	A496 W500	A496-Y498 PolarHBondContact O-N 3.37Å; Y498-W500 VanDerWaalsContact O-CD1 3.25Å; Y498-W500 PolarHBondContact O-N 2.93Å; Y498-W500 PolarHBondContact O-NE1 3.46Å
499	N	40.4	Very low	47.3	Very low	122 Å²	122	102.5 Å²	102.5	65%	0.652	58%	0.576	S	S	*	*			trans	-66.9	99.4	162.1	178.1	-42	0	0	0	107.7	G501 C502	N499-G501 PolarHBondContact O-N 3.35Å; N499-G501 WeakPolarHBondContact OD1-CA 3.2Å; N499-G501 PolarHBondContact OD1-N 3.1Å; N499-G501 VanDerWaalsContact OD1-N 3.08Å; N499-C502 WeakPolarHBondContact O-CB 3.48Å; N499-C502 PolarHBondContact O-N 3.48Å
500	W	45.6	Very low	48.9	Very low	160 Å²	160	102.6 Å²	102.6	61%	0.606	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-61.9	-24.4	-175.8	-60.7	102.2	0	0	0	113	P476 Y498 C502 A503	P476-W500 HydrophobicContact CG-CZ3 4.38Å; Y498-W500 VanDerWaalsContact O-CD1 3.25Å; Y498-W500 PolarHBondContact O-N 2.93Å; Y498-W500 PolarHBondContact O-NE1 3.46Å; W500-C502 PolarHBondContact O-N 3.38Å; W500-C502 VanDerWaalsContact O-N 3.08Å; W500-A503 VanDerWaalsContact O-CB 3.26Å; W500-A503 WeakPolarHBondContact O-CB 3.4Å; W500-A503 PolarHBondContact O-N 3.12Å
501	G	44.3	Very low	50.8	Low	53 Å²	53	106.2 Å²	106.2	55%	0.546	56%	0.564	S	S	.	*	G	3₁₀ helix	trans	-58.9	-19.4	172.5	0	0	0	0	0	114.3	N499 A503 S504	N499-G501 PolarHBondContact O-N 3.35Å; N499-G501 WeakPolarHBondContact OD1-CA 3.2Å; N499-G501 PolarHBondContact OD1-N 3.1Å; N499-G501 VanDerWaalsContact OD1-N 3.08Å; G501-A503 VanDerWaalsContact C-N 3.33Å; G501-S504 PolarHBondContact O-OG 3.25Å
502	C	35.1	Very low	52.6	Low	51 Å²	51	102.7 Å²	102.7	35%	0.345	55%	0.548	S	S	.	.	G	3₁₀ helix	trans	-73.1	-16.6	171.6	-77.3	0	0	0	0	114.5	N499 W500 S504 R505 F506	N499-C502 WeakPolarHBondContact O-CB 3.48Å; N499-C502 PolarHBondContact O-N 3.48Å; W500-C502 PolarHBondContact O-N 3.38Å; W500-C502 VanDerWaalsContact O-N 3.08Å; C502-S504 VanDerWaalsContact C-N 3.29Å; C502-S504 PolarHBondContact O-N 3.35Å; C502-R505 WeakPolarHBondContact O-CB 3.43Å; C502-R505 PolarHBondContact O-N 3.02Å; C502-F506 WeakPolarHBondContact O-CD2 3.38Å
503	A	42.7	Very low	54.1	Low	46 Å²	46	96.6 Å²	96.6	38%	0.38	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-58.1	-40.9	-177.4	0	0	0	0	0	112.3	W500 G501 R505 F506 A507	W500-A503 VanDerWaalsContact O-CB 3.26Å; W500-A503 WeakPolarHBondContact O-CB 3.4Å; W500-A503 PolarHBondContact O-N 3.12Å; G501-A503 VanDerWaalsContact C-N 3.33Å; A503-R505 PolarHBondContact O-N 3.5Å; A503-R505 VanDerWaalsContact O-N 3.1Å; A503-F506 CarbonylContact O-C 3.5Å; A503-F506 VanDerWaalsContact O-C 3.31Å; A503-F506 PolarHBondContact O-N 2.92Å; A503-A507 PolarHBondContact O-N 3.28Å
504	S	45.9	Very low	55.7	Low	97 Å²	97	97.5 Å²	97.5	68%	0.678	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-53.5	-30.1	174.2	63.8	0	0	0	0	114.1	G501 C502 F506	G501-S504 PolarHBondContact O-OG 3.25Å; C502-S504 VanDerWaalsContact C-N 3.29Å; C502-S504 PolarHBondContact O-N 3.35Å; S504-F506 VanDerWaalsContact C-N 3.33Å
505	R	44.1	Very low	57.3	Low	178 Å²	178	92.7 Å²	92.7	67%	0.672	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-83.9	-9.6	-178.9	-60.8	-179.5	56.5	-178.5	-7.8	113.4	C502 A503	C502-R505 WeakPolarHBondContact O-CB 3.43Å; C502-R505 PolarHBondContact O-N 3.02Å; A503-R505 PolarHBondContact O-N 3.5Å; A503-R505 VanDerWaalsContact O-N 3.1Å
506	F	52.1	Low	59	Low	152 Å²	152	88.6 Å²	88.6	67%	0.667	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-133.8	38.3	-179	-58.8	-75.5	0	0	0	110.9	C502 A503 S504 V508	C502-F506 WeakPolarHBondContact O-CD2 3.38Å; A503-F506 CarbonylContact O-C 3.5Å; A503-F506 VanDerWaalsContact O-C 3.31Å; A503-F506 PolarHBondContact O-N 2.92Å; S504-F506 VanDerWaalsContact C-N 3.33Å; F506-V508 WeakPolarHBondContact O-CG2 3.32Å; F506-V508 PolarHBondContact O-N 3.04Å
507	A	55.6	Low	60.9	Low	55 Å²	55	93.7 Å²	93.7	46%	0.455	48%	0.483	S	S	.	.			trans	-69.9	78.7	175.9	0	0	0	0	0	111.3	R412 A503	R412-A507 PolarHBondContact NH1-O 2.88Å; A503-A507 PolarHBondContact O-N 3.28Å
508	V	61.9	Low	62.8	Low	80 Å²	80	95.5 Å²	95.5	49%	0.485	49%	0.489	S	S	.	.			trans	-61.8	131.1	177.3	-165.3	0	0	0	0	109.6	F506 E512 I513	F506-V508 WeakPolarHBondContact O-CG2 3.32Å; F506-V508 PolarHBondContact O-N 3.04Å; V508-E512 WeakPolarHBondContact CA-OE2 3.47Å; V508-E512 HydrophobicContact CG1-CB 3.41Å; V508-E512 VanDerWaalsContact CG1-CB 3.41Å; V508-I513 HydrophobicContact CB-CG1 4.19Å; V508-I513 HydrophobicContact CG1-CG1 3.71Å
509	T	76.7	Confident	64.9	Low	37 Å²	37	98 Å²	98	23%	0.227	50%	0.498	C	S	.	.			trans	-74	160.8	175.6	71.6	0	0	0	0	111.5	E511 E512 I513	T509-E511 PolarHBondContact O-N 3.33Å; T509-E511 PolarHBondContact OG1-N 2.87Å; T509-E512 PolarHBondContact N-OE2 2.87Å; T509-E512 PolarHBondContact O-N 3Å; T509-E512 VanDerWaalsContact O-N 3.11Å; T509-E512 WeakPolarHBondContact OG1-CG 3.41Å; T509-E512 PolarHBondContact OG1-N 2.86Å; T509-I513 WeakPolarHBondContact O-CG1 3.49Å; T509-I513 PolarHBondContact O-N 3.45Å
510	H	75.9	Confident	67.2	Low	124 Å²	124	94.8 Å²	94.8	57%	0.574	48%	0.483	S	S	*	.	H	α-helix	trans	-56.3	-40.7	171.6	-175.5	61.7	0	0	0	111.7	E512 I513 E514	H510-E512 PolarHBondContact O-N 3.49Å; H510-I513 WeakPolarHBondContact O-CB 3.29Å; H510-I513 PolarHBondContact O-N 3.08Å; H510-E514 WeakPolarHBondContact O-CG 3.44Å; H510-E514 PolarHBondContact O-N 3.22Å
511	E	79.9	Confident	69.2	Low	151 Å²	151	89.7 Å²	89.7	71%	0.706	46%	0.463	S	S	*	.	H	α-helix	trans	-60.4	-42.5	173.8	-177.1	-172.1	-173.9	0	0	112.5	T509 E514 A515	T509-E511 PolarHBondContact O-N 3.33Å; T509-E511 PolarHBondContact OG1-N 2.87Å; E511-E514 PolarHBondContact O-N 3.02Å; E511-A515 WeakPolarHBondContact O-CB 3.28Å; E511-A515 PolarHBondContact O-N 2.84Å
512	E	79.7	Confident	71.4	Confident	105 Å²	105	93.5 Å²	93.5	49%	0.491	47%	0.467	S	S	.	.	H	α-helix	trans	-67.4	-35.8	175.9	-74.5	174.9	137.1	0	0	112	V508 T509 H510 M516	V508-E512 WeakPolarHBondContact CA-OE2 3.47Å; V508-E512 HydrophobicContact CG1-CB 3.41Å; V508-E512 VanDerWaalsContact CG1-CB 3.41Å; T509-E512 PolarHBondContact N-OE2 2.87Å; T509-E512 PolarHBondContact O-N 3Å; T509-E512 VanDerWaalsContact O-N 3.11Å; T509-E512 WeakPolarHBondContact OG1-CG 3.41Å; T509-E512 PolarHBondContact OG1-N 2.86Å; H510-E512 PolarHBondContact O-N 3.49Å; E512-M516 WeakPolarHBondContact O-CB 3.38Å; E512-M516 PolarHBondContact O-N 3.47Å
513	I	78.8	Confident	74.1	Confident	33 Å²	33	99.7 Å²	99.7	17%	0.169	48%	0.483	C	S	.	.	H	α-helix	trans	-65.6	-48.1	173	-67.9	169.7	0	0	0	110.5	V508 T509 H510 M516 Y517	V508-I513 HydrophobicContact CB-CG1 4.19Å; V508-I513 HydrophobicContact CG1-CG1 3.71Å; T509-I513 WeakPolarHBondContact O-CG1 3.49Å; T509-I513 PolarHBondContact O-N 3.45Å; H510-I513 WeakPolarHBondContact O-CB 3.29Å; H510-I513 PolarHBondContact O-N 3.08Å; I513-M516 WeakPolarHBondContact O-CB 3.4Å; I513-M516 PolarHBondContact O-N 2.98Å; I513-Y517 HydrophobicContact CG2-CD2 3.68Å; I513-Y517 HydrophobicContact CG2-CE2 3.53Å; I513-Y517 VanDerWaalsContact O-CD2 3.28Å; I513-Y517 WeakPolarHBondContact O-CD2 3.27Å; I513-Y517 PolarHBondContact O-N 3.27Å
514	E	81.3	Confident	76.5	Confident	104 Å²	104	101.7 Å²	101.7	49%	0.486	49%	0.487	S	S	.	.	H	α-helix	trans	-63.1	-42.1	176.1	-72.2	-156.2	123.4	0	0	111.8	H510 E511 M516 Y517 N518	H510-E514 WeakPolarHBondContact O-CG 3.44Å; H510-E514 PolarHBondContact O-N 3.22Å; E511-E514 PolarHBondContact O-N 3.02Å; E514-M516 VanDerWaalsContact C-N 3.31Å; E514-M516 PolarHBondContact O-N 2.87Å; E514-Y517 PolarHBondContact O-N 2.85Å; E514-N518 VanDerWaalsContact O-CB 3.31Å; E514-N518 WeakPolarHBondContact O-CB 3.34Å; E514-N518 VanDerWaalsContact O-CG 3.29Å; E514-N518 PolarHBondContact O-N 2.84Å; E514-N518 PolarHBondContact O-ND2 3.09Å
515	A	82.1	Confident	78.7	Confident	31 Å²	31	97.4 Å²	97.4	26%	0.256	46%	0.456	S	S	.	.	H	α-helix	trans	-62.2	-37.5	174.8	0	0	0	0	0	112	E511 R519	E511-A515 WeakPolarHBondContact O-CB 3.28Å; E511-A515 PolarHBondContact O-N 2.84Å; A515-R519 WeakPolarHBondContact O-CB 3.17Å; A515-R519 WeakPolarHBondContact O-CD 3.27Å; A515-R519 WeakPolarHBondContact O-CG 3.36Å; A515-R519 PolarHBondContact O-N 3.06Å
516	M	84.5	Confident	81	Confident	80 Å²	80	93.2 Å²	93.2	39%	0.394	44%	0.444	S	S	.	.	H	α-helix	trans	-63.8	-51.7	172.2	-177.8	-171.9	69.4	0	0	111.3	E512 I513 E514 N518 R519 V520	E512-M516 WeakPolarHBondContact O-CB 3.38Å; E512-M516 PolarHBondContact O-N 3.47Å; I513-M516 WeakPolarHBondContact O-CB 3.4Å; I513-M516 PolarHBondContact O-N 2.98Å; E514-M516 VanDerWaalsContact C-N 3.31Å; E514-M516 PolarHBondContact O-N 2.87Å; M516-N518 VanDerWaalsContact C-N 3.3Å; M516-N518 PolarHBondContact O-N 2.87Å; M516-R519 PolarHBondContact O-N 2.93Å; M516-V520 WeakPolarHBondContact O-CG2 3.47Å; M516-V520 PolarHBondContact O-N 3.47Å
517	Y	81.7	Confident	83	Confident	140 Å²	140	93.5 Å²	93.5	55%	0.549	44%	0.441	S	S	.	.	H	α-helix	trans	-59.9	-39.7	178.3	-82	-61.9	0	0	0	112.5	I513 E514 V520 R521	I513-Y517 HydrophobicContact CG2-CD2 3.68Å; I513-Y517 HydrophobicContact CG2-CE2 3.53Å; I513-Y517 VanDerWaalsContact O-CD2 3.28Å; I513-Y517 WeakPolarHBondContact O-CD2 3.27Å; I513-Y517 PolarHBondContact O-N 3.27Å; E514-Y517 PolarHBondContact O-N 2.85Å; Y517-V520 PolarHBondContact O-N 3.31Å; Y517-R521 WeakPolarHBondContact O-CB 3.39Å; Y517-R521 PolarHBondContact O-N 3.36Å
518	N	86.4	Confident	84.8	Confident	91 Å²	91	92.6 Å²	92.6	49%	0.487	43%	0.427	S	S	.	.	H	α-helix	trans	-65.5	-41.8	176.7	-75.6	-41.1	0	0	0	111.9	E514 M516 R521 Q522	E514-N518 VanDerWaalsContact O-CB 3.31Å; E514-N518 WeakPolarHBondContact O-CB 3.34Å; E514-N518 VanDerWaalsContact O-CG 3.29Å; E514-N518 PolarHBondContact O-N 2.84Å; E514-N518 PolarHBondContact O-ND2 3.09Å; M516-N518 VanDerWaalsContact C-N 3.3Å; M516-N518 PolarHBondContact O-N 2.87Å; N518-R521 PolarHBondContact O-N 3.49Å; N518-Q522 WeakPolarHBondContact O-CB 3.2Å; N518-Q522 PolarHBondContact O-N 2.75Å
519	R	88.5	Confident	86.3	Confident	167 Å²	167	88.8 Å²	88.8	63%	0.63	40%	0.404	S	S	*	.	H	α-helix	trans	-64.1	-44.5	174	-72.1	167.4	-171.9	163.5	6.6	112.8	A515 M516 Q522 R523	A515-R519 WeakPolarHBondContact O-CB 3.17Å; A515-R519 WeakPolarHBondContact O-CD 3.27Å; A515-R519 WeakPolarHBondContact O-CG 3.36Å; A515-R519 PolarHBondContact O-N 3.06Å; M516-R519 PolarHBondContact O-N 2.93Å; R519-Q522 PolarHBondContact O-N 3.29Å; R519-R523 WeakPolarHBondContact O-CG 3.36Å; R519-R523 PolarHBondContact O-N 3.37Å; R519-R523 VanDerWaalsContact O-N 3.12Å
520	V	87.1	Confident	87	Confident	55 Å²	55	90.4 Å²	90.4	33%	0.333	41%	0.41	S	S	.	.	H	α-helix	trans	-62.3	-46	176.8	171.1	0	0	0	0	110	M516 Y517 Q522 R523 I524	M516-V520 WeakPolarHBondContact O-CG2 3.47Å; M516-V520 PolarHBondContact O-N 3.47Å; Y517-V520 PolarHBondContact O-N 3.31Å; V520-Q522 PolarHBondContact O-N 2.92Å; V520-R523 PolarHBondContact O-N 2.85Å; V520-I524 HydrophobicContact CG1-CD1 3.95Å; V520-I524 WeakPolarHBondContact O-CG1 3.22Å; V520-I524 PolarHBondContact O-N 3.49Å; V520-I524 VanDerWaalsContact O-N 3.1Å
521	R	89.1	Confident	87.8	Confident	53 Å²	53	87.5 Å²	87.5	20%	0.2	40%	0.399	C	S	.	.	H	α-helix	trans	-60.9	-42.9	176.4	-177	175.5	-179.9	-116.8	-14.5	112.2	Y517 N518 I524 L525 H560 N561	Y517-R521 WeakPolarHBondContact O-CB 3.39Å; Y517-R521 PolarHBondContact O-N 3.36Å; N518-R521 PolarHBondContact O-N 3.49Å; R521-I524 PolarHBondContact O-N 3.43Å; R521-L525 HydrophobicContact CG-CD1 4.27Å; R521-L525 WeakPolarHBondContact O-CG 3.1Å; R521-L525 PolarHBondContact O-N 3.09Å; R521-H560 PolarHBondContact NH2-ND1 2.96Å; R521-N561 VanDerWaalsContact CZ-OD1 3.26Å; R521-N561 PolarHBondContact NH1-OD1 2.92Å; R521-N561 PolarHBondContact NH2-OD1 3.3Å
522	Q	90.9	Very high	88.5	Confident	133 Å²	133	80.3 Å²	80.3	62%	0.621	37%	0.365	S	S	*	.	H	α-helix	trans	-59	-48.1	177.8	-173.6	173.8	6.5	0	0	111	N518 R519 V520 I524 L525 E526	N518-Q522 WeakPolarHBondContact O-CB 3.2Å; N518-Q522 PolarHBondContact O-N 2.75Å; R519-Q522 PolarHBondContact O-N 3.29Å; V520-Q522 PolarHBondContact O-N 2.92Å; Q522-I524 VanDerWaalsContact C-N 3.31Å; Q522-I524 PolarHBondContact O-N 2.78Å; Q522-L525 PolarHBondContact O-N 3.41Å; Q522-E526 VanDerWaalsContact O-CB 3.27Å; Q522-E526 WeakPolarHBondContact O-CB 3.37Å; Q522-E526 PolarHBondContact O-N 2.82Å
523	R	91.9	Very high	89.1	Confident	182 Å²	182	76.3 Å²	76.3	69%	0.687	35%	0.347	S	S	*	.	H	α-helix	trans	-60.6	-35.7	176.2	-70.4	175.9	176.4	-175.1	-2.8	113.7	R519 V520 R527	R519-R523 WeakPolarHBondContact O-CG 3.36Å; R519-R523 PolarHBondContact O-N 3.37Å; R519-R523 VanDerWaalsContact O-N 3.12Å; V520-R523 PolarHBondContact O-N 2.85Å; R523-R527 PolarHBondContact O-N 3.48Å
524	I	91	Very high	89.6	Confident	88 Å²	88	81.3 Å²	81.3	45%	0.451	37%	0.37	S	S	.	.	H	α-helix	trans	-67.5	-46	176.2	-68.4	165.6	0	0	0	110.5	V520 R521 Q522 E526 R527 Q528	V520-I524 HydrophobicContact CG1-CD1 3.95Å; V520-I524 WeakPolarHBondContact O-CG1 3.22Å; V520-I524 PolarHBondContact O-N 3.49Å; V520-I524 VanDerWaalsContact O-N 3.1Å; R521-I524 PolarHBondContact O-N 3.43Å; Q522-I524 VanDerWaalsContact C-N 3.31Å; Q522-I524 PolarHBondContact O-N 2.78Å; I524-E526 VanDerWaalsContact C-N 3.32Å; I524-E526 PolarHBondContact O-N 3.3Å; I524-R527 PolarHBondContact O-N 3.33Å; I524-Q528 WeakPolarHBondContact O-CB 3.32Å; I524-Q528 VanDerWaalsContact O-CG 3.26Å; I524-Q528 WeakPolarHBondContact O-CG 3.33Å; I524-Q528 PolarHBondContact O-N 3.07Å
525	L	93.1	Very high	90.1	Very high	6 Å²	6	82 Å²	82	3%	0.031	37%	0.373	C	S	.	.	H	α-helix	trans	-64.5	-38.3	176.3	-63.5	175.8	0	0	0	111.8	R521 Q522 Q528 C529 F556 T557 H560	R521-L525 HydrophobicContact CG-CD1 4.27Å; R521-L525 WeakPolarHBondContact O-CG 3.1Å; R521-L525 PolarHBondContact O-N 3.09Å; Q522-L525 PolarHBondContact O-N 3.41Å; L525-Q528 PolarHBondContact O-N 3.07Å; L525-C529 VanDerWaalsContact O-CB 3.27Å; L525-C529 WeakPolarHBondContact O-CB 3.24Å; L525-C529 PolarHBondContact O-N 3Å; L525-F556 HydrophobicContact CB-CD1 4.44Å; L525-F556 HydrophobicContact CB-CE1 4.45Å; L525-F556 HydrophobicContact CD2-CD1 4.43Å; L525-F556 HydrophobicContact CD2-CE1 4.04Å; L525-T557 HydrophobicContact CD1-CG2 4.16Å; L525-H560 HydrophobicContact CD2-CB 3.89Å; L525-H560 WeakPolarHBondContact CD2-CD2 3.3Å
526	E	92.9	Very high	90.4	Very high	90 Å²	90	80.7 Å²	80.7	42%	0.421	36%	0.362	S	S	.	.	H	α-helix	trans	-60	-52.1	176.6	-177.3	172.8	-151.9	0	0	111.5	Q522 I524 C529 I530 M553	Q522-E526 VanDerWaalsContact O-CB 3.27Å; Q522-E526 WeakPolarHBondContact O-CB 3.37Å; Q522-E526 PolarHBondContact O-N 2.82Å; I524-E526 VanDerWaalsContact C-N 3.32Å; I524-E526 PolarHBondContact O-N 3.3Å; E526-C529 PolarHBondContact O-N 2.93Å; E526-I530 HydrophobicContact CG-CD1 4.03Å; E526-I530 VanDerWaalsContact O-CG1 3.29Å; E526-I530 WeakPolarHBondContact O-CG1 3.27Å; E526-I530 PolarHBondContact O-N 3.49Å; E526-M553 HydrophobicContact CB-CE 4.26Å; E526-M553 HydrophobicContact CB-SD 4.25Å; E526-M553 HydrophobicContact CG-CE 3.98Å
527	R	93.3	Very high	90.3	Very high	159 Å²	159	80.7 Å²	80.7	60%	0.6	37%	0.374	S	S	*	.	H	α-helix	trans	-60.2	-49.4	175.5	-168.8	171.9	-179.3	-178	-1.9	111.8	R523 I524 C529 I530 D531	R523-R527 PolarHBondContact O-N 3.48Å; I524-R527 PolarHBondContact O-N 3.33Å; R527-C529 VanDerWaalsContact C-N 3.26Å; R527-C529 PolarHBondContact O-N 3.18Å; R527-I530 PolarHBondContact O-N 2.9Å; R527-I530 VanDerWaalsContact O-N 3.13Å; R527-D531 PolarHBondContact O-N 3.28Å
528	Q	93.4	Very high	90	Very high	36 Å²	36	77.9 Å²	77.9	17%	0.168	39%	0.388	C	S	.	.	H	α-helix	trans	-61	-31.9	178.4	-71.8	177.6	-2.5	0	0	113.7	I524 L525 L532 F556 Y583	I524-Q528 WeakPolarHBondContact O-CB 3.32Å; I524-Q528 VanDerWaalsContact O-CG 3.26Å; I524-Q528 WeakPolarHBondContact O-CG 3.33Å; I524-Q528 PolarHBondContact O-N 3.07Å; L525-Q528 PolarHBondContact O-N 3.07Å; Q528-L532 PolarHBondContact O-N 2.8Å; Q528-F556 HydrophobicContact CB-CE1 3.91Å; Q528-F556 HydrophobicContact CB-CZ 3.63Å; Q528-Y583 HydrophobicContact CB-CE2 4.13Å; Q528-Y583 HydrophobicContact CG-CD2 4.21Å; Q528-Y583 HydrophobicContact CG-CE2 3.71Å
529	C	94	Very high	89.8	Confident	0 Å²	0	81.1 Å²	81.1	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-73.9	-44.9	173.9	-171.5	0	0	0	0	110.8	L525 E526 R527 D531 L532 L533 M553 F556	L525-C529 VanDerWaalsContact O-CB 3.27Å; L525-C529 WeakPolarHBondContact O-CB 3.24Å; L525-C529 PolarHBondContact O-N 3Å; E526-C529 PolarHBondContact O-N 2.93Å; R527-C529 VanDerWaalsContact C-N 3.26Å; R527-C529 PolarHBondContact O-N 3.18Å; C529-D531 VanDerWaalsContact C-N 3.32Å; C529-D531 PolarHBondContact O-N 3.21Å; C529-L532 CarbonylContact O-C 3.59Å; C529-L532 WeakPolarHBondContact O-CA 3.47Å; C529-L532 WeakPolarHBondContact O-CB 3.5Å; C529-L532 PolarHBondContact O-N 3.46Å; C529-L532 VanDerWaalsContact O-N 3.08Å; C529-L533 WeakPolarHBondContact O-CG 3.44Å; C529-L533 PolarHBondContact O-N 3.04Å; C529-M553 HydrophobicContact CB-CE 3.65Å; C529-M553 HydrophobicContact CB-SD 3.62Å; C529-F556 HydrophobicContact CB-CB 4.09Å; C529-F556 HydrophobicContact CB-CD1 4.01Å; C529-F556 HydrophobicContact CB-CD2 3.98Å; C529-F556 HydrophobicContact CB-CE1 4.47Å; C529-F556 HydrophobicContact CB-CE2 4.44Å; C529-F556 HydrophobicContact CB-CG 3.76Å
530	I	92	Very high	89.1	Confident	70 Å²	70	77.7 Å²	77.7	36%	0.359	39%	0.393	S	S	.	.	H	α-helix	trans	-58	-44.5	176.1	-69.9	163.7	0	0	0	110.8	E526 R527 L532 L533 H534 M553	E526-I530 HydrophobicContact CG-CD1 4.03Å; E526-I530 VanDerWaalsContact O-CG1 3.29Å; E526-I530 WeakPolarHBondContact O-CG1 3.27Å; E526-I530 PolarHBondContact O-N 3.49Å; R527-I530 PolarHBondContact O-N 2.9Å; R527-I530 VanDerWaalsContact O-N 3.13Å; I530-L532 VanDerWaalsContact C-N 3.28Å; I530-L532 PolarHBondContact O-N 3.08Å; I530-L533 PolarHBondContact O-N 3.21Å; I530-H534 PolarHBondContact O-N 3.44Å; I530-M553 HydrophobicContact CG1-CE 4.47Å
531	D	92.7	Very high	88.6	Confident	63 Å²	63	77 Å²	77	34%	0.337	39%	0.387	S	S	.	.	H	α-helix	trans	-58.1	-40.1	175.1	-61.2	-30.8	0	0	0	111.8	R527 C529 E535	R527-D531 PolarHBondContact O-N 3.28Å; C529-D531 VanDerWaalsContact C-N 3.32Å; C529-D531 PolarHBondContact O-N 3.21Å; D531-E535 PolarHBondContact O-N 2.96Å
532	L	93	Very high	88.2	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-69.4	-35.9	173.5	173.1	62.9	0	0	0	112.6	Q528 C529 I530 E535 L536 F556 K587 A590 Q591 I594	Q528-L532 PolarHBondContact O-N 2.8Å; C529-L532 CarbonylContact O-C 3.59Å; C529-L532 WeakPolarHBondContact O-CA 3.47Å; C529-L532 WeakPolarHBondContact O-CB 3.5Å; C529-L532 PolarHBondContact O-N 3.46Å; C529-L532 VanDerWaalsContact O-N 3.08Å; I530-L532 VanDerWaalsContact C-N 3.28Å; I530-L532 PolarHBondContact O-N 3.08Å; L532-E535 PolarHBondContact O-N 2.89Å; L532-L536 HydrophobicContact CD1-CD1 4.39Å; L532-L536 HydrophobicContact CD1-CG 4.36Å; L532-L536 HydrophobicContact CG-CD1 4.39Å; L532-L536 WeakPolarHBondContact O-CG 3.34Å; L532-L536 PolarHBondContact O-N 2.86Å; L532-L536 VanDerWaalsContact O-N 3.11Å; L532-F556 HydrophobicContact CD2-CD2 3.94Å; L532-F556 HydrophobicContact CD2-CE2 3.99Å; L532-K587 HydrophobicContact CB-CG 4.48Å; L532-K587 HydrophobicContact CD1-CG 4.07Å; L532-K587 HydrophobicContact CD2-CG 4.49Å; L532-A590 HydrophobicContact CD2-CB 3.96Å; L532-Q591 HydrophobicContact CD1-CB 3.87Å; L532-Q591 HydrophobicContact CD1-CG 3.99Å; L532-Q591 HydrophobicContact CD2-CB 4.36Å; L532-I594 HydrophobicContact CD2-CD1 4.18Å
533	L	92.2	Very high	87.7	Confident	22 Å²	22	69 Å²	69	12%	0.115	35%	0.354	C	S	.	.	H	α-helix	trans	-70.4	-36.3	177.7	-62.4	-163.9	0	0	0	111.5	C529 I530 L536 A537 P543 Q549 A552	C529-L533 WeakPolarHBondContact O-CG 3.44Å; C529-L533 PolarHBondContact O-N 3.04Å; I530-L533 PolarHBondContact O-N 3.21Å; L533-L536 HydrophobicContact CD2-CD1 4.46Å; L533-L536 CarbonylContact O-C 3.53Å; L533-L536 PolarHBondContact O-N 2.57Å; L533-A537 PolarHBondContact O-N 3.02Å; L533-P543 HydrophobicContact CD1-CG 3.83Å; L533-P543 HydrophobicContact CD2-CG 3.57Å; L533-P543 HydrophobicContact CG-CG 4.21Å; L533-Q549 HydrophobicContact CD1-CB 4.24Å; L533-Q549 HydrophobicContact CD1-CG 3.94Å; L533-A552 HydrophobicContact CD1-CB 4.33Å; L533-A552 HydrophobicContact CD2-CB 4.15Å
534	H	90.7	Very high	87.1	Confident	137 Å²	137	67.1 Å²	67.1	63%	0.634	35%	0.353	S	S	*	.	H	α-helix	trans	-61.7	-41.7	170.6	-67.4	167.4	0	0	0	112.1	I530 L536 A537	I530-H534 PolarHBondContact O-N 3.44Å; H534-L536 PolarHBondContact O-N 3.16Å; H534-A537 PolarHBondContact O-N 2.96Å
535	E	90.8	Very high	86.7	Confident	119 Å²	119	66 Å²	66	56%	0.556	35%	0.348	S	S	*	.	H	α-helix	trans	-64	-22.3	171.7	-76.9	177.8	-173.3	0	0	113.9	D531 L532 K587	D531-E535 PolarHBondContact O-N 2.96Å; L532-E535 PolarHBondContact O-N 2.89Å; E535-K587 VanDerWaalsContact CD-CE 3.5Å; E535-K587 WeakPolarHBondContact OE1-CE 3.34Å; E535-K587 IonicContact OE1-NZ 3.79Å; E535-K587 PolarHBondContact OE1-NZ 3Å; E535-K587 WeakPolarHBondContact OE2-CE 3.3Å; E535-K587 IonicContact OE2-NZ 2.96Å; E535-K587 PolarHBondContact OE2-NZ 3.06Å; E535-K587 VanDerWaalsContact OE2-NZ 3.14Å
536	L	89.3	Confident	86.3	Confident	4 Å²	4	71.5 Å²	71.5	2%	0.021	38%	0.381	C	S	.	.	H	α-helix	trans	-93.2	-15.6	178.3	-72.2	-178.5	0	0	0	114.3	L532 L533 H534 G538 R539 A542 Q591 L595	L532-L536 HydrophobicContact CD1-CD1 4.39Å; L532-L536 HydrophobicContact CD1-CG 4.36Å; L532-L536 HydrophobicContact CG-CD1 4.39Å; L532-L536 WeakPolarHBondContact O-CG 3.34Å; L532-L536 PolarHBondContact O-N 2.86Å; L532-L536 VanDerWaalsContact O-N 3.11Å; L533-L536 HydrophobicContact CD2-CD1 4.46Å; L533-L536 CarbonylContact O-C 3.53Å; L533-L536 PolarHBondContact O-N 2.57Å; H534-L536 PolarHBondContact O-N 3.16Å; L536-G538 PolarHBondContact O-N 3.42Å; L536-R539 HydrophobicContact CD2-CG 4.48Å; L536-R539 WeakPolarHBondContact O-CB 3.48Å; L536-R539 PolarHBondContact O-N 3.13Å; L536-A542 HydrophobicContact CB-CB 4.29Å; L536-A542 WeakPolarHBondContact O-CB 3.3Å; L536-Q591 HydrophobicContact CD1-CG 4.44Å; L536-Q591 HydrophobicContact CD2-CG 3.98Å; L536-L595 HydrophobicContact CD1-CD2 4.08Å; L536-L595 HydrophobicContact CD1-CG 4.24Å; L536-L595 HydrophobicContact CD2-CD1 3.97Å; L536-L595 HydrophobicContact CD2-CD2 4.01Å; L536-L595 HydrophobicContact CD2-CG 4.25Å
537	A	81.6	Confident	85.9	Confident	79 Å²	79	69.6 Å²	69.6	65%	0.653	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-11.9	-168.6	0	0	0	0	0	116.2	L533 H534	L533-A537 PolarHBondContact O-N 3.02Å; H534-A537 PolarHBondContact O-N 2.96Å
538	G	76.6	Confident	85.7	Confident	82 Å²	82	62.3 Å²	62.3	85%	0.845	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	8.7	171.4	0	0	0	0	0	115.7	L536	L536-G538 PolarHBondContact O-N 3.42Å
539	R	80.9	Confident	85.4	Confident	159 Å²	159	64.8 Å²	64.8	60%	0.6	36%	0.361	S	S	*	.	S	Bend	trans	-103.8	142.3	178.8	-66.1	-72.8	178.4	162.9	-4.9	111	L536 D541 A542	L536-R539 HydrophobicContact CD2-CG 4.48Å; L536-R539 WeakPolarHBondContact O-CB 3.48Å; L536-R539 PolarHBondContact O-N 3.13Å; R539-D541 VanDerWaalsContact C-N 3.31Å; R539-D541 PolarHBondContact O-N 3.26Å; R539-A542 HydrophobicContact CB-CB 4.23Å; R539-A542 WeakPolarHBondContact O-CB 3.43Å; R539-A542 PolarHBondContact O-N 3.28Å
540	P	73.9	Confident	85.2	Confident	94 Å²	94	66 Å²	66	61%	0.61	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-35.8	174.6	27	-32.7	0	0	0	111.9	A542 Q544	P540-A542 PolarHBondContact O-N 3.34Å; P540-Q544 PolarHBondContact O-NE2 3.31Å
541	D	77.9	Confident	85.1	Confident	40 Å²	40	63 Å²	63	21%	0.214	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	14	177.5	-33	-98.3	0	0	0	113.9	R539 L595 I598 Q599	R539-D541 VanDerWaalsContact C-N 3.31Å; R539-D541 PolarHBondContact O-N 3.26Å; D541-L595 HydrophobicContact CB-CD2 4.18Å; D541-L595 WeakPolarHBondContact O-CD2 3.3Å; D541-I598 WeakPolarHBondContact O-CG2 3.11Å; D541-Q599 HydrophobicContact CB-CB 4.38Å; D541-Q599 PolarHBondContact OD1-NE2 3.17Å
542	A	80.2	Confident	85.2	Confident	5 Å²	5	60 Å²	60	4%	0.041	34%	0.342	C	S	.	.	S	Bend	trans	-78.3	154	175.3	0	0	0	0	0	111.4	L536 R539 P540 Q544	L536-A542 HydrophobicContact CB-CB 4.29Å; L536-A542 WeakPolarHBondContact O-CB 3.3Å; R539-A542 HydrophobicContact CB-CB 4.23Å; R539-A542 WeakPolarHBondContact O-CB 3.43Å; R539-A542 PolarHBondContact O-N 3.28Å; P540-A542 PolarHBondContact O-N 3.34Å; A542-Q544 WeakPolarHBondContact O-CG 3.34Å; A542-Q544 PolarHBondContact O-N 3.01Å
543	P	80.6	Confident	85.1	Confident	14 Å²	14	62.1 Å²	62.1	9%	0.091	35%	0.352	C	S	.	.			trans	-67.3	115.8	172.1	25.7	-30.9	0	0	0	110.5	L533 E548 Q549 A552 I598	L533-P543 HydrophobicContact CD1-CG 3.83Å; L533-P543 HydrophobicContact CD2-CG 3.57Å; L533-P543 HydrophobicContact CG-CG 4.21Å; P543-E548 WeakPolarHBondContact CA-OE2 3.43Å; P543-E548 HydrophobicContact CB-CB 3.57Å; P543-Q549 HydrophobicContact CB-CG 4.19Å; P543-A552 HydrophobicContact CG-CB 4.34Å; P543-I598 HydrophobicContact CB-CD1 3.62Å; P543-I598 HydrophobicContact CG-CD1 3.93Å
544	Q	79.7	Confident	85.1	Confident	142 Å²	142	63.8 Å²	63.8	66%	0.664	36%	0.359	S	S	*	.			trans	-96.6	-35.7	-175.7	-52	-171.9	17.9	0	0	111.7	P540 A542 E548	P540-Q544 PolarHBondContact O-NE2 3.31Å; A542-Q544 WeakPolarHBondContact O-CG 3.34Å; A542-Q544 PolarHBondContact O-N 3.01Å; Q544-E548 PolarHBondContact N-OE2 2.97Å
545	D	81.9	Confident	85.3	Confident	66 Å²	66	57.3 Å²	57.3	35%	0.353	33%	0.329	S	S	.	.	S	Bend	trans	-105.2	168.7	-178.1	79.7	37.8	0	0	0	114.2	T547 E548 Q549	D545-T547 VanDerWaalsContact C-N 3.28Å; D545-T547 VanDerWaalsContact CG-OG1 3.31Å; D545-T547 PolarHBondContact O-N 3.37Å; D545-T547 VanDerWaalsContact OD1-CA 3.32Å; D545-T547 WeakPolarHBondContact OD1-CA 3.26Å; D545-T547 WeakPolarHBondContact OD1-CB 3.21Å; D545-T547 PolarHBondContact OD1-N 3.19Å; D545-T547 PolarHBondContact OD1-OG1 3.14Å; D545-T547 PolarHBondContact OD2-OG1 2.75Å; D545-E548 PolarHBondContact N-OE2 3.37Å; D545-E548 PolarHBondContact O-N 2.9Å; D545-E548 PolarHBondContact OD1-N 2.71Å; D545-Q549 VanDerWaalsContact O-CG 3.27Å; D545-Q549 WeakPolarHBondContact O-CG 3.43Å; D545-Q549 PolarHBondContact O-N 3.5Å
546	V	84.8	Confident	85.6	Confident	120 Å²	120	51.6 Å²	51.6	73%	0.727	30%	0.303	S	S	*	.	H	α-helix	trans	-65.5	-30	-176.7	-177.3	0	0	0	0	112.3	G550	V546-G550 PolarHBondContact O-N 3.18Å
547	T	84.8	Confident	85.8	Confident	51 Å²	51	52.8 Å²	52.8	31%	0.313	31%	0.31	S	S	.	.	H	α-helix	trans	-74.2	-38.1	176.1	32.2	0	0	0	0	112.2	D545 G550 F551 L616	D545-T547 VanDerWaalsContact C-N 3.28Å; D545-T547 VanDerWaalsContact CG-OG1 3.31Å; D545-T547 PolarHBondContact O-N 3.37Å; D545-T547 VanDerWaalsContact OD1-CA 3.32Å; D545-T547 WeakPolarHBondContact OD1-CA 3.26Å; D545-T547 WeakPolarHBondContact OD1-CB 3.21Å; D545-T547 PolarHBondContact OD1-N 3.19Å; D545-T547 PolarHBondContact OD1-OG1 3.14Å; D545-T547 PolarHBondContact OD2-OG1 2.75Å; T547-G550 PolarHBondContact O-N 3.39Å; T547-F551 VanDerWaalsContact O-CB 3.32Å; T547-F551 WeakPolarHBondContact O-CB 3.31Å; T547-F551 PolarHBondContact O-N 3.11Å; T547-L616 WeakPolarHBondContact CG2-O 3.26Å
548	E	87.9	Confident	86.5	Confident	6 Å²	6	50.4 Å²	50.4	3%	0.028	29%	0.286	C	S	.	.	H	α-helix	trans	-67.9	-37.5	172.5	-68.1	179.7	157.6	0	0	112.1	P543 Q544 D545 F551 A552 H602 L616	P543-E548 WeakPolarHBondContact CA-OE2 3.43Å; P543-E548 HydrophobicContact CB-CB 3.57Å; Q544-E548 PolarHBondContact N-OE2 2.97Å; D545-E548 PolarHBondContact N-OE2 3.37Å; D545-E548 PolarHBondContact O-N 2.9Å; D545-E548 PolarHBondContact OD1-N 2.71Å; E548-F551 PolarHBondContact O-N 3.48Å; E548-A552 VanDerWaalsContact O-CB 3.29Å; E548-A552 WeakPolarHBondContact O-CB 3.44Å; E548-A552 PolarHBondContact O-N 2.91Å; E548-H602 IonicContact OE1-CD2 2.82Å; E548-H602 PolarHBondContact OE1-CD2 2.93Å; E548-H602 IonicContact OE1-CE1 2.88Å; E548-H602 IonicContact OE1-NE2 2.83Å; E548-H602 PolarHBondContact OE1-NE2 3.35Å; E548-H602 IonicContact OE2-NE2 2.67Å; E548-L616 HydrophobicContact CB-CD1 4.38Å; E548-L616 HydrophobicContact CG-CD1 3.57Å
549	Q	88.9	Confident	87.4	Confident	88 Å²	88	46.5 Å²	46.5	41%	0.411	25%	0.246	S	C	.	.	H	α-helix	trans	-64.7	-43.3	172.8	-70.7	172.8	13.4	0	0	111.5	L533 P543 D545 A552 M553	L533-Q549 HydrophobicContact CD1-CB 4.24Å; L533-Q549 HydrophobicContact CD1-CG 3.94Å; P543-Q549 HydrophobicContact CB-CG 4.19Å; D545-Q549 VanDerWaalsContact O-CG 3.27Å; D545-Q549 WeakPolarHBondContact O-CG 3.43Å; D545-Q549 PolarHBondContact O-N 3.5Å; Q549-A552 PolarHBondContact O-N 2.94Å; Q549-M553 PolarHBondContact O-N 2.9Å
550	G	88.9	Confident	88.1	Confident	26 Å²	26	40 Å²	40	27%	0.268	22%	0.222	S	C	.	.	H	α-helix	trans	-62.4	-42.5	173.2	0	0	0	0	0	113.1	V546 T547 M553 E554	V546-G550 PolarHBondContact O-N 3.18Å; T547-G550 PolarHBondContact O-N 3.39Å; G550-M553 WeakPolarHBondContact O-CB 3.27Å; G550-M553 PolarHBondContact O-N 2.86Å; G550-E554 PolarHBondContact O-N 3.43Å; G550-E554 VanDerWaalsContact O-N 3.08Å
551	F	90.8	Very high	89.1	Confident	7 Å²	7	39 Å²	39	3%	0.031	21%	0.212	C	C	.	.	H	α-helix	trans	-63.5	-39.9	174.4	178.6	-100.9	0	0	0	112.4	T547 E548 M553 E554 L555 E597 I598 L616 L620	T547-F551 VanDerWaalsContact O-CB 3.32Å; T547-F551 WeakPolarHBondContact O-CB 3.31Å; T547-F551 PolarHBondContact O-N 3.11Å; E548-F551 PolarHBondContact O-N 3.48Å; F551-M553 VanDerWaalsContact C-N 3.34Å; F551-E554 PolarHBondContact O-N 3.36Å; F551-L555 HydrophobicContact CD1-CD1 3.84Å; F551-L555 HydrophobicContact CE1-CD1 3.48Å; F551-L555 VanDerWaalsContact CE1-CD1 3.48Å; F551-L555 HydrophobicContact CE1-CG 4.35Å; F551-L555 HydrophobicContact CZ-CD1 4.06Å; F551-L555 WeakPolarHBondContact O-CG 3.34Å; F551-L555 PolarHBondContact O-N 2.68Å; F551-E597 HydrophobicContact CE1-CB 4.06Å; F551-E597 HydrophobicContact CZ-CB 4.23Å; F551-I598 HydrophobicContact CD1-CG1 4.45Å; F551-L616 HydrophobicContact CB-CD1 4.36Å; F551-L616 HydrophobicContact CD2-CD2 3.84Å; F551-L616 HydrophobicContact CE2-CD2 4.01Å; F551-L616 HydrophobicContact CG-CD1 4.42Å; F551-L616 HydrophobicContact CG-CD2 4.13Å; F551-L616 HydrophobicContact CZ-CD2 4.47Å; F551-L620 HydrophobicContact CD2-CD1 3.92Å; F551-L620 HydrophobicContact CE2-CD1 3.33Å; F551-L620 HydrophobicContact CZ-CD1 3.8Å
552	A	92.8	Very high	89.9	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.2	-36.7	173.9	0	0	0	0	0	112.2	L533 P543 E548 Q549 L555 F556 I594	L533-A552 HydrophobicContact CD1-CB 4.33Å; L533-A552 HydrophobicContact CD2-CB 4.15Å; P543-A552 HydrophobicContact CG-CB 4.34Å; E548-A552 VanDerWaalsContact O-CB 3.29Å; E548-A552 WeakPolarHBondContact O-CB 3.44Å; E548-A552 PolarHBondContact O-N 2.91Å; Q549-A552 PolarHBondContact O-N 2.94Å; A552-L555 PolarHBondContact O-N 3.1Å; A552-F556 WeakPolarHBondContact O-CB 3.31Å; A552-F556 PolarHBondContact O-N 3.23Å; A552-I594 HydrophobicContact CB-CD1 4.11Å; A552-I594 HydrophobicContact CB-CG1 4.21Å; A552-I594 HydrophobicContact CB-CG2 3.93Å
553	M	92.2	Very high	90.6	Very high	44 Å²	44	37.8 Å²	37.8	22%	0.217	21%	0.205	C	C	.	.	H	α-helix	trans	-62.8	-44.8	175	-168.7	60.8	65.1	0	0	112.4	E526 C529 I530 Q549 G550 F551 F556 T557	E526-M553 HydrophobicContact CB-CE 4.26Å; E526-M553 HydrophobicContact CB-SD 4.25Å; E526-M553 HydrophobicContact CG-CE 3.98Å; C529-M553 HydrophobicContact CB-CE 3.65Å; C529-M553 HydrophobicContact CB-SD 3.62Å; I530-M553 HydrophobicContact CG1-CE 4.47Å; Q549-M553 PolarHBondContact O-N 2.9Å; G550-M553 WeakPolarHBondContact O-CB 3.27Å; G550-M553 PolarHBondContact O-N 2.86Å; F551-M553 VanDerWaalsContact C-N 3.34Å; M553-F556 PolarHBondContact O-N 3.27Å; M553-T557 VanDerWaalsContact O-CB 3.27Å; M553-T557 WeakPolarHBondContact O-CB 3.42Å; M553-T557 PolarHBondContact O-N 2.83Å; M553-T557 PolarHBondContact O-OG1 2.87Å
554	E	92.9	Very high	91.2	Very high	57 Å²	57	43.8 Å²	43.8	27%	0.266	23%	0.226	S	C	.	.	H	α-helix	trans	-63.8	-41.5	174.1	-93.7	-65.2	106.8	0	0	111.9	G550 F551 T557 L558 L620 R625	G550-E554 PolarHBondContact O-N 3.43Å; G550-E554 VanDerWaalsContact O-N 3.08Å; F551-E554 PolarHBondContact O-N 3.36Å; E554-T557 PolarHBondContact O-N 3.39Å; E554-L558 VanDerWaalsContact O-CB 3.29Å; E554-L558 WeakPolarHBondContact O-CB 3.45Å; E554-L558 PolarHBondContact O-N 2.9Å; E554-L620 HydrophobicContact CB-CB 4.02Å; E554-L620 HydrophobicContact CB-CD2 4.25Å; E554-L620 HydrophobicContact CG-CB 4.49Å; E554-R625 IonicContact OE2-CZ 2.96Å; E554-R625 IonicContact OE2-NE 3.08Å; E554-R625 IonicContact OE2-NH2 3.96Å; E554-R625 PolarHBondContact OE2-NH2 3.28Å
555	L	94.7	Very high	91.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.3	-45.6	174.2	-79.2	174.9	0	0	0	112.5	F551 A552 L558 V559 V593 I594 E597 L620 V624 V628	F551-L555 HydrophobicContact CD1-CD1 3.84Å; F551-L555 HydrophobicContact CE1-CD1 3.48Å; F551-L555 VanDerWaalsContact CE1-CD1 3.48Å; F551-L555 HydrophobicContact CE1-CG 4.35Å; F551-L555 HydrophobicContact CZ-CD1 4.06Å; F551-L555 WeakPolarHBondContact O-CG 3.34Å; F551-L555 PolarHBondContact O-N 2.68Å; A552-L555 PolarHBondContact O-N 3.1Å; L555-L558 PolarHBondContact O-N 3.06Å; L555-V559 WeakPolarHBondContact O-CB 3.22Å; L555-V559 VanDerWaalsContact O-CG2 3.32Å; L555-V559 WeakPolarHBondContact O-CG2 3.43Å; L555-V559 PolarHBondContact O-N 3Å; L555-V593 HydrophobicContact CD1-CG1 4.29Å; L555-V593 HydrophobicContact CD2-CG1 3.77Å; L555-V593 HydrophobicContact CG-CG1 4.5Å; L555-I594 HydrophobicContact CB-CG1 3.97Å; L555-I594 HydrophobicContact CD1-CG1 4.07Å; L555-E597 HydrophobicContact CD1-CB 4.2Å; L555-L620 HydrophobicContact CD2-CD1 3.66Å; L555-L620 HydrophobicContact CD2-CD2 3.81Å; L555-L620 HydrophobicContact CD2-CG 4.4Å; L555-L620 HydrophobicContact CG-CD1 3.9Å; L555-L620 HydrophobicContact CG-CD2 4.23Å; L555-V624 HydrophobicContact CD2-CG1 4.06Å; L555-V628 HydrophobicContact CD2-CG2 3.87Å
556	F	95.7	Very high	92.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.2	-46.5	177.2	-170.1	-84	0	0	0	111	L525 Q528 C529 L532 A552 M553 V559 H560 T586 A590	L525-F556 HydrophobicContact CB-CD1 4.44Å; L525-F556 HydrophobicContact CB-CE1 4.45Å; L525-F556 HydrophobicContact CD2-CD1 4.43Å; L525-F556 HydrophobicContact CD2-CE1 4.04Å; Q528-F556 HydrophobicContact CB-CE1 3.91Å; Q528-F556 HydrophobicContact CB-CZ 3.63Å; C529-F556 HydrophobicContact CB-CB 4.09Å; C529-F556 HydrophobicContact CB-CD1 4.01Å; C529-F556 HydrophobicContact CB-CD2 3.98Å; C529-F556 HydrophobicContact CB-CE1 4.47Å; C529-F556 HydrophobicContact CB-CE2 4.44Å; C529-F556 HydrophobicContact CB-CG 3.76Å; L532-F556 HydrophobicContact CD2-CD2 3.94Å; L532-F556 HydrophobicContact CD2-CE2 3.99Å; A552-F556 WeakPolarHBondContact O-CB 3.31Å; A552-F556 PolarHBondContact O-N 3.23Å; M553-F556 PolarHBondContact O-N 3.27Å; F556-V559 PolarHBondContact O-N 3.28Å; F556-H560 PolarHBondContact O-N 2.97Å; F556-T586 HydrophobicContact CD1-CG2 4.21Å; F556-T586 HydrophobicContact CD2-CG2 4.48Å; F556-T586 HydrophobicContact CE1-CG2 3.7Å; F556-T586 HydrophobicContact CE2-CG2 4.01Å; F556-T586 HydrophobicContact CZ-CG2 3.58Å; F556-A590 HydrophobicContact CB-CB 4.4Å; F556-A590 HydrophobicContact CD2-CB 3.48Å; F556-A590 VanDerWaalsContact CD2-CB 3.48Å; F556-A590 HydrophobicContact CE2-CB 4.08Å; F556-A590 HydrophobicContact CG-CB 4.23Å
557	T	94.7	Very high	92.7	Very high	29 Å²	29	36.8 Å²	36.8	18%	0.178	19%	0.191	C	C	.	.	H	α-helix	trans	-63.3	-41.9	178.1	-63	0	0	0	0	112	L525 M553 E554 H560 N561	L525-T557 HydrophobicContact CD1-CG2 4.16Å; M553-T557 VanDerWaalsContact O-CB 3.27Å; M553-T557 WeakPolarHBondContact O-CB 3.42Å; M553-T557 PolarHBondContact O-N 2.83Å; M553-T557 PolarHBondContact O-OG1 2.87Å; E554-T557 PolarHBondContact O-N 3.39Å; T557-H560 PolarHBondContact O-N 3.46Å; T557-N561 VanDerWaalsContact O-CB 3.27Å; T557-N561 WeakPolarHBondContact O-CB 3.41Å; T557-N561 PolarHBondContact O-N 2.93Å; T557-N561 PolarHBondContact O-ND2 3.26Å
558	L	95.2	Very high	92.9	Very high	28 Å²	28	37 Å²	37	15%	0.147	19%	0.19	C	C	.	.	H	α-helix	trans	-63	-44.5	173.8	176.7	65.1	0	0	0	112.4	E554 L555 N561 T562 L620 R625 V628	E554-L558 VanDerWaalsContact O-CB 3.29Å; E554-L558 WeakPolarHBondContact O-CB 3.45Å; E554-L558 PolarHBondContact O-N 2.9Å; L555-L558 PolarHBondContact O-N 3.06Å; L558-N561 PolarHBondContact O-N 2.82Å; L558-T562 WeakPolarHBondContact O-CB 3.48Å; L558-T562 PolarHBondContact O-N 3Å; L558-T562 PolarHBondContact O-OG1 3.29Å; L558-L620 HydrophobicContact CB-CD2 4.36Å; L558-L620 HydrophobicContact CD2-CD2 3.76Å; L558-R625 HydrophobicContact CD2-CB 4.18Å; L558-R625 HydrophobicContact CD2-CG 4.24Å; L558-V628 HydrophobicContact CD2-CB 3.95Å; L558-V628 HydrophobicContact CD2-CG1 3.9Å; L558-V628 HydrophobicContact CG-CG1 4.42Å
559	V	96.8	Very high	92.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.8	-48	177.4	168.2	0	0	0	0	110.2	L555 F556 N561 T562 L563 T586 L589 V628 V632	L555-V559 WeakPolarHBondContact O-CB 3.22Å; L555-V559 VanDerWaalsContact O-CG2 3.32Å; L555-V559 WeakPolarHBondContact O-CG2 3.43Å; L555-V559 PolarHBondContact O-N 3Å; F556-V559 PolarHBondContact O-N 3.28Å; V559-N561 PolarHBondContact O-N 3.19Å; V559-T562 PolarHBondContact O-N 3.41Å; V559-L563 HydrophobicContact CG1-CD1 3.77Å; V559-L563 HydrophobicContact CG1-CG 4.45Å; V559-L563 WeakPolarHBondContact O-CB 3.31Å; V559-L563 WeakPolarHBondContact O-CG 3.39Å; V559-L563 PolarHBondContact O-N 3.22Å; V559-T586 HydrophobicContact CG1-CG2 4.46Å; V559-L589 HydrophobicContact CG1-CB 3.85Å; V559-V628 HydrophobicContact CG2-CG1 3.83Å; V559-V632 HydrophobicContact CG1-CG2 4.43Å; V559-V632 HydrophobicContact CG2-CG2 4.19Å
560	H	95.5	Very high	92.7	Very high	23 Å²	23	45.2 Å²	45.2	11%	0.106	23%	0.232	C	C	.	.	H	α-helix	trans	-61.9	-44.8	175.2	-171.5	-51.4	0	0	0	111.9	R521 L525 F556 T557 T562 L563 R564 T586	R521-H560 PolarHBondContact NH2-ND1 2.96Å; L525-H560 HydrophobicContact CD2-CB 3.89Å; L525-H560 WeakPolarHBondContact CD2-CD2 3.3Å; F556-H560 PolarHBondContact O-N 2.97Å; T557-H560 PolarHBondContact O-N 3.46Å; H560-T562 VanDerWaalsContact C-N 3.26Å; H560-T562 PolarHBondContact O-N 2.99Å; H560-L563 PolarHBondContact O-N 2.87Å; H560-R564 WeakPolarHBondContact O-CB 3.49Å; H560-R564 PolarHBondContact O-N 3.2Å; H560-T586 HydrophobicContact CB-CG2 3.72Å
561	N	93.6	Very high	92.6	Very high	73 Å²	73	45.5 Å²	45.5	39%	0.39	23%	0.229	S	C	.	.	H	α-helix	trans	-59.1	-40.7	178.9	-78.6	-26.1	0	0	0	111.3	R521 T557 L558 V559	R521-N561 VanDerWaalsContact CZ-OD1 3.26Å; R521-N561 PolarHBondContact NH1-OD1 2.92Å; R521-N561 PolarHBondContact NH2-OD1 3.3Å; T557-N561 VanDerWaalsContact O-CB 3.27Å; T557-N561 WeakPolarHBondContact O-CB 3.41Å; T557-N561 PolarHBondContact O-N 2.93Å; T557-N561 PolarHBondContact O-ND2 3.26Å; L558-N561 PolarHBondContact O-N 2.82Å; V559-N561 PolarHBondContact O-N 3.19Å
562	T	94.9	Very high	92.6	Very high	20 Å²	20	53.8 Å²	53.8	12%	0.123	27%	0.265	C	S	.	.	H	α-helix	trans	-66.7	-46.3	176	-53.3	0	0	0	0	111.6	L558 V559 H560 R564 G565 F566 T629 V632	L558-T562 WeakPolarHBondContact O-CB 3.48Å; L558-T562 PolarHBondContact O-N 3Å; L558-T562 PolarHBondContact O-OG1 3.29Å; V559-T562 PolarHBondContact O-N 3.41Å; H560-T562 VanDerWaalsContact C-N 3.26Å; H560-T562 PolarHBondContact O-N 2.99Å; T562-R564 VanDerWaalsContact C-N 3.33Å; T562-R564 PolarHBondContact O-N 3.38Å; T562-G565 PolarHBondContact O-N 3.35Å; T562-F566 HydrophobicContact CG2-CE2 4.44Å; T562-F566 WeakPolarHBondContact O-CD2 3.42Å; T562-T629 HydrophobicContact CG2-CG2 4.13Å; T562-V632 HydrophobicContact CG2-CB 3.93Å; T562-V632 HydrophobicContact CG2-CG1 3.62Å
563	L	96	Very high	92.5	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-66.6	-29.8	179	-70.7	168.7	0	0	0	113.4	V559 H560 G565 F566 R567 I576 L582 L585 T586 L589 V632 M636	V559-L563 HydrophobicContact CG1-CD1 3.77Å; V559-L563 HydrophobicContact CG1-CG 4.45Å; V559-L563 WeakPolarHBondContact O-CB 3.31Å; V559-L563 WeakPolarHBondContact O-CG 3.39Å; V559-L563 PolarHBondContact O-N 3.22Å; H560-L563 PolarHBondContact O-N 2.87Å; L563-G565 PolarHBondContact O-N 2.92Å; L563-F566 WeakPolarHBondContact O-CA 3.5Å; L563-F566 WeakPolarHBondContact O-CB 3.27Å; L563-F566 PolarHBondContact O-N 3.34Å; L563-R567 PolarHBondContact O-N 2.73Å; L563-I576 HydrophobicContact CB-CD1 4.26Å; L563-I576 HydrophobicContact CD2-CD1 4.2Å; L563-L582 HydrophobicContact CB-CD1 3.52Å; L563-L585 HydrophobicContact CD1-CB 3.84Å; L563-L585 HydrophobicContact CD2-CB 4.27Å; L563-L585 HydrophobicContact CD2-CD1 4.45Å; L563-T586 WeakPolarHBondContact CD1-OG1 3.34Å; L563-L589 HydrophobicContact CD1-CD1 4.28Å; L563-L589 HydrophobicContact CD2-CD1 4.03Å; L563-V632 HydrophobicContact CD2-CG1 3.76Å; L563-V632 HydrophobicContact CG-CG1 4Å; L563-M636 HydrophobicContact CD2-CE 4.4Å; L563-M636 HydrophobicContact CD2-CG 3.96Å; L563-M636 HydrophobicContact CD2-SD 3.7Å
564	R	92.1	Very high	92.4	Very high	140 Å²	140	55.9 Å²	55.9	53%	0.528	28%	0.277	S	S	.	.	H	α-helix	trans	-58.5	-33.1	175.5	-163.6	-179.9	-172.1	-165	1.5	111.7	H560 T562 F566 R567	H560-R564 WeakPolarHBondContact O-CB 3.49Å; H560-R564 PolarHBondContact O-N 3.2Å; T562-R564 VanDerWaalsContact C-N 3.33Å; T562-R564 PolarHBondContact O-N 3.38Å; R564-F566 VanDerWaalsContact C-N 3.27Å; R564-F566 PolarHBondContact O-N 3.3Å; R564-R567 PolarHBondContact O-N 2.7Å
565	G	92.3	Very high	92.5	Very high	47 Å²	47	56.7 Å²	56.7	49%	0.485	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-65.9	-24.8	173.2	0	0	0	0	0	114.4	T562 L563 R567	T562-G565 PolarHBondContact O-N 3.35Å; L563-G565 PolarHBondContact O-N 2.92Å; G565-R567 VanDerWaalsContact C-N 3.34Å
566	F	93.9	Very high	92.4	Very high	24 Å²	24	56.7 Å²	56.7	11%	0.105	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-83	-8.6	174.6	-70.2	-87.5	0	0	0	113.4	T562 L563 R564 L573 R575 I576 R633 M636	T562-F566 HydrophobicContact CG2-CE2 4.44Å; T562-F566 WeakPolarHBondContact O-CD2 3.42Å; L563-F566 WeakPolarHBondContact O-CA 3.5Å; L563-F566 WeakPolarHBondContact O-CB 3.27Å; L563-F566 PolarHBondContact O-N 3.34Å; R564-F566 VanDerWaalsContact C-N 3.27Å; R564-F566 PolarHBondContact O-N 3.3Å; F566-L573 VanDerWaalsContact CD1-O 3.28Å; F566-L573 WeakPolarHBondContact CD1-O 3.44Å; F566-R575 CarbonylContact O-C 3.56Å; F566-R575 WeakPolarHBondContact O-CA 3.38Å; F566-I576 HydrophobicContact CB-CD1 3.93Å; F566-I576 HydrophobicContact CB-CG1 4.03Å; F566-I576 PolarHBondContact O-N 3.14Å; F566-R633 HydrophobicContact CE2-CG 4.3Å; F566-R633 HydrophobicContact CZ-CB 4.43Å; F566-R633 HydrophobicContact CZ-CG 4.11Å; F566-M636 HydrophobicContact CB-CE 4.37Å; F566-M636 HydrophobicContact CD1-CB 3.76Å; F566-M636 HydrophobicContact CD1-CG 4.15Å; F566-M636 HydrophobicContact CD2-CB 4.43Å; F566-M636 HydrophobicContact CD2-CG 4.06Å; F566-M636 HydrophobicContact CE1-CB 3.49Å; F566-M636 VanDerWaalsContact CE1-CB 3.49Å; F566-M636 HydrophobicContact CE1-CG 4.18Å; F566-M636 HydrophobicContact CE2-CB 4.21Å; F566-M636 HydrophobicContact CE2-CG 4.08Å; F566-M636 HydrophobicContact CG-CB 4.23Å; F566-M636 HydrophobicContact CG-CE 4.47Å; F566-M636 HydrophobicContact CG-CG 4.11Å; F566-M636 HydrophobicContact CZ-CB 3.74Å; F566-M636 HydrophobicContact CZ-CG 4.14Å
567	R	91.5	Very high	92.1	Very high	109 Å²	109	60.5 Å²	60.5	41%	0.411	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-83.3	-16	172.4	-169.4	176	172.5	-155.1	-2.4	113.1	L563 R564 G565 A569 I576 D579	L563-R567 PolarHBondContact O-N 2.73Å; R564-R567 PolarHBondContact O-N 2.7Å; G565-R567 VanDerWaalsContact C-N 3.34Å; R567-A569 PolarHBondContact O-N 2.67Å; R567-I576 HydrophobicContact CB-CB 4.5Å; R567-D579 IonicContact CZ-OD1 2.76Å; R567-D579 IonicContact CZ-OD2 2.63Å; R567-D579 IonicContact NE-OD1 2.63Å; R567-D579 IonicContact NE-OD2 3.25Å; R567-D579 IonicContact NH1-OD1 2.74Å; R567-D579 PolarHBondContact NH1-OD1 2.83Å; R567-D579 IonicContact NH1-OD2 3.04Å; R567-D579 PolarHBondContact NH1-OD2 3.1Å; R567-D579 IonicContact NH2-OD1 2.84Å; R567-D579 IonicContact NH2-OD2 3.62Å; R567-D579 PolarHBondContact NH2-OD2 2.96Å
568	D	89	Confident	91.9	Very high	55 Å²	55	63 Å²	63	29%	0.294	31%	0.312	S	S	.	.	S	Bend	trans	-54.7	132.6	176.7	-170.3	-37.5	0	0	0	110.9	R570 C571	D568-R570 PolarHBondContact O-N 2.67Å; D568-R570 VanDerWaalsContact O-N 3.1Å; D568-R570 VanDerWaalsContact OD1-CB 3.25Å; D568-R570 WeakPolarHBondContact OD1-CB 3.48Å; D568-R570 WeakPolarHBondContact OD1-CG 3.47Å; D568-R570 IonicContact OD1-CZ 3.74Å; D568-R570 PolarHBondContact OD1-N 2.96Å; D568-R570 IonicContact OD1-NE 2.69Å; D568-R570 PolarHBondContact OD1-NE 3.03Å; D568-R570 IonicContact OD1-NH2 3.47Å; D568-R570 IonicContact OD2-CZ 2.68Å; D568-R570 VanDerWaalsContact OD2-CZ 3.3Å; D568-R570 IonicContact OD2-NE 3.64Å; D568-R570 PolarHBondContact OD2-NE 3.24Å; D568-R570 VanDerWaalsContact OD2-NE 3.1Å; D568-R570 IonicContact OD2-NH2 3.64Å; D568-R570 PolarHBondContact OD2-NH2 3.2Å; D568-C571 WeakPolarHBondContact O-CB 3.47Å; D568-C571 PolarHBondContact O-N 2.74Å
569	A	85.1	Confident	91.6	Very high	67 Å²	67	65.4 Å²	65.4	55%	0.554	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-25.2	179.2	0	0	0	0	0	113.4	R567 C571 R575	R567-A569 PolarHBondContact O-N 2.67Å; A569-C571 VanDerWaalsContact C-N 3.34Å; A569-R575 PolarHBondContact O-NH1 3.39Å
570	R	88	Confident	91.3	Very high	201 Å²	201	71.2 Å²	71.2	76%	0.758	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-7.5	178.3	-55.4	172.1	-67.5	-179.4	2.9	113.3	D568 K572	D568-R570 PolarHBondContact O-N 2.67Å; D568-R570 VanDerWaalsContact O-N 3.1Å; D568-R570 VanDerWaalsContact OD1-CB 3.25Å; D568-R570 WeakPolarHBondContact OD1-CB 3.48Å; D568-R570 WeakPolarHBondContact OD1-CG 3.47Å; D568-R570 IonicContact OD1-CZ 3.74Å; D568-R570 PolarHBondContact OD1-N 2.96Å; D568-R570 IonicContact OD1-NE 2.69Å; D568-R570 PolarHBondContact OD1-NE 3.03Å; D568-R570 IonicContact OD1-NH2 3.47Å; D568-R570 IonicContact OD2-CZ 2.68Å; D568-R570 VanDerWaalsContact OD2-CZ 3.3Å; D568-R570 IonicContact OD2-NE 3.64Å; D568-R570 PolarHBondContact OD2-NE 3.24Å; D568-R570 VanDerWaalsContact OD2-NE 3.1Å; D568-R570 IonicContact OD2-NH2 3.64Å; D568-R570 PolarHBondContact OD2-NH2 3.2Å; R570-K572 PolarHBondContact O-N 2.63Å
571	C	87.8	Confident	91.2	Very high	31 Å²	31	70.8 Å²	70.8	21%	0.209	35%	0.351	C	S	.	.			trans	-68.3	126	-179.3	-161.8	0	0	0	0	110.8	D568 A569 L573 R575	D568-C571 WeakPolarHBondContact O-CB 3.47Å; D568-C571 PolarHBondContact O-N 2.74Å; A569-C571 VanDerWaalsContact C-N 3.34Å; C571-L573 PolarHBondContact SG-O 2.85Å; C571-R575 HydrophobicContact CB-CB 4.29Å; C571-R575 HydrophobicContact CB-CG 4.32Å
572	K	89.5	Confident	91.3	Very high	181 Å²	181	67.6 Å²	67.6	79%	0.787	33%	0.334	S	S	*	.			trans	-92.9	-20.7	-173	-64.6	-175.7	178.6	-178.5	0	114.6	R570 A641	R570-K572 PolarHBondContact O-N 2.63Å; K572-A641 WeakPolarHBondContact O-CA 3.44Å
573	L	91.9	Very high	91.2	Very high	89 Å²	89	70.1 Å²	70.1	47%	0.466	34%	0.342	S	S	.	.	S	Bend	trans	-135.5	136.7	-176	-66.9	176	0	0	0	108.8	F566 C571 R575 E637 G640	F566-L573 VanDerWaalsContact CD1-O 3.28Å; F566-L573 WeakPolarHBondContact CD1-O 3.44Å; C571-L573 PolarHBondContact SG-O 2.85Å; L573-R575 PolarHBondContact O-N 2.99Å; L573-E637 HydrophobicContact CD1-CG 4.41Å; L573-G640 CarbonylContact C-O 3.52Å; L573-G640 WeakPolarHBondContact CA-O 3.37Å
574	G	90	Very high	91.1	Very high	0 Å²	0	73.7 Å²	73.7	0%	0	36%	0.356	C	S	.	.	S	Bend	trans	64.1	20.2	-178.6	0	0	0	0	0	114.6	I576 M636 G640 A641	G574-I576 PolarHBondContact O-N 2.91Å; G574-M636 VanDerWaalsContact CA-O 3.3Å; G574-M636 WeakPolarHBondContact CA-O 2.9Å; G574-M636 WeakPolarHBondContact O-CE 3.46Å; G574-G640 PolarHBondContact N-O 3.39Å; G574-A641 PolarHBondContact N-O 3.15Å
575	R	93.6	Very high	91.3	Very high	73 Å²	73	67 Å²	67	28%	0.275	33%	0.331	S	S	.	.	B	Isolated β-bridge	trans	-57.9	124.4	-172.8	-176.6	177.6	163.4	-159.8	-7.9	111.5	F566 A569 C571 L573 A641 F642 Y643	F566-R575 CarbonylContact O-C 3.56Å; F566-R575 WeakPolarHBondContact O-CA 3.38Å; A569-R575 PolarHBondContact O-NH1 3.39Å; C571-R575 HydrophobicContact CB-CB 4.29Å; C571-R575 HydrophobicContact CB-CG 4.32Å; L573-R575 PolarHBondContact O-N 2.99Å; R575-A641 WeakPolarHBondContact CB-O 3.42Å; R575-A641 PolarHBondContact N-O 2.91Å; R575-F642 HydrophobicContact CB-CD1 4.12Å; R575-F642 HydrophobicContact CG-CD1 4.49Å; R575-Y643 PolarHBondContact O-N 3.35Å
576	I	94.2	Very high	91.5	Very high	1 Å²	1	64.8 Å²	64.8	1%	0.005	31%	0.308	C	S	.	.			trans	-88.2	128.9	177.5	-53	173	0	0	0	108.3	L563 F566 R567 G574 N578 D581 L582 L585 M636	L563-I576 HydrophobicContact CB-CD1 4.26Å; L563-I576 HydrophobicContact CD2-CD1 4.2Å; F566-I576 HydrophobicContact CB-CD1 3.93Å; F566-I576 HydrophobicContact CB-CG1 4.03Å; F566-I576 PolarHBondContact O-N 3.14Å; R567-I576 HydrophobicContact CB-CB 4.5Å; G574-I576 PolarHBondContact O-N 2.91Å; I576-N578 WeakPolarHBondContact CG2-O 3.49Å; I576-D581 HydrophobicContact CG2-CB 3.93Å; I576-L582 HydrophobicContact CD1-CD1 4.03Å; I576-L582 HydrophobicContact CG2-CB 4.13Å; I576-L585 HydrophobicContact CD1-CD1 3.63Å; I576-L585 HydrophobicContact CG1-CD1 3.82Å; I576-M636 HydrophobicContact CD1-CE 4.07Å; I576-M636 HydrophobicContact CG1-CE 3.79Å
577	V	89.9	Confident	91.5	Very high	79 Å²	79	65.3 Å²	65.3	48%	0.479	31%	0.31	S	S	.	.			trans	-96.1	-46.7	-177.7	-177	0	0	0	0	111.5	F642	V577-F642 HydrophobicContact CG2-CD1 4.18Å
578	N	89.2	Confident	91.7	Very high	81 Å²	81	64 Å²	64	43%	0.433	31%	0.307	S	S	.	.			trans	-105.1	148	-171.6	-48.8	-55	0	0	0	111.8	I576 E580 D581 L582	I576-N578 WeakPolarHBondContact CG2-O 3.49Å; N578-E580 VanDerWaalsContact C-N 3.3Å; N578-E580 HydrophobicContact CB-CB 4.48Å; N578-E580 PolarHBondContact O-N 2.86Å; N578-D581 HydrophobicContact CB-CB 4.33Å; N578-D581 PolarHBondContact ND2-OD2 3.41Å; N578-D581 PolarHBondContact O-N 3.19Å; N578-D581 VanDerWaalsContact O-N 3.15Å; N578-L582 PolarHBondContact O-N 3.33Å; N578-L582 VanDerWaalsContact O-N 3.15Å
579	D	89.3	Confident	92.1	Very high	79 Å²	79	61.5 Å²	61.5	42%	0.422	29%	0.294	S	S	.	.	H	α-helix	trans	-64.4	-35.9	170.9	-86.4	-52.1	0	0	0	112.2	R567 D581 L582 Y583	R567-D579 IonicContact CZ-OD1 2.76Å; R567-D579 IonicContact CZ-OD2 2.63Å; R567-D579 IonicContact NE-OD1 2.63Å; R567-D579 IonicContact NE-OD2 3.25Å; R567-D579 IonicContact NH1-OD1 2.74Å; R567-D579 PolarHBondContact NH1-OD1 2.83Å; R567-D579 IonicContact NH1-OD2 3.04Å; R567-D579 PolarHBondContact NH1-OD2 3.1Å; R567-D579 IonicContact NH2-OD1 2.84Å; R567-D579 IonicContact NH2-OD2 3.62Å; R567-D579 PolarHBondContact NH2-OD2 2.96Å; D579-D581 PolarHBondContact O-N 3.15Å; D579-L582 WeakPolarHBondContact O-CA 3.44Å; D579-L582 WeakPolarHBondContact O-CB 3.47Å; D579-L582 PolarHBondContact O-N 2.91Å; D579-Y583 PolarHBondContact O-N 3.04Å
580	E	91.3	Very high	92.6	Very high	123 Å²	123	58.3 Å²	58.3	58%	0.575	27%	0.267	S	S	*	.	H	α-helix	trans	-54	-36.8	171	-67.6	-50.6	122.5	0	0	113.1	N578 Y584 R645	N578-E580 VanDerWaalsContact C-N 3.3Å; N578-E580 HydrophobicContact CB-CB 4.48Å; N578-E580 PolarHBondContact O-N 2.86Å; E580-Y584 VanDerWaalsContact O-CB 3.24Å; E580-Y584 WeakPolarHBondContact O-CB 3.26Å; E580-Y584 PolarHBondContact O-N 2.76Å; E580-R645 PolarHBondContact O-NH2 3.15Å
581	D	93.1	Very high	92.9	Very high	14 Å²	14	52.1 Å²	52.1	8%	0.075	25%	0.247	C	C	.	.	H	α-helix	trans	-78.7	-31.9	177.8	-73.1	-44.2	0	0	0	112.1	I576 N578 D579 L585 Y643 R645	I576-D581 HydrophobicContact CG2-CB 3.93Å; N578-D581 HydrophobicContact CB-CB 4.33Å; N578-D581 PolarHBondContact ND2-OD2 3.41Å; N578-D581 PolarHBondContact O-N 3.19Å; N578-D581 VanDerWaalsContact O-N 3.15Å; D579-D581 PolarHBondContact O-N 3.15Å; D581-L585 WeakPolarHBondContact O-CB 3.17Å; D581-L585 WeakPolarHBondContact O-CD1 3.25Å; D581-L585 VanDerWaalsContact O-CG 3.26Å; D581-L585 WeakPolarHBondContact O-CG 3.33Å; D581-L585 PolarHBondContact O-N 3.08Å; D581-Y643 HydrophobicContact CB-CD1 3.88Å; D581-Y643 HydrophobicContact CB-CE1 3.97Å; D581-R645 IonicContact OD1-CZ 3.96Å; D581-R645 VanDerWaalsContact OD1-CZ 3.25Å; D581-R645 IonicContact OD1-NE 2.68Å; D581-R645 PolarHBondContact OD1-NE 2.61Å; D581-R645 IonicContact OD1-NH2 3.3Å; D581-R645 PolarHBondContact OD1-NH2 3.49Å
582	L	94.1	Very high	93.2	Very high	6 Å²	6	52.2 Å²	52.2	3%	0.031	25%	0.25	C	C	.	.	H	α-helix	trans	-64.4	-45.7	170.6	176.1	58.3	0	0	0	111.1	L563 I576 N578 D579 T586	L563-L582 HydrophobicContact CB-CD1 3.52Å; I576-L582 HydrophobicContact CD1-CD1 4.03Å; I576-L582 HydrophobicContact CG2-CB 4.13Å; N578-L582 PolarHBondContact O-N 3.33Å; N578-L582 VanDerWaalsContact O-N 3.15Å; D579-L582 WeakPolarHBondContact O-CA 3.44Å; D579-L582 WeakPolarHBondContact O-CB 3.47Å; D579-L582 PolarHBondContact O-N 2.91Å; L582-T586 VanDerWaalsContact O-CB 3.31Å; L582-T586 WeakPolarHBondContact O-CB 3.2Å; L582-T586 PolarHBondContact O-N 3.41Å; L582-T586 PolarHBondContact O-OG1 2.92Å
583	Y	93.5	Very high	93.5	Very high	73 Å²	73	44 Å²	44	29%	0.286	22%	0.215	S	C	.	.	H	α-helix	trans	-63.5	-50.9	176.2	173.2	-133.7	0	0	0	111.5	Q528 D579 L585 T586 K587	Q528-Y583 HydrophobicContact CB-CE2 4.13Å; Q528-Y583 HydrophobicContact CG-CD2 4.21Å; Q528-Y583 HydrophobicContact CG-CE2 3.71Å; D579-Y583 PolarHBondContact O-N 3.04Å; Y583-L585 PolarHBondContact O-N 3.29Å; Y583-T586 PolarHBondContact O-N 3.33Å; Y583-T586 VanDerWaalsContact O-N 3.15Å; Y583-K587 HydrophobicContact CE2-CB 4.5Å; Y583-K587 HydrophobicContact CE2-CD 4.36Å; Y583-K587 PolarHBondContact O-N 3.45Å
584	Y	94.1	Very high	93.6	Very high	74 Å²	74	39.7 Å²	39.7	29%	0.29	19%	0.192	S	C	.	.	H	α-helix	trans	-58.8	-43.5	177.5	176.6	-98	0	0	0	112.8	E580 K588 Y643 R645	E580-Y584 VanDerWaalsContact O-CB 3.24Å; E580-Y584 WeakPolarHBondContact O-CB 3.26Å; E580-Y584 PolarHBondContact O-N 2.76Å; Y584-K588 HydrophobicContact CE1-CD 3.77Å; Y584-K588 WeakPolarHBondContact O-CB 3.28Å; Y584-K588 PolarHBondContact O-N 3.35Å; Y584-K588 PolarHBondContact OH-NZ 3.29Å; Y584-Y643 WeakPolarHBondContact CE1-OH 3.43Å; Y584-R645 HydrophobicContact CD1-CG 4.19Å; Y584-R645 HydrophobicContact CE1-CG 4.01Å
585	L	95.8	Very high	93.7	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.4	-41.8	175.2	-82.5	168.3	0	0	0	112.2	L563 I576 D581 Y583 K588 L589 Y635 M636 Y643	L563-L585 HydrophobicContact CD1-CB 3.84Å; L563-L585 HydrophobicContact CD2-CB 4.27Å; L563-L585 HydrophobicContact CD2-CD1 4.45Å; I576-L585 HydrophobicContact CD1-CD1 3.63Å; I576-L585 HydrophobicContact CG1-CD1 3.82Å; D581-L585 WeakPolarHBondContact O-CB 3.17Å; D581-L585 WeakPolarHBondContact O-CD1 3.25Å; D581-L585 VanDerWaalsContact O-CG 3.26Å; D581-L585 WeakPolarHBondContact O-CG 3.33Å; D581-L585 PolarHBondContact O-N 3.08Å; Y583-L585 PolarHBondContact O-N 3.29Å; L585-K588 PolarHBondContact O-N 3.24Å; L585-L589 HydrophobicContact CD2-CD1 4.3Å; L585-L589 VanDerWaalsContact O-CB 3.31Å; L585-L589 WeakPolarHBondContact O-CB 3.43Å; L585-L589 WeakPolarHBondContact O-CG 3.13Å; L585-L589 PolarHBondContact O-N 2.83Å; L585-Y635 HydrophobicContact CD2-CD1 4.49Å; L585-Y635 HydrophobicContact CD2-CE1 3.78Å; L585-M636 HydrophobicContact CD1-CE 3.68Å; L585-M636 HydrophobicContact CD1-SD 3.95Å; L585-M636 HydrophobicContact CD2-SD 4.05Å; L585-Y643 HydrophobicContact CD1-CD1 3.85Å; L585-Y643 HydrophobicContact CD1-CD2 3.89Å; L585-Y643 HydrophobicContact CD1-CE1 4.02Å; L585-Y643 HydrophobicContact CD1-CE2 4.09Å; L585-Y643 HydrophobicContact CD1-CG 3.77Å; L585-Y643 HydrophobicContact CD2-CD2 4.06Å; L585-Y643 HydrophobicContact CD2-CE1 4.47Å; L585-Y643 HydrophobicContact CD2-CE2 3.57Å; L585-Y643 HydrophobicContact CG-CD1 4.4Å; L585-Y643 HydrophobicContact CG-CD2 4.35Å; L585-Y643 HydrophobicContact CG-CE1 4.05Å; L585-Y643 HydrophobicContact CG-CE2 4.03Å
586	T	96.5	Very high	93.6	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.1	-55.7	177.8	-60.1	0	0	0	0	109.8	F556 V559 H560 L563 L582 Y583 K588 L589 A590	F556-T586 HydrophobicContact CD1-CG2 4.21Å; F556-T586 HydrophobicContact CD2-CG2 4.48Å; F556-T586 HydrophobicContact CE1-CG2 3.7Å; F556-T586 HydrophobicContact CE2-CG2 4.01Å; F556-T586 HydrophobicContact CZ-CG2 3.58Å; V559-T586 HydrophobicContact CG1-CG2 4.46Å; H560-T586 HydrophobicContact CB-CG2 3.72Å; L563-T586 WeakPolarHBondContact CD1-OG1 3.34Å; L582-T586 VanDerWaalsContact O-CB 3.31Å; L582-T586 WeakPolarHBondContact O-CB 3.2Å; L582-T586 PolarHBondContact O-N 3.41Å; L582-T586 PolarHBondContact O-OG1 2.92Å; Y583-T586 PolarHBondContact O-N 3.33Å; Y583-T586 VanDerWaalsContact O-N 3.15Å; T586-K588 PolarHBondContact O-N 3.04Å; T586-L589 PolarHBondContact O-N 2.82Å; T586-A590 WeakPolarHBondContact O-CB 3.38Å; T586-A590 PolarHBondContact O-N 3.37Å
587	K	95.4	Very high	93.5	Very high	36 Å²	36	44.3 Å²	44.3	16%	0.157	22%	0.216	C	C	.	.	H	α-helix	trans	-56.9	-46.8	179.3	-170.8	165.5	179.9	170.2	0	111.8	L532 E535 Y583 Q591	L532-K587 HydrophobicContact CB-CG 4.48Å; L532-K587 HydrophobicContact CD1-CG 4.07Å; L532-K587 HydrophobicContact CD2-CG 4.49Å; E535-K587 VanDerWaalsContact CD-CE 3.5Å; E535-K587 WeakPolarHBondContact OE1-CE 3.34Å; E535-K587 IonicContact OE1-NZ 3.79Å; E535-K587 PolarHBondContact OE1-NZ 3Å; E535-K587 WeakPolarHBondContact OE2-CE 3.3Å; E535-K587 IonicContact OE2-NZ 2.96Å; E535-K587 PolarHBondContact OE2-NZ 3.06Å; E535-K587 VanDerWaalsContact OE2-NZ 3.14Å; Y583-K587 HydrophobicContact CE2-CB 4.5Å; Y583-K587 HydrophobicContact CE2-CD 4.36Å; Y583-K587 PolarHBondContact O-N 3.45Å; K587-Q591 VanDerWaalsContact O-CB 3.27Å; K587-Q591 WeakPolarHBondContact O-CB 2.97Å; K587-Q591 PolarHBondContact O-N 2.79Å
588	K	95	Very high	93.5	Very high	81 Å²	81	40.6 Å²	40.6	35%	0.352	19%	0.194	S	C	.	.	H	α-helix	trans	-65.4	-43.5	-179	-174.9	172.4	-164.7	160.9	0	114.1	Y584 L585 T586 A592	Y584-K588 HydrophobicContact CE1-CD 3.77Å; Y584-K588 WeakPolarHBondContact O-CB 3.28Å; Y584-K588 PolarHBondContact O-N 3.35Å; Y584-K588 PolarHBondContact OH-NZ 3.29Å; L585-K588 PolarHBondContact O-N 3.24Å; T586-K588 PolarHBondContact O-N 3.04Å; K588-A592 PolarHBondContact O-N 2.89Å
589	L	96.8	Very high	93.5	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-79.7	-35.4	-179.1	-67.8	172.8	0	0	0	111.5	V559 L563 L585 T586 A592 V593 Y631 V632 Y635	V559-L589 HydrophobicContact CG1-CB 3.85Å; L563-L589 HydrophobicContact CD1-CD1 4.28Å; L563-L589 HydrophobicContact CD2-CD1 4.03Å; L585-L589 HydrophobicContact CD2-CD1 4.3Å; L585-L589 VanDerWaalsContact O-CB 3.31Å; L585-L589 WeakPolarHBondContact O-CB 3.43Å; L585-L589 WeakPolarHBondContact O-CG 3.13Å; L585-L589 PolarHBondContact O-N 2.83Å; T586-L589 PolarHBondContact O-N 2.82Å; L589-A592 PolarHBondContact O-N 2.98Å; L589-V593 WeakPolarHBondContact O-CB 3.42Å; L589-V593 WeakPolarHBondContact O-CG2 3.37Å; L589-V593 PolarHBondContact O-N 2.81Å; L589-Y631 HydrophobicContact CD2-CE1 4.01Å; L589-V632 HydrophobicContact CD1-CG1 4.34Å; L589-V632 HydrophobicContact CD1-CG2 4.47Å; L589-Y635 HydrophobicContact CD1-CD1 3.76Å; L589-Y635 HydrophobicContact CD1-CE1 4.18Å; L589-Y635 HydrophobicContact CD1-CG 4.33Å; L589-Y635 HydrophobicContact CD2-CD1 3.74Å; L589-Y635 HydrophobicContact CD2-CD2 3.86Å; L589-Y635 HydrophobicContact CD2-CE1 3.97Å; L589-Y635 HydrophobicContact CD2-CE2 4.07Å; L589-Y635 HydrophobicContact CD2-CG 3.69Å; L589-Y635 HydrophobicContact CG-CD1 4.28Å; L589-Y635 HydrophobicContact CG-CE1 4.4Å
590	A	96.2	Very high	93.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.8	-48	171.2	0	0	0	0	0	110.5	L532 F556 T586 A592 V593 I594	L532-A590 HydrophobicContact CD2-CB 3.96Å; F556-A590 HydrophobicContact CB-CB 4.4Å; F556-A590 HydrophobicContact CD2-CB 3.48Å; F556-A590 VanDerWaalsContact CD2-CB 3.48Å; F556-A590 HydrophobicContact CE2-CB 4.08Å; F556-A590 HydrophobicContact CG-CB 4.23Å; T586-A590 WeakPolarHBondContact O-CB 3.38Å; T586-A590 PolarHBondContact O-N 3.37Å; A590-A592 VanDerWaalsContact C-N 3.32Å; A590-A592 PolarHBondContact O-N 3.19Å; A590-V593 PolarHBondContact O-N 3.45Å; A590-I594 HydrophobicContact CB-CD1 3.99Å; A590-I594 VanDerWaalsContact O-CB 3.3Å; A590-I594 WeakPolarHBondContact O-CB 3.47Å; A590-I594 VanDerWaalsContact O-CG1 3.24Å; A590-I594 WeakPolarHBondContact O-CG1 3.34Å; A590-I594 PolarHBondContact O-N 3.35Å
591	Q	94.5	Very high	92.9	Very high	72 Å²	72	36.8 Å²	36.8	34%	0.336	17%	0.169	S	C	.	.	H	α-helix	trans	-53.6	-47	175.2	-168.6	-179.4	45.1	0	0	112.4	L532 L536 K587 V593 L595	L532-Q591 HydrophobicContact CD1-CB 3.87Å; L532-Q591 HydrophobicContact CD1-CG 3.99Å; L532-Q591 HydrophobicContact CD2-CB 4.36Å; L536-Q591 HydrophobicContact CD1-CG 4.44Å; L536-Q591 HydrophobicContact CD2-CG 3.98Å; K587-Q591 VanDerWaalsContact O-CB 3.27Å; K587-Q591 WeakPolarHBondContact O-CB 2.97Å; K587-Q591 PolarHBondContact O-N 2.79Å; Q591-V593 VanDerWaalsContact C-N 3.3Å; Q591-V593 PolarHBondContact O-N 3.28Å; Q591-L595 HydrophobicContact CG-CD1 4.3Å; Q591-L595 WeakPolarHBondContact O-CG 3.31Å; Q591-L595 PolarHBondContact O-N 3.44Å
592	A	94	Very high	92.5	Very high	32 Å²	32	38.4 Å²	38.4	26%	0.264	18%	0.176	S	C	.	.	H	α-helix	trans	-72.4	-18.4	-179.3	0	0	0	0	0	114.5	K588 L589 A590 K596	K588-A592 PolarHBondContact O-N 2.89Å; L589-A592 PolarHBondContact O-N 2.98Å; A590-A592 VanDerWaalsContact C-N 3.32Å; A590-A592 PolarHBondContact O-N 3.19Å; A592-K596 VanDerWaalsContact O-CD 3.3Å; A592-K596 WeakPolarHBondContact O-CD 3.32Å; A592-K596 VanDerWaalsContact O-CG 3.3Å; A592-K596 WeakPolarHBondContact O-CG 3.33Å
593	V	94.9	Very high	92.1	Very high	8 Å²	8	44.8 Å²	44.8	5%	0.048	21%	0.206	C	C	.	.	H	α-helix	trans	-94.5	-49.1	178.2	167.1	0	0	0	0	111.2	L555 L589 A590 Q591 L595 K596 E597 V628 Y631	L555-V593 HydrophobicContact CD1-CG1 4.29Å; L555-V593 HydrophobicContact CD2-CG1 3.77Å; L555-V593 HydrophobicContact CG-CG1 4.5Å; L589-V593 WeakPolarHBondContact O-CB 3.42Å; L589-V593 WeakPolarHBondContact O-CG2 3.37Å; L589-V593 PolarHBondContact O-N 2.81Å; A590-V593 PolarHBondContact O-N 3.45Å; Q591-V593 VanDerWaalsContact C-N 3.3Å; Q591-V593 PolarHBondContact O-N 3.28Å; V593-L595 PolarHBondContact O-N 3.09Å; V593-K596 PolarHBondContact O-N 2.87Å; V593-K596 VanDerWaalsContact O-N 3.09Å; V593-E597 HydrophobicContact CG1-CG 4.22Å; V593-E597 WeakPolarHBondContact O-CG 3.1Å; V593-E597 PolarHBondContact O-N 2.97Å; V593-V628 HydrophobicContact CG1-CB 4.42Å; V593-V628 HydrophobicContact CG1-CG1 3.95Å; V593-V628 HydrophobicContact CG1-CG2 3.56Å; V593-V628 HydrophobicContact CG2-CG1 4.33Å; V593-Y631 HydrophobicContact CG2-CD1 3.67Å; V593-Y631 HydrophobicContact CG2-CE1 3.75Å
594	I	93.8	Very high	91.5	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-54.3	-56	-179.3	-70.8	164.9	0	0	0	109.9	L532 A552 L555 A590 K596 E597 I598	L532-I594 HydrophobicContact CD2-CD1 4.18Å; A552-I594 HydrophobicContact CB-CD1 4.11Å; A552-I594 HydrophobicContact CB-CG1 4.21Å; A552-I594 HydrophobicContact CB-CG2 3.93Å; L555-I594 HydrophobicContact CB-CG1 3.97Å; L555-I594 HydrophobicContact CD1-CG1 4.07Å; A590-I594 HydrophobicContact CB-CD1 3.99Å; A590-I594 VanDerWaalsContact O-CB 3.3Å; A590-I594 WeakPolarHBondContact O-CB 3.47Å; A590-I594 VanDerWaalsContact O-CG1 3.24Å; A590-I594 WeakPolarHBondContact O-CG1 3.34Å; A590-I594 PolarHBondContact O-N 3.35Å; I594-K596 VanDerWaalsContact C-N 3.25Å; I594-K596 PolarHBondContact O-N 3.11Å; I594-E597 PolarHBondContact O-N 3.42Å; I594-I598 HydrophobicContact CG2-CD1 3.53Å; I594-I598 HydrophobicContact CG2-CG1 4.39Å; I594-I598 WeakPolarHBondContact O-CB 3.48Å; I594-I598 WeakPolarHBondContact O-CG1 2.95Å; I594-I598 PolarHBondContact O-N 2.84Å
595	L	92.5	Very high	90.6	Very high	39 Å²	39	44.8 Å²	44.8	20%	0.204	22%	0.215	C	C	.	.	H	α-helix	trans	-55.9	-38.6	177.9	-66.9	173.5	0	0	0	112.6	L536 D541 Q591 V593 Q599	L536-L595 HydrophobicContact CD1-CD2 4.08Å; L536-L595 HydrophobicContact CD1-CG 4.24Å; L536-L595 HydrophobicContact CD2-CD1 3.97Å; L536-L595 HydrophobicContact CD2-CD2 4.01Å; L536-L595 HydrophobicContact CD2-CG 4.25Å; D541-L595 HydrophobicContact CB-CD2 4.18Å; D541-L595 WeakPolarHBondContact O-CD2 3.3Å; Q591-L595 HydrophobicContact CG-CD1 4.3Å; Q591-L595 WeakPolarHBondContact O-CG 3.31Å; Q591-L595 PolarHBondContact O-N 3.44Å; V593-L595 PolarHBondContact O-N 3.09Å; L595-Q599 WeakPolarHBondContact O-CB 3.29Å; L595-Q599 PolarHBondContact O-N 3.02Å
596	K	92.5	Very high	89.7	Confident	117 Å²	117	48.4 Å²	48.4	51%	0.509	25%	0.246	S	C	.	.	H	α-helix	trans	-78.1	-27.3	-177.5	-75.3	-173.4	-177.1	-179.7	0	114.5	A592 V593 I594 K600	A592-K596 VanDerWaalsContact O-CD 3.3Å; A592-K596 WeakPolarHBondContact O-CD 3.32Å; A592-K596 VanDerWaalsContact O-CG 3.3Å; A592-K596 WeakPolarHBondContact O-CG 3.33Å; V593-K596 PolarHBondContact O-N 2.87Å; V593-K596 VanDerWaalsContact O-N 3.09Å; I594-K596 VanDerWaalsContact C-N 3.25Å; I594-K596 PolarHBondContact O-N 3.11Å; K596-K600 VanDerWaalsContact O-CD 3.28Å; K596-K600 WeakPolarHBondContact O-CD 3.4Å; K596-K600 VanDerWaalsContact O-CE 3.28Å; K596-K600 WeakPolarHBondContact O-CE 3.36Å; K596-K600 WeakPolarHBondContact O-CG 3.49Å
597	E	91.5	Very high	88.8	Confident	15 Å²	15	51.8 Å²	51.8	7%	0.07	27%	0.274	C	S	.	.	H	α-helix	trans	-91.4	-30.4	178.8	-61.3	-65.8	145.3	0	0	110.8	F551 L555 V593 I594 K600 F601 V624 R627	F551-E597 HydrophobicContact CE1-CB 4.06Å; F551-E597 HydrophobicContact CZ-CB 4.23Å; L555-E597 HydrophobicContact CD1-CB 4.2Å; V593-E597 HydrophobicContact CG1-CG 4.22Å; V593-E597 WeakPolarHBondContact O-CG 3.1Å; V593-E597 PolarHBondContact O-N 2.97Å; I594-E597 PolarHBondContact O-N 3.42Å; E597-K600 IonicContact OE1-NZ 3.48Å; E597-K600 PolarHBondContact OE1-NZ 3.49Å; E597-K600 IonicContact OE2-NZ 3.37Å; E597-F601 PolarHBondContact O-N 2.76Å; E597-V624 HydrophobicContact CG-CG1 4.18Å; E597-R627 IonicContact OE1-CZ 3.57Å; E597-R627 IonicContact OE1-NE 3.81Å; E597-R627 PolarHBondContact OE1-NE 2.91Å; E597-R627 IonicContact OE1-NH2 3.72Å; E597-R627 IonicContact OE2-CZ 3.86Å; E597-R627 IonicContact OE2-NE 2.69Å; E597-R627 PolarHBondContact OE2-NE 3.32Å; E597-R627 IonicContact OE2-NH2 2.69Å; E597-R627 PolarHBondContact OE2-NH2 2.77Å
598	I	89.2	Confident	87.4	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-66.5	-48.5	167.9	-67.5	174.6	0	0	0	111	D541 P543 F551 I594 K600 F601 H602	D541-I598 WeakPolarHBondContact O-CG2 3.11Å; P543-I598 HydrophobicContact CB-CD1 3.62Å; P543-I598 HydrophobicContact CG-CD1 3.93Å; F551-I598 HydrophobicContact CD1-CG1 4.45Å; I594-I598 HydrophobicContact CG2-CD1 3.53Å; I594-I598 HydrophobicContact CG2-CG1 4.39Å; I594-I598 WeakPolarHBondContact O-CB 3.48Å; I594-I598 WeakPolarHBondContact O-CG1 2.95Å; I594-I598 PolarHBondContact O-N 2.84Å; I598-K600 PolarHBondContact O-N 3.17Å; I598-F601 CarbonylContact O-C 3.58Å; I598-F601 WeakPolarHBondContact O-CA 3.45Å; I598-F601 WeakPolarHBondContact O-CB 3.24Å; I598-F601 PolarHBondContact O-N 2.77Å; I598-H602 WeakPolarHBondContact CG2-CE1 3.38Å; I598-H602 PolarHBondContact O-N 2.84Å
599	Q	89	Confident	85.5	Confident	103 Å²	103	56.2 Å²	56.2	48%	0.481	31%	0.308	S	S	.	.	H	α-helix	trans	-56.4	-38.1	176.4	-179.5	176.1	77.7	0	0	112.4	D541 L595 Q603	D541-Q599 HydrophobicContact CB-CB 4.38Å; D541-Q599 PolarHBondContact OD1-NE2 3.17Å; L595-Q599 WeakPolarHBondContact O-CB 3.29Å; L595-Q599 PolarHBondContact O-N 3.02Å; Q599-Q603 WeakPolarHBondContact O-CB 3.44Å; Q599-Q603 PolarHBondContact O-N 2.93Å
600	K	86.8	Confident	83.3	Confident	79 Å²	79	59.6 Å²	59.6	34%	0.343	33%	0.332	S	S	.	.	H	α-helix	trans	-67.8	-38	172.3	-72.5	168.9	-163	173.5	0	112.4	K596 E597 I598 Q603 T604	K596-K600 VanDerWaalsContact O-CD 3.28Å; K596-K600 WeakPolarHBondContact O-CD 3.4Å; K596-K600 VanDerWaalsContact O-CE 3.28Å; K596-K600 WeakPolarHBondContact O-CE 3.36Å; K596-K600 WeakPolarHBondContact O-CG 3.49Å; E597-K600 IonicContact OE1-NZ 3.48Å; E597-K600 PolarHBondContact OE1-NZ 3.49Å; E597-K600 IonicContact OE2-NZ 3.37Å; I598-K600 PolarHBondContact O-N 3.17Å; K600-Q603 PolarHBondContact O-N 2.86Å; K600-T604 WeakPolarHBondContact O-CB 3.48Å; K600-T604 PolarHBondContact O-N 3.39Å; K600-T604 PolarHBondContact O-OG1 3.19Å
601	F	82.4	Confident	81.3	Confident	21 Å²	21	68.1 Å²	68.1	9%	0.092	38%	0.376	C	S	.	.	H	α-helix	trans	-63	-50.3	176.1	176.4	-107.4	0	0	0	111.1	E597 I598 Q603 T604 Q605 T614 L616	E597-F601 PolarHBondContact O-N 2.76Å; I598-F601 CarbonylContact O-C 3.58Å; I598-F601 WeakPolarHBondContact O-CA 3.45Å; I598-F601 WeakPolarHBondContact O-CB 3.24Å; I598-F601 PolarHBondContact O-N 2.77Å; F601-Q603 VanDerWaalsContact C-N 3.32Å; F601-Q603 PolarHBondContact O-N 2.76Å; F601-T604 PolarHBondContact O-N 3.15Å; F601-T604 VanDerWaalsContact O-N 3.08Å; F601-Q605 HydrophobicContact CZ-CB 4.45Å; F601-Q605 WeakPolarHBondContact O-CB 3.47Å; F601-Q605 PolarHBondContact O-N 3.26Å; F601-T614 HydrophobicContact CE2-CG2 4.37Å; F601-T614 WeakPolarHBondContact CE2-O 3.29Å; F601-T614 WeakPolarHBondContact CZ-O 3.33Å; F601-L616 HydrophobicContact CD1-CD1 3.59Å; F601-L616 HydrophobicContact CD1-CG 3.91Å; F601-L616 HydrophobicContact CD2-CD1 4.33Å; F601-L616 HydrophobicContact CD2-CD2 3.87Å; F601-L616 HydrophobicContact CD2-CG 3.8Å; F601-L616 HydrophobicContact CE1-CD1 3.72Å; F601-L616 HydrophobicContact CE1-CG 3.78Å; F601-L616 HydrophobicContact CE2-CD1 4.45Å; F601-L616 HydrophobicContact CE2-CD2 4.14Å; F601-L616 HydrophobicContact CE2-CG 3.69Å; F601-L616 HydrophobicContact CG-CD1 3.93Å; F601-L616 HydrophobicContact CG-CD2 4.12Å; F601-L616 HydrophobicContact CG-CG 3.92Å; F601-L616 HydrophobicContact CZ-CB 4.46Å; F601-L616 HydrophobicContact CZ-CD1 4.17Å; F601-L616 HydrophobicContact CZ-CG 3.69Å
602	H	84.8	Confident	79.1	Confident	49 Å²	49	73.2 Å²	73.2	23%	0.227	40%	0.398	C	S	.	.	H	α-helix	trans	-55.8	-45.1	173	-64.5	161.6	0	0	0	112	E548 I598 T604 Q605 A606	E548-H602 IonicContact OE1-CD2 2.82Å; E548-H602 PolarHBondContact OE1-CD2 2.93Å; E548-H602 IonicContact OE1-CE1 2.88Å; E548-H602 IonicContact OE1-NE2 2.83Å; E548-H602 PolarHBondContact OE1-NE2 3.35Å; E548-H602 IonicContact OE2-NE2 2.67Å; I598-H602 WeakPolarHBondContact CG2-CE1 3.38Å; I598-H602 PolarHBondContact O-N 2.84Å; H602-T604 VanDerWaalsContact C-N 3.34Å; H602-T604 PolarHBondContact O-N 2.81Å; H602-Q605 PolarHBondContact O-N 3.11Å; H602-A606 WeakPolarHBondContact O-CB 3.38Å; H602-A606 PolarHBondContact O-N 2.92Å
603	Q	84.9	Confident	76.9	Confident	139 Å²	139	75.2 Å²	75.2	65%	0.65	41%	0.41	S	S	*	.	H	α-helix	trans	-62.4	-39	176.1	-173.5	175.8	39	0	0	112.7	Q599 K600 F601 A607	Q599-Q603 WeakPolarHBondContact O-CB 3.44Å; Q599-Q603 PolarHBondContact O-N 2.93Å; K600-Q603 PolarHBondContact O-N 2.86Å; F601-Q603 VanDerWaalsContact C-N 3.32Å; F601-Q603 PolarHBondContact O-N 2.76Å; Q603-A607 WeakPolarHBondContact O-CB 3.41Å; Q603-A607 PolarHBondContact O-N 3.38Å; Q603-A607 VanDerWaalsContact O-N 3.09Å
604	T	80.7	Confident	74.9	Confident	63 Å²	63	77.6 Å²	77.6	39%	0.387	42%	0.424	S	S	.	.	H	α-helix	trans	-69.7	-40.8	177.4	-55.2	0	0	0	0	111.1	K600 F601 H602 A607 N608	K600-T604 WeakPolarHBondContact O-CB 3.48Å; K600-T604 PolarHBondContact O-N 3.39Å; K600-T604 PolarHBondContact O-OG1 3.19Å; F601-T604 PolarHBondContact O-N 3.15Å; F601-T604 VanDerWaalsContact O-N 3.08Å; H602-T604 VanDerWaalsContact C-N 3.34Å; H602-T604 PolarHBondContact O-N 2.81Å; T604-A607 PolarHBondContact O-N 3.48Å; T604-N608 VanDerWaalsContact O-CB 3.23Å; T604-N608 WeakPolarHBondContact O-CB 3.4Å; T604-N608 PolarHBondContact O-N 2.98Å
605	Q	75.5	Confident	73.2	Confident	84 Å²	84	82.5 Å²	82.5	39%	0.393	45%	0.454	S	S	.	.	H	α-helix	trans	-65.4	-42.5	176.8	-171.7	-173.5	66.1	0	0	111.5	F601 H602 N608	F601-Q605 HydrophobicContact CZ-CB 4.45Å; F601-Q605 WeakPolarHBondContact O-CB 3.47Å; F601-Q605 PolarHBondContact O-N 3.26Å; H602-Q605 PolarHBondContact O-N 3.11Å; Q605-N608 CarbonylContact O-C 3.54Å; Q605-N608 PolarHBondContact O-N 2.99Å
606	A	77.6	Confident	71.7	Confident	77 Å²	77	81.5 Å²	81.5	64%	0.636	45%	0.449	S	S	*	.	H	α-helix	trans	-65.1	-37.4	175.6	0	0	0	0	0	112.9	H602	H602-A606 WeakPolarHBondContact O-CB 3.38Å; H602-A606 PolarHBondContact O-N 2.92Å
607	A	77.8	Confident	70.1	Confident	71 Å²	71	80 Å²	80	59%	0.587	45%	0.449	S	S	*	.	H	α-helix	trans	-70.8	-37.5	173.7	0	0	0	0	0	112.6	Q603 T604 T609	Q603-A607 WeakPolarHBondContact O-CB 3.41Å; Q603-A607 PolarHBondContact O-N 3.38Å; Q603-A607 VanDerWaalsContact O-N 3.09Å; T604-A607 PolarHBondContact O-N 3.48Å; A607-T609 VanDerWaalsContact C-N 3.29Å; A607-T609 PolarHBondContact O-N 2.89Å; A607-T609 PolarHBondContact O-OG1 3.28Å
608	N	64.1	Low	68.6	Low	73 Å²	73	83 Å²	83	39%	0.39	47%	0.47	S	S	.	.			trans	-83.8	63.5	-178.4	-70.6	-8.5	0	0	0	112	T604 Q605 S610 T614	T604-N608 VanDerWaalsContact O-CB 3.23Å; T604-N608 WeakPolarHBondContact O-CB 3.4Å; T604-N608 PolarHBondContact O-N 2.98Å; Q605-N608 CarbonylContact O-C 3.54Å; Q605-N608 PolarHBondContact O-N 2.99Å; N608-S610 PolarHBondContact O-N 2.83Å; N608-T614 PolarHBondContact ND2-OG1 3.04Å; N608-T614 VanDerWaalsContact ND2-OG1 3.11Å
609	T	57	Low	67.6	Low	136 Å²	136	88.4 Å²	88.4	83%	0.834	50%	0.495	S	S	*	.			trans	-68.6	12.5	-179.7	-5.9	0	0	0	0	114.9	A607	A607-T609 VanDerWaalsContact C-N 3.29Å; A607-T609 PolarHBondContact O-N 2.89Å; A607-T609 PolarHBondContact O-OG1 3.28Å
610	S	48.7	Very low	67.1	Low	73 Å²	73	83.5 Å²	83.5	51%	0.51	47%	0.472	S	S	.	.	S	Bend	trans	-84.6	154	179.7	89.2	0	0	0	0	111.9	N608 F612	N608-S610 PolarHBondContact O-N 2.83Å; S610-F612 CarbonylContact O-C 3.31Å; S610-F612 PolarHBondContact O-N 2.89Å
611	L	54.4	Low	67.1	Low	179 Å²	179	82.6 Å²	82.6	94%	0.937	48%	0.475	S	S	*	.	S	Bend	trans	-58.4	-17.3	-175.9	-66.4	169.7	0	0	0	115	S613	L611-S613 VanDerWaalsContact C-N 3.35Å; L611-S613 PolarHBondContact O-N 3Å
612	F	48.3	Very low	67.4	Low	180 Å²	180	85.8 Å²	85.8	79%	0.789	50%	0.5	S	S	*	.	S	Bend	trans	-85	80.7	168.4	-61.2	-76.2	0	0	0	109.6	S610 T614	S610-F612 CarbonylContact O-C 3.31Å; S610-F612 PolarHBondContact O-N 2.89Å; F612-T614 PolarHBondContact O-N 2.87Å
613	S	47.9	Very low	67.6	Low	74 Å²	74	87.7 Å²	87.7	52%	0.517	52%	0.515	S	S	.	.			trans	-49.8	128	170.1	-177.3	0	0	0	0	109.3	L611 V615	L611-S613 VanDerWaalsContact C-N 3.35Å; L611-S613 PolarHBondContact O-N 3Å; S613-V615 PolarHBondContact O-N 2.95Å
614	T	54.4	Low	67.9	Low	58 Å²	58	81.5 Å²	81.5	36%	0.356	49%	0.487	S	S	.	.			trans	-73.6	81.5	176.7	-53.2	0	0	0	0	107.9	F601 N608 F612 L616	F601-T614 HydrophobicContact CE2-CG2 4.37Å; F601-T614 WeakPolarHBondContact CE2-O 3.29Å; F601-T614 WeakPolarHBondContact CZ-O 3.33Å; N608-T614 PolarHBondContact ND2-OG1 3.04Å; N608-T614 VanDerWaalsContact ND2-OG1 3.11Å; F612-T614 PolarHBondContact O-N 2.87Å; T614-L616 PolarHBondContact O-N 3.1Å
615	V	56.5	Low	68.5	Low	103 Å²	103	82.2 Å²	82.2	62%	0.624	48%	0.482	S	S	*	.			trans	-61.8	129.4	178.7	179.7	0	0	0	0	108.9	S613 T617	S613-V615 PolarHBondContact O-N 2.95Å; V615-T617 PolarHBondContact O-N 2.78Å
616	L	60.8	Low	69.4	Low	18 Å²	18	81.8 Å²	81.8	9%	0.094	49%	0.488	C	S	.	.			trans	-63.6	106.6	165.7	-88.2	173.3	0	0	0	108.5	T547 E548 F551 F601 T614	T547-L616 WeakPolarHBondContact CG2-O 3.26Å; E548-L616 HydrophobicContact CB-CD1 4.38Å; E548-L616 HydrophobicContact CG-CD1 3.57Å; F551-L616 HydrophobicContact CB-CD1 4.36Å; F551-L616 HydrophobicContact CD2-CD2 3.84Å; F551-L616 HydrophobicContact CE2-CD2 4.01Å; F551-L616 HydrophobicContact CG-CD1 4.42Å; F551-L616 HydrophobicContact CG-CD2 4.13Å; F551-L616 HydrophobicContact CZ-CD2 4.47Å; F601-L616 HydrophobicContact CD1-CD1 3.59Å; F601-L616 HydrophobicContact CD1-CG 3.91Å; F601-L616 HydrophobicContact CD2-CD1 4.33Å; F601-L616 HydrophobicContact CD2-CD2 3.87Å; F601-L616 HydrophobicContact CD2-CG 3.8Å; F601-L616 HydrophobicContact CE1-CD1 3.72Å; F601-L616 HydrophobicContact CE1-CG 3.78Å; F601-L616 HydrophobicContact CE2-CD1 4.45Å; F601-L616 HydrophobicContact CE2-CD2 4.14Å; F601-L616 HydrophobicContact CE2-CG 3.69Å; F601-L616 HydrophobicContact CG-CD1 3.93Å; F601-L616 HydrophobicContact CG-CD2 4.12Å; F601-L616 HydrophobicContact CG-CG 3.92Å; F601-L616 HydrophobicContact CZ-CB 4.46Å; F601-L616 HydrophobicContact CZ-CD1 4.17Å; F601-L616 HydrophobicContact CZ-CG 3.69Å; T614-L616 PolarHBondContact O-N 3.1Å
617	T	60.1	Low	70.2	Confident	84 Å²	84	83.2 Å²	83.2	52%	0.515	48%	0.477	S	S	.	.			trans	-61.1	132.4	156.2	50.6	0	0	0	0	107.5	V615 E619	V615-T617 PolarHBondContact O-N 2.78Å; T617-E619 PolarHBondContact O-N 2.82Å; T617-E619 VanDerWaalsContact O-N 3.1Å; T617-E619 PolarHBondContact OG1-O 2.69Å; T617-E619 VanDerWaalsContact OG1-O 3.11Å
618	P	60.6	Low	71.1	Confident	78 Å²	78	79.9 Å²	79.9	51%	0.506	45%	0.45	S	S	.	.	S	Bend	trans	-60.6	-21.3	173.8	25	-33.8	0	0	0	111.6	L620	P618-L620 PolarHBondContact O-N 3.41Å
619	E	66.8	Low	72.6	Confident	114 Å²	114	77.6 Å²	77.6	53%	0.533	44%	0.438	S	S	.	.	S	Bend	trans	-64.1	115	166.1	-81.4	-59.8	151.2	0	0	112.8	T617 P621 R625	T617-E619 PolarHBondContact O-N 2.82Å; T617-E619 VanDerWaalsContact O-N 3.1Å; T617-E619 PolarHBondContact OG1-O 2.69Å; T617-E619 VanDerWaalsContact OG1-O 3.11Å; E619-P621 WeakPolarHBondContact O-CD 3.41Å; E619-R625 IonicContact OE2-CZ 3.14Å; E619-R625 VanDerWaalsContact OE2-CZ 3.3Å; E619-R625 IonicContact OE2-NH1 3.01Å; E619-R625 PolarHBondContact OE2-NH1 2.89Å; E619-R625 IonicContact OE2-NH2 2.67Å; E619-R625 PolarHBondContact OE2-NH2 2.99Å
620	L	79.7	Confident	74.5	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	42%	0.419	C	S	.	.			trans	-70	114.4	179.2	-179.4	63.6	0	0	0	111	F551 E554 L555 L558 P618 V624 R625	F551-L620 HydrophobicContact CD2-CD1 3.92Å; F551-L620 HydrophobicContact CE2-CD1 3.33Å; F551-L620 HydrophobicContact CZ-CD1 3.8Å; E554-L620 HydrophobicContact CB-CB 4.02Å; E554-L620 HydrophobicContact CB-CD2 4.25Å; E554-L620 HydrophobicContact CG-CB 4.49Å; L555-L620 HydrophobicContact CD2-CD1 3.66Å; L555-L620 HydrophobicContact CD2-CD2 3.81Å; L555-L620 HydrophobicContact CD2-CG 4.4Å; L555-L620 HydrophobicContact CG-CD1 3.9Å; L555-L620 HydrophobicContact CG-CD2 4.23Å; L558-L620 HydrophobicContact CB-CD2 4.36Å; L558-L620 HydrophobicContact CD2-CD2 3.76Å; P618-L620 PolarHBondContact O-N 3.41Å; L620-V624 HydrophobicContact CD1-CB 3.88Å; L620-V624 HydrophobicContact CD1-CG1 3.57Å; L620-V624 HydrophobicContact CG-CB 4.47Å; L620-V624 HydrophobicContact CG-CG1 4.43Å; L620-R625 HydrophobicContact CB-CG 4.08Å; L620-R625 HydrophobicContact CD2-CG 3.68Å; L620-R625 HydrophobicContact CG-CG 3.6Å; L620-R625 VanDerWaalsContact O-CD 3.27Å; L620-R625 WeakPolarHBondContact O-CD 3.35Å; L620-R625 WeakPolarHBondContact O-CG 3.32Å; L620-R625 PolarHBondContact O-NE 3.27Å; L620-R625 PolarHBondContact O-NH1 3.45Å
621	P	86	Confident	76.8	Confident	61 Å²	61	75.1 Å²	75.1	40%	0.396	41%	0.411	S	S	.	.			trans	-64.1	146.9	-172.7	21	-30.9	0	0	0	113	E619 T623 V624 R625	E619-P621 WeakPolarHBondContact O-CD 3.41Å; P621-T623 PolarHBondContact O-N 2.97Å; P621-T623 VanDerWaalsContact O-N 3.09Å; P621-V624 HydrophobicContact CG-CB 4.39Å; P621-V624 HydrophobicContact CG-CG2 3.79Å; P621-V624 WeakPolarHBondContact O-CA 3.38Å; P621-V624 WeakPolarHBondContact O-CB 3.29Å; P621-V624 PolarHBondContact O-N 3.37Å; P621-R625 PolarHBondContact O-N 3.44Å
622	S	88.1	Confident	78.8	Confident	87 Å²	87	66.6 Å²	66.6	61%	0.608	37%	0.366	S	S	*	.	H	α-helix	trans	-56.7	-30	-172	58.8	0	0	0	0	114.4	S626	S622-S626 WeakPolarHBondContact O-CB 3.39Å; S622-S626 PolarHBondContact O-N 2.96Å; S622-S626 PolarHBondContact O-OG 2.99Å
623	T	89.5	Confident	81	Confident	90 Å²	90	64.3 Å²	64.3	55%	0.552	35%	0.353	S	S	*	.	H	α-helix	trans	-67.4	-38.7	174.4	56.5	0	0	0	0	112.2	P621 R627	P621-T623 PolarHBondContact O-N 2.97Å; P621-T623 VanDerWaalsContact O-N 3.09Å; T623-R627 VanDerWaalsContact O-CB 3.25Å; T623-R627 WeakPolarHBondContact O-CB 3.33Å; T623-R627 PolarHBondContact O-N 3.16Å
624	V	92	Very high	83.3	Confident	9 Å²	9	69.3 Å²	69.3	6%	0.055	36%	0.36	C	S	.	.	H	α-helix	trans	-72.6	-47.5	172.5	-174.2	0	0	0	0	109.8	L555 E597 L620 P621 S626 R627 V628	L555-V624 HydrophobicContact CD2-CG1 4.06Å; E597-V624 HydrophobicContact CG-CG1 4.18Å; L620-V624 HydrophobicContact CD1-CB 3.88Å; L620-V624 HydrophobicContact CD1-CG1 3.57Å; L620-V624 HydrophobicContact CG-CB 4.47Å; L620-V624 HydrophobicContact CG-CG1 4.43Å; P621-V624 HydrophobicContact CG-CB 4.39Å; P621-V624 HydrophobicContact CG-CG2 3.79Å; P621-V624 WeakPolarHBondContact O-CA 3.38Å; P621-V624 WeakPolarHBondContact O-CB 3.29Å; P621-V624 PolarHBondContact O-N 3.37Å; V624-S626 PolarHBondContact O-N 3.41Å; V624-R627 PolarHBondContact O-N 3.48Å; V624-R627 VanDerWaalsContact O-N 3.1Å; V624-V628 HydrophobicContact CG1-CG2 3.85Å; V624-V628 WeakPolarHBondContact O-CB 3.44Å; V624-V628 WeakPolarHBondContact O-CG2 3.49Å; V624-V628 PolarHBondContact O-N 3.38Å
625	R	93.8	Very high	85.3	Confident	78 Å²	78	69 Å²	69	29%	0.294	35%	0.353	S	S	.	.	H	α-helix	trans	-51.6	-44.3	176.3	-68	-174.2	162	131.8	-14.6	111.1	E554 L558 E619 L620 P621 T629	E554-R625 IonicContact OE2-CZ 2.96Å; E554-R625 IonicContact OE2-NE 3.08Å; E554-R625 IonicContact OE2-NH2 3.96Å; E554-R625 PolarHBondContact OE2-NH2 3.28Å; L558-R625 HydrophobicContact CD2-CB 4.18Å; L558-R625 HydrophobicContact CD2-CG 4.24Å; E619-R625 IonicContact OE2-CZ 3.14Å; E619-R625 VanDerWaalsContact OE2-CZ 3.3Å; E619-R625 IonicContact OE2-NH1 3.01Å; E619-R625 PolarHBondContact OE2-NH1 2.89Å; E619-R625 IonicContact OE2-NH2 2.67Å; E619-R625 PolarHBondContact OE2-NH2 2.99Å; L620-R625 HydrophobicContact CB-CG 4.08Å; L620-R625 HydrophobicContact CD2-CG 3.68Å; L620-R625 HydrophobicContact CG-CG 3.6Å; L620-R625 VanDerWaalsContact O-CD 3.27Å; L620-R625 WeakPolarHBondContact O-CD 3.35Å; L620-R625 WeakPolarHBondContact O-CG 3.32Å; L620-R625 PolarHBondContact O-NE 3.27Å; L620-R625 PolarHBondContact O-NH1 3.45Å; P621-R625 PolarHBondContact O-N 3.44Å; R625-T629 WeakPolarHBondContact O-CB 3.23Å; R625-T629 PolarHBondContact O-N 3.28Å; R625-T629 VanDerWaalsContact O-N 3.14Å; R625-T629 PolarHBondContact O-OG1 2.94Å
626	S	93.9	Very high	87.2	Confident	74 Å²	74	64.1 Å²	64.1	52%	0.517	32%	0.323	S	S	.	.	H	α-helix	trans	-69.3	-44.5	176.5	-56	0	0	0	0	113.9	S622 V624 T630	S622-S626 WeakPolarHBondContact O-CB 3.39Å; S622-S626 PolarHBondContact O-N 2.96Å; S622-S626 PolarHBondContact O-OG 2.99Å; V624-S626 PolarHBondContact O-N 3.41Å; S626-T630 WeakPolarHBondContact O-CB 3.45Å; S626-T630 PolarHBondContact O-N 2.68Å; S626-T630 PolarHBondContact O-OG1 2.9Å
627	R	94.5	Very high	88.7	Confident	107 Å²	107	67.6 Å²	67.6	40%	0.404	34%	0.339	S	S	.	.	H	α-helix	trans	-61.4	-47.3	178.6	171.1	166	62.4	-114.8	11.7	111.7	E597 T623 V624 T630 Y631	E597-R627 IonicContact OE1-CZ 3.57Å; E597-R627 IonicContact OE1-NE 3.81Å; E597-R627 PolarHBondContact OE1-NE 2.91Å; E597-R627 IonicContact OE1-NH2 3.72Å; E597-R627 IonicContact OE2-CZ 3.86Å; E597-R627 IonicContact OE2-NE 2.69Å; E597-R627 PolarHBondContact OE2-NE 3.32Å; E597-R627 IonicContact OE2-NH2 2.69Å; E597-R627 PolarHBondContact OE2-NH2 2.77Å; T623-R627 VanDerWaalsContact O-CB 3.25Å; T623-R627 WeakPolarHBondContact O-CB 3.33Å; T623-R627 PolarHBondContact O-N 3.16Å; V624-R627 PolarHBondContact O-N 3.48Å; V624-R627 VanDerWaalsContact O-N 3.1Å; R627-T630 PolarHBondContact O-N 2.85Å; R627-Y631 WeakPolarHBondContact O-CB 3.49Å; R627-Y631 PolarHBondContact O-N 2.86Å
628	V	95.9	Very high	90.3	Very high	2 Å²	2	65.5 Å²	65.5	1%	0.012	33%	0.328	C	S	.	.	H	α-helix	trans	-66.4	-46.4	-179.3	172.8	0	0	0	0	110.9	L555 L558 V559 V593 V624 T630 Y631 V632	L555-V628 HydrophobicContact CD2-CG2 3.87Å; L558-V628 HydrophobicContact CD2-CB 3.95Å; L558-V628 HydrophobicContact CD2-CG1 3.9Å; L558-V628 HydrophobicContact CG-CG1 4.42Å; V559-V628 HydrophobicContact CG2-CG1 3.83Å; V593-V628 HydrophobicContact CG1-CB 4.42Å; V593-V628 HydrophobicContact CG1-CG1 3.95Å; V593-V628 HydrophobicContact CG1-CG2 3.56Å; V593-V628 HydrophobicContact CG2-CG1 4.33Å; V624-V628 HydrophobicContact CG1-CG2 3.85Å; V624-V628 WeakPolarHBondContact O-CB 3.44Å; V624-V628 WeakPolarHBondContact O-CG2 3.49Å; V624-V628 PolarHBondContact O-N 3.38Å; V628-T630 VanDerWaalsContact C-N 3.28Å; V628-T630 PolarHBondContact O-N 3.22Å; V628-Y631 PolarHBondContact O-N 3.03Å; V628-V632 WeakPolarHBondContact O-CG2 3.41Å; V628-V632 PolarHBondContact O-N 3.24Å
629	T	95.9	Very high	91.9	Very high	24 Å²	24	64.9 Å²	64.9	15%	0.147	32%	0.317	C	S	.	.	H	α-helix	trans	-56.7	-43.2	175.1	-57.6	0	0	0	0	111.6	T562 R625 V632 R633	T562-T629 HydrophobicContact CG2-CG2 4.13Å; R625-T629 WeakPolarHBondContact O-CB 3.23Å; R625-T629 PolarHBondContact O-N 3.28Å; R625-T629 VanDerWaalsContact O-N 3.14Å; R625-T629 PolarHBondContact O-OG1 2.94Å; T629-V632 PolarHBondContact O-N 3.15Å; T629-R633 WeakPolarHBondContact O-CG 3.47Å; T629-R633 PolarHBondContact O-N 2.95Å
630	T	96.4	Very high	93	Very high	69 Å²	69	61.1 Å²	61.1	42%	0.423	31%	0.309	S	S	.	.	H	α-helix	trans	-67.6	-39.5	178.2	-55.3	0	0	0	0	112.3	S626 R627 V628 R633 R634	S626-T630 WeakPolarHBondContact O-CB 3.45Å; S626-T630 PolarHBondContact O-N 2.68Å; S626-T630 PolarHBondContact O-OG1 2.9Å; R627-T630 PolarHBondContact O-N 2.85Å; V628-T630 VanDerWaalsContact C-N 3.28Å; V628-T630 PolarHBondContact O-N 3.22Å; T630-R633 PolarHBondContact O-N 3.2Å; T630-R634 PolarHBondContact O-N 3.37Å
631	Y	96.7	Very high	93.5	Very high	88 Å²	88	63.6 Å²	63.6	35%	0.345	33%	0.329	S	S	.	.	H	α-helix	trans	-62	-47	174.8	170.7	-109.5	0	0	0	111.8	L589 V593 R627 V628 R634 Y635	L589-Y631 HydrophobicContact CD2-CE1 4.01Å; V593-Y631 HydrophobicContact CG2-CD1 3.67Å; V593-Y631 HydrophobicContact CG2-CE1 3.75Å; R627-Y631 WeakPolarHBondContact O-CB 3.49Å; R627-Y631 PolarHBondContact O-N 2.86Å; V628-Y631 PolarHBondContact O-N 3.03Å; Y631-R634 PolarHBondContact O-N 2.94Å; Y631-Y635 WeakPolarHBondContact O-CB 3.37Å; Y631-Y635 PolarHBondContact O-N 2.77Å
632	V	96.7	Very high	93.8	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-61.2	-45.9	177	174.2	0	0	0	0	110.8	V559 T562 L563 L589 V628 T629 Y635 M636	V559-V632 HydrophobicContact CG1-CG2 4.43Å; V559-V632 HydrophobicContact CG2-CG2 4.19Å; T562-V632 HydrophobicContact CG2-CB 3.93Å; T562-V632 HydrophobicContact CG2-CG1 3.62Å; L563-V632 HydrophobicContact CD2-CG1 3.76Å; L563-V632 HydrophobicContact CG-CG1 4Å; L589-V632 HydrophobicContact CD1-CG1 4.34Å; L589-V632 HydrophobicContact CD1-CG2 4.47Å; V628-V632 WeakPolarHBondContact O-CG2 3.41Å; V628-V632 PolarHBondContact O-N 3.24Å; T629-V632 PolarHBondContact O-N 3.15Å; V632-Y635 WeakPolarHBondContact O-CB 3.35Å; V632-Y635 PolarHBondContact O-N 3.41Å; V632-M636 HydrophobicContact CG1-CG 4.42Å; V632-M636 WeakPolarHBondContact O-CG 3.49Å; V632-M636 PolarHBondContact O-N 3.39Å
633	R	95.8	Very high	94	Very high	133 Å²	133	62 Å²	62	50%	0.502	31%	0.305	S	S	.	.	H	α-helix	trans	-56.9	-53.4	177	-72.3	176.4	-169.3	176	5.8	112.3	F566 T629 T630 Y635 M636 E637	F566-R633 HydrophobicContact CE2-CG 4.3Å; F566-R633 HydrophobicContact CZ-CB 4.43Å; F566-R633 HydrophobicContact CZ-CG 4.11Å; T629-R633 WeakPolarHBondContact O-CG 3.47Å; T629-R633 PolarHBondContact O-N 2.95Å; T630-R633 PolarHBondContact O-N 3.2Å; R633-Y635 VanDerWaalsContact C-N 3.27Å; R633-Y635 PolarHBondContact O-N 2.74Å; R633-M636 PolarHBondContact O-N 3.09Å; R633-E637 WeakPolarHBondContact O-CB 3.45Å; R633-E637 VanDerWaalsContact O-CG 3.27Å; R633-E637 WeakPolarHBondContact O-CG 3.43Å; R633-E637 PolarHBondContact O-N 3.07Å
634	R	95.8	Very high	93.9	Very high	179 Å²	179	67.5 Å²	67.5	68%	0.675	32%	0.315	S	S	*	.	H	α-helix	trans	-61.6	-33	177.4	-71	-170.4	-179.5	-156.7	2.5	113.4	T630 Y631 E637 S638	T630-R634 PolarHBondContact O-N 3.37Å; Y631-R634 PolarHBondContact O-N 2.94Å; R634-E637 WeakPolarHBondContact CA-OE2 3.42Å; R634-S638 PolarHBondContact O-N 2.95Å; R634-S638 PolarHBondContact O-OG 2.98Å
635	Y	96.2	Very high	93.7	Very high	51 Å²	51	71 Å²	71	20%	0.2	33%	0.328	C	S	.	.	H	α-helix	trans	-65.8	-39.1	174.4	-177	-88.2	0	0	0	112.1	L585 L589 Y631 V632 R633 S638 K639	L585-Y635 HydrophobicContact CD2-CD1 4.49Å; L585-Y635 HydrophobicContact CD2-CE1 3.78Å; L589-Y635 HydrophobicContact CD1-CD1 3.76Å; L589-Y635 HydrophobicContact CD1-CE1 4.18Å; L589-Y635 HydrophobicContact CD1-CG 4.33Å; L589-Y635 HydrophobicContact CD2-CD1 3.74Å; L589-Y635 HydrophobicContact CD2-CD2 3.86Å; L589-Y635 HydrophobicContact CD2-CE1 3.97Å; L589-Y635 HydrophobicContact CD2-CE2 4.07Å; L589-Y635 HydrophobicContact CD2-CG 3.69Å; L589-Y635 HydrophobicContact CG-CD1 4.28Å; L589-Y635 HydrophobicContact CG-CE1 4.4Å; Y631-Y635 WeakPolarHBondContact O-CB 3.37Å; Y631-Y635 PolarHBondContact O-N 2.77Å; V632-Y635 WeakPolarHBondContact O-CB 3.35Å; V632-Y635 PolarHBondContact O-N 3.41Å; R633-Y635 VanDerWaalsContact C-N 3.27Å; R633-Y635 PolarHBondContact O-N 2.74Å; Y635-S638 PolarHBondContact O-OG 3.41Å; Y635-K639 WeakPolarHBondContact O-CE 3.48Å; Y635-K639 WeakPolarHBondContact O-CG 3.43Å; Y635-K639 PolarHBondContact O-NZ 3.21Å
636	M	95.6	Very high	93	Very high	0 Å²	0	78.3 Å²	78.3	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-77	-37.7	178.5	-63.7	-52.1	-64.9	0	0	112.4	L563 F566 G574 I576 L585 V632 R633 S638 K639 Y643	L563-M636 HydrophobicContact CD2-CE 4.4Å; L563-M636 HydrophobicContact CD2-CG 3.96Å; L563-M636 HydrophobicContact CD2-SD 3.7Å; F566-M636 HydrophobicContact CB-CE 4.37Å; F566-M636 HydrophobicContact CD1-CB 3.76Å; F566-M636 HydrophobicContact CD1-CG 4.15Å; F566-M636 HydrophobicContact CD2-CB 4.43Å; F566-M636 HydrophobicContact CD2-CG 4.06Å; F566-M636 HydrophobicContact CE1-CB 3.49Å; F566-M636 VanDerWaalsContact CE1-CB 3.49Å; F566-M636 HydrophobicContact CE1-CG 4.18Å; F566-M636 HydrophobicContact CE2-CB 4.21Å; F566-M636 HydrophobicContact CE2-CG 4.08Å; F566-M636 HydrophobicContact CG-CB 4.23Å; F566-M636 HydrophobicContact CG-CE 4.47Å; F566-M636 HydrophobicContact CG-CG 4.11Å; F566-M636 HydrophobicContact CZ-CB 3.74Å; F566-M636 HydrophobicContact CZ-CG 4.14Å; G574-M636 VanDerWaalsContact CA-O 3.3Å; G574-M636 WeakPolarHBondContact CA-O 2.9Å; G574-M636 WeakPolarHBondContact O-CE 3.46Å; I576-M636 HydrophobicContact CD1-CE 4.07Å; I576-M636 HydrophobicContact CG1-CE 3.79Å; L585-M636 HydrophobicContact CD1-CE 3.68Å; L585-M636 HydrophobicContact CD1-SD 3.95Å; L585-M636 HydrophobicContact CD2-SD 4.05Å; V632-M636 HydrophobicContact CG1-CG 4.42Å; V632-M636 WeakPolarHBondContact O-CG 3.49Å; V632-M636 PolarHBondContact O-N 3.39Å; R633-M636 PolarHBondContact O-N 3.09Å; M636-S638 PolarHBondContact O-N 2.87Å; M636-K639 WeakPolarHBondContact O-CB 3.46Å; M636-K639 PolarHBondContact O-N 3.35Å; M636-K639 VanDerWaalsContact O-N 3.08Å; M636-Y643 HydrophobicContact CE-CD2 4.4Å
637	E	93.5	Very high	91.8	Very high	92 Å²	92	80 Å²	80	43%	0.43	36%	0.362	S	S	.	.	H	α-helix	trans	-57.9	-44.3	174.3	-72.2	155.3	-167	0	0	111.7	L573 R633 R634 K639 G640	L573-E637 HydrophobicContact CD1-CG 4.41Å; R633-E637 WeakPolarHBondContact O-CB 3.45Å; R633-E637 VanDerWaalsContact O-CG 3.27Å; R633-E637 WeakPolarHBondContact O-CG 3.43Å; R633-E637 PolarHBondContact O-N 3.07Å; R634-E637 WeakPolarHBondContact CA-OE2 3.42Å; E637-K639 PolarHBondContact O-N 3.17Å; E637-G640 PolarHBondContact O-N 3.04Å
638	S	93.8	Very high	89.7	Confident	40 Å²	40	83 Å²	83	28%	0.28	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	21.1	173.5	54.2	0	0	0	0	114.4	E241 R634 Y635 M636	E241-S638 WeakPolarHBondContact OE1-CB 3.25Å; R634-S638 PolarHBondContact O-N 2.95Å; R634-S638 PolarHBondContact O-OG 2.98Å; Y635-S638 PolarHBondContact O-OG 3.41Å; M636-S638 PolarHBondContact O-N 2.87Å
639	K	92.7	Very high	87	Confident	65 Å²	65	90.1 Å²	90.1	28%	0.283	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	-0.3	169.5	-52.2	-65.2	151.3	-68	0	112.4	Y635 M636 E637 Y643	Y635-K639 WeakPolarHBondContact O-CE 3.48Å; Y635-K639 WeakPolarHBondContact O-CG 3.43Å; Y635-K639 PolarHBondContact O-NZ 3.21Å; M636-K639 WeakPolarHBondContact O-CB 3.46Å; M636-K639 PolarHBondContact O-N 3.35Å; M636-K639 VanDerWaalsContact O-N 3.08Å; E637-K639 PolarHBondContact O-N 3.17Å; K639-Y643 HydrophobicContact CD-CD2 4.41Å; K639-Y643 HydrophobicContact CG-CD2 4.13Å
640	G	90.4	Very high	84.4	Confident	35 Å²	35	96.1 Å²	96.1	36%	0.361	45%	0.448	S	S	.	.			trans	73.3	-151.8	-174.1	0	0	0	0	0	111.3	L573 G574 E637 F642	L573-G640 CarbonylContact C-O 3.52Å; L573-G640 WeakPolarHBondContact CA-O 3.37Å; G574-G640 PolarHBondContact N-O 3.39Å; E637-G640 PolarHBondContact O-N 3.04Å; G640-F642 PolarHBondContact O-N 3.13Å
641	A	90.9	Very high	81.3	Confident	52 Å²	52	97.3 Å²	97.3	43%	0.43	46%	0.457	S	S	.	.	S	Bend	trans	-65.1	-40.7	-173.3	0	0	0	0	0	114.3	K572 G574 R575	K572-A641 WeakPolarHBondContact O-CA 3.44Å; G574-A641 PolarHBondContact N-O 3.15Å; R575-A641 WeakPolarHBondContact CB-O 3.42Å; R575-A641 PolarHBondContact N-O 2.91Å
642	F	91.1	Very high	78.5	Confident	98 Å²	98	98.3 Å²	98.3	43%	0.43	48%	0.483	S	S	.	.	B	Isolated β-bridge	trans	-125.9	138.9	-175.6	-63	-88.3	0	0	0	110.8	R575 V577 G640 R644	R575-F642 HydrophobicContact CB-CD1 4.12Å; R575-F642 HydrophobicContact CG-CD1 4.49Å; V577-F642 HydrophobicContact CG2-CD1 4.18Å; G640-F642 PolarHBondContact O-N 3.13Å; F642-R644 PolarHBondContact O-N 2.82Å
643	Y	93.1	Very high	75.7	Confident	15 Å²	15	104.3 Å²	104.3	6%	0.059	52%	0.52	C	S	.	.			trans	-64.9	130.1	165	-179	-104.2	0	0	0	110.1	R575 D581 Y584 L585 M636 K639 R645	R575-Y643 PolarHBondContact O-N 3.35Å; D581-Y643 HydrophobicContact CB-CD1 3.88Å; D581-Y643 HydrophobicContact CB-CE1 3.97Å; Y584-Y643 WeakPolarHBondContact CE1-OH 3.43Å; L585-Y643 HydrophobicContact CD1-CD1 3.85Å; L585-Y643 HydrophobicContact CD1-CD2 3.89Å; L585-Y643 HydrophobicContact CD1-CE1 4.02Å; L585-Y643 HydrophobicContact CD1-CE2 4.09Å; L585-Y643 HydrophobicContact CD1-CG 3.77Å; L585-Y643 HydrophobicContact CD2-CD2 4.06Å; L585-Y643 HydrophobicContact CD2-CE1 4.47Å; L585-Y643 HydrophobicContact CD2-CE2 3.57Å; L585-Y643 HydrophobicContact CG-CD1 4.4Å; L585-Y643 HydrophobicContact CG-CD2 4.35Å; L585-Y643 HydrophobicContact CG-CE1 4.05Å; L585-Y643 HydrophobicContact CG-CE2 4.03Å; M636-Y643 HydrophobicContact CE-CD2 4.4Å; K639-Y643 HydrophobicContact CD-CD2 4.41Å; K639-Y643 HydrophobicContact CG-CD2 4.13Å; Y643-R645 HydrophobicContact CE1-CB 3.92Å
644	R	87.9	Confident	72.8	Confident	206 Å²	206	100.8 Å²	100.8	78%	0.777	52%	0.524	S	S	*	.			trans	-127.3	114.8	168.7	-65.6	-172.9	179	-166.3	-0.6	108.6	F642 R646	F642-R644 PolarHBondContact O-N 2.82Å; R644-R646 PolarHBondContact O-N 3.34Å; R644-R646 VanDerWaalsContact O-N 3.16Å
645	R	86.8	Confident	70.1	Confident	83 Å²	83	101 Å²	101	31%	0.313	54%	0.537	S	S	.	.			trans	-60.9	117.6	170.4	-164.7	-173	-52.7	-155.2	3.8	108	E580 D581 Y584 Y643 V647	E580-R645 PolarHBondContact O-NH2 3.15Å; D581-R645 IonicContact OD1-CZ 3.96Å; D581-R645 VanDerWaalsContact OD1-CZ 3.25Å; D581-R645 IonicContact OD1-NE 2.68Å; D581-R645 PolarHBondContact OD1-NE 2.61Å; D581-R645 IonicContact OD1-NH2 3.3Å; D581-R645 PolarHBondContact OD1-NH2 3.49Å; Y584-R645 HydrophobicContact CD1-CG 4.19Å; Y584-R645 HydrophobicContact CE1-CG 4.01Å; Y643-R645 HydrophobicContact CE1-CB 3.92Å; R645-V647 PolarHBondContact O-N 3.14Å
646	R	79.8	Confident	67.1	Low	232 Å²	232	103.5 Å²	103.5	88%	0.875	56%	0.562	S	S	*	*			trans	-68.3	101.1	165.1	-69.4	-173.1	-174.9	175.8	3.5	106.6	R644 Q648	R644-R646 PolarHBondContact O-N 3.34Å; R644-R646 VanDerWaalsContact O-N 3.16Å; R646-Q648 PolarHBondContact O-N 3.11Å
647	V	67.4	Low	64.3	Low	108 Å²	108	112.8 Å²	112.8	66%	0.655	60%	0.597	S	S	*	*			trans	-60.9	104.8	168.3	-179.5	0	0	0	0	106.5	R645 L649	R645-V647 PolarHBondContact O-N 3.14Å; V647-L649 VanDerWaalsContact C-N 3.29Å; V647-L649 HydrophobicContact CG1-CD1 4.06Å; V647-L649 PolarHBondContact O-N 2.94Å
648	Q	50.9	Low	61.6	Low	172 Å²	172	114.6 Å²	114.6	80%	0.804	62%	0.617	S	S	*	*			trans	-70	96.7	162	-75.9	179	-36.9	0	0	105.8	R646 I650	R646-Q648 PolarHBondContact O-N 3.11Å; Q648-I650 VanDerWaalsContact C-N 3.32Å; Q648-I650 PolarHBondContact O-N 3.27Å
649	L	40.4	Very low	59	Low	150 Å²	150	118.8 Å²	118.8	79%	0.785	63%	0.632	S	S	*	*			trans	-59.8	106.3	158.4	-80.6	88.8	0	0	0	105.9	V647 P651	V647-L649 VanDerWaalsContact C-N 3.29Å; V647-L649 HydrophobicContact CG1-CD1 4.06Å; V647-L649 PolarHBondContact O-N 2.94Å; L649-P651 WeakPolarHBondContact O-CD 3.42Å
650	I	39.4	Very low	56.4	Low	151 Å²	151	124.8 Å²	124.8	77%	0.774	66%	0.661	S	S	*	*			trans	-57.2	121.8	161.6	-60.3	172.2	0	0	0	105.1	Q648 A652	Q648-I650 VanDerWaalsContact C-N 3.32Å; Q648-I650 PolarHBondContact O-N 3.27Å; I650-A652 PolarHBondContact O-N 2.63Å
651	P	33.1	Very low	54	Low	94 Å²	94	129.1 Å²	129.1	61%	0.61	68%	0.681	S	S	*	*			trans	-57	127.8	173.8	-23.2	34.3	0	0	0	108.6	L649 T653	L649-P651 WeakPolarHBondContact O-CD 3.42Å; P651-T653 HydrophobicContact CB-CG2 4.21Å; P651-T653 PolarHBondContact O-N 2.66Å; P651-T653 PolarHBondContact O-OG1 3.42Å
652	A	36.2	Very low	51.6	Low	109 Å²	109	131 Å²	131	90%	0.901	70%	0.696	S	S	*	*			trans	-75.4	52.3	-178.9	0	0	0	0	0	111.8	I650 G654	I650-A652 PolarHBondContact O-N 2.63Å; A652-G654 PolarHBondContact O-N 3.04Å
653	T	39.1	Very low	49.1	Very low	126 Å²	126	134.5 Å²	134.5	77%	0.773	71%	0.713	S	S	*	*			trans	-84.5	89.9	-178.3	44.1	0	0	0	0	111.2	P651	P651-T653 HydrophobicContact CB-CG2 4.21Å; P651-T653 PolarHBondContact O-N 2.66Å; P651-T653 PolarHBondContact O-OG1 3.42Å
654	G	34	Very low	46.9	Very low	58 Å²	58	141.6 Å²	141.6	60%	0.598	75%	0.751	S	S	*	*			trans	77.2	67.7	145.3	0	0	0	0	0	117.7	A652 S656	A652-G654 PolarHBondContact O-N 3.04Å; G654-S656 PolarHBondContact O-N 3.23Å
655	I	38.5	Very low	44.8	Very low	185 Å²	185	140.4 Å²	140.4	95%	0.949	75%	0.752	S	S	*	*			trans	-74.5	77.6	149.6	-55.8	-179.7	0	0	0	107.6
656	S	34.9	Very low	42.4	Very low	102 Å²	102	141.8 Å²	141.8	71%	0.713	77%	0.772	S	S	*	*			trans	-112	87	177.5	57.8	0	0	0	0	111	G654	G654-S656 PolarHBondContact O-N 3.23Å
657	R	37.2	Very low	40.7	Very low	195 Å²	195	138.2 Å²	138.2	74%	0.736	77%	0.77	S	S	*	*			trans	-1.6	111.1	155.5	178.2	178.6	176.4	151.5	-8	115.4	E659	R657-E659 IonicContact CZ-OE2 3.1Å; R657-E659 IonicContact NE-OE2 3.99Å; R657-E659 PolarHBondContact NE-OE2 2.91Å; R657-E659 IonicContact NH2-OE2 2.66Å; R657-E659 PolarHBondContact NH2-OE2 3Å; R657-E659 PolarHBondContact O-N 3.15Å; R657-E659 VanDerWaalsContact O-N 3.09Å
658	P	35.4	Very low	39.6	Very low	131 Å²	131	138.6 Å²	138.6	85%	0.851	78%	0.775	S	S	*	*			trans	-79.5	87.3	171.1	32.5	-32.9	0	0	0	110.3
659	E	40.1	Very low	39.4	Very low	127 Å²	127	134.6 Å²	134.6	59%	0.593	77%	0.771	S	S	*	*			trans	-86.6	126.4	171.3	-166.3	146.7	130.4	0	0	110.9	R657 T661	R657-E659 IonicContact CZ-OE2 3.1Å; R657-E659 IonicContact NE-OE2 3.99Å; R657-E659 PolarHBondContact NE-OE2 2.91Å; R657-E659 IonicContact NH2-OE2 2.66Å; R657-E659 PolarHBondContact NH2-OE2 3Å; R657-E659 PolarHBondContact O-N 3.15Å; R657-E659 VanDerWaalsContact O-N 3.09Å; E659-T661 PolarHBondContact O-N 3.41Å
660	Q	36.9	Very low	39.5	Very low	192 Å²	192	134.8 Å²	134.8	90%	0.897	77%	0.771	S	S	*	*			trans	-87.3	101.7	-177.5	-62.1	177.5	12.8	0	0	110.9
661	T	39.7	Very low	39.7	Very low	125 Å²	125	134.2 Å²	134.2	77%	0.767	77%	0.769	S	S	*	*			trans	-140.1	138.5	164.8	-32.4	0	0	0	0	111.1	E659	E659-T661 PolarHBondContact O-N 3.41Å
662	A	42.3	Very low	40.3	Very low	91 Å²	91	138.9 Å²	138.9	75%	0.752	78%	0.78	S	S	*	*			trans	-79.3	124.9	-169.8	0	0	0	0	0	113.5
663	H	38.5	Very low	40.3	Very low	172 Å²	172	139.2 Å²	139.2	80%	0.796	77%	0.773	S	S	*	*				31.7	97.5	122.9	-172.4	-73.5	0	0	0	117.4
664	L	46	Very low	40.2	Very low	164 Å²	164	138.9 Å²	138.9	86%	0.859	78%	0.776	S	S	*	*			trans	-159.2	129.2	138.7	-108.1	167.6	0	0	0	113.2
665	K	44.4	Very low	40.6	Very low	181 Å²	181	141.9 Å²	141.9	79%	0.787	78%	0.782	S	S	*	*			trans	-25.4	140.8	177.1	-162.7	177.4	-177	-174.4	0	119.4
666	P	36.9	Very low	40.5	Very low	112 Å²	112	140.1 Å²	140.1	73%	0.727	77%	0.774	S	S	*	*			trans	-93.3	163.1	174.5	38.5	-35.8	0	0	0	114.2
667	D	44.1	Very low	40.5	Very low	158 Å²	158	141.1 Å²	141.1	85%	0.845	78%	0.78	S	S	*	*			trans	-153.9	153.4	146.1	-108.1	-40.1	0	0	0	110.3
668	P	43	Very low	40.4	Very low	116 Å²	116	136.6 Å²	136.6	75%	0.753	78%	0.779	S	S	*	*			trans	-115.7	144.8	-162.1	39.2	-30.4	0	0	0	116.5
669	A	46.2	Very low	40.7	Very low	88 Å²	88	136.3 Å²	136.3	73%	0.727	77%	0.774	S	S	*	*			trans	-160.9	131	159.9	0	0	0	0	0	115.6
670	I	44.3	Very low	40.7	Very low	153 Å²	153	141.4 Å²	141.4	79%	0.785	79%	0.788	S	S	*	*			trans	71.7	100.8	135.6	-63.1	174.1	0	0	0	120.6
671	L	42.7	Very low	40.9	Very low	140 Å²	140	137.4 Å²	137.4	73%	0.733	78%	0.782	S	S	*	*			trans	69.1	106	133.1	-60	-179.9	0	0	0	124.1
672	K	45.6	Very low	40.9	Very low	191 Å²	191	142.7 Å²	142.7	83%	0.83	79%	0.787	S	S	*	*				90.2	148.4	129.7	-70.4	178	174.4	-180	0	120.2
673	P	35.9	Very low	40.9	Very low	116 Å²	116	143.1 Å²	143.1	75%	0.753	78%	0.782	S	S	*	*			trans	-117	162	-166.6	41.9	-30.3	0	0	0	115.4
674	S	36.5	Very low	41.1	Very low	120 Å²	120	140.8 Å²	140.8	84%	0.839	78%	0.78	S	S	*	*			trans	-162.6	136.2	153	-89	0	0	0	0	115.4
675	V	43.9	Very low	40.9	Very low	120 Å²	120	139.7 Å²	139.7	73%	0.727	78%	0.781	S	S	*	*			trans	3.3	125.8	160.1	-80.5	0	0	0	0	122.9
676	N	35.7	Very low	40.9	Very low	148 Å²	148	140 Å²	140	79%	0.791	78%	0.784	S	S	*	*				28.5	113.8	120.1	-57.2	-2.4	0	0	0	120.7
677	C	35.7	Very low	41.3	Very low	123 Å²	123	139.8 Å²	139.8	83%	0.831	78%	0.783	S	S	*	*				-173.7	133.6	111.5	-89.1	0	0	0	0	108.1
678	S	34	Very low	41.2	Very low	101 Å²	101	141.4 Å²	141.4	71%	0.706	79%	0.785	S	S	*	*			cis	83.7	128.3	47.6	-164.8	0	0	0	0	114.5
679	T	42.8	Very low	40.9	Very low	124 Å²	124	142.3 Å²	142.3	76%	0.761	78%	0.784	S	S	*	*			trans	96.1	138.3	168.3	75.2	0	0	0	0	120.3
680	R	39	Very low	40.7	Very low	235 Å²	235	145.1 Å²	145.1	89%	0.887	79%	0.786	S	S	*	*			trans	66.1	141.5	155	-76.2	176.4	166.3	-161.9	-5.1	118.2
681	S	42.4	Very low	40.2	Very low	108 Å²	108	142.6 Å²	142.6	76%	0.755	78%	0.782	S	S	*	*			cis	-151.5	159.8	2	-91.8	0	0	0	0	113.6
682	R	38.6	Very low	40	Very low	235 Å²	235	142 Å²	142	89%	0.887	78%	0.784	S	S	*	*			trans	-77.3	-174.9	163.4	-115.1	-175.1	179.8	-165.8	2.4	110.7
683	P	43.1	Very low	39.6	Very low	100 Å²	100	139.2 Å²	139.2	65%	0.649	78%	0.783	S	S	*	*			cis	-143.6	-166.2	-19.5	34.4	-10.7	0	0	0	115.5
684	V	41.3	Very low	39.6	Very low	124 Å²	124	137.4 Å²	137.4	75%	0.752	77%	0.773	S	S	*	*			trans	71.7	123.1	157.8	-175.4	0	0	0	0	117.3
685	T	42.9	Very low	39.8	Very low	141 Å²	141	139.2 Å²	139.2	87%	0.865	77%	0.768	S	S	*	*				-151.9	162.1	84.7	32.8	0	0	0	0	117.6
686	H	43.8	Very low	39.6	Very low	187 Å²	187	141.4 Å²	141.4	87%	0.866	77%	0.77	S	S	*	*			trans	-71.2	178.2	-168.3	-96.6	-47.6	0	0	0	119.2
687	P	44.9	Very low	39.7	Very low	107 Å²	107	139.1 Å²	139.1	70%	0.695	76%	0.762	S	S	*	*			trans	-121	177.2	-160.9	45.5	-36.1	0	0	0	116.7
688	Q	43.7	Very low	39.7	Very low	192 Å²	192	140.5 Å²	140.5	90%	0.897	76%	0.76	S	S	*	*			trans	-150.9	178.5	155.1	-65.1	-166.8	21.9	0	0	109.3
689	N	35.8	Very low	39.9	Very low	135 Å²	135	145.4 Å²	145.4	72%	0.722	77%	0.765	S	S	*	*				-168.3	179.3	-57	-163.7	5.9	0	0	0	107.6
690	L	41.9	Very low	39.5	Very low	147 Å²	147	145.4 Å²	145.4	77%	0.77	77%	0.765	S	S	*	*			trans	73.4	123.3	176.1	-50.2	163.1	0	0	0	112.9
691	S	34.5	Very low	39.6	Very low	101 Å²	101	140.5 Å²	140.5	71%	0.706	76%	0.756	S	S	*	*				71	129.5	51.4	-50.2	0	0	0	0	111.5
692	T	37.5	Very low	39.3	Very low	126 Å²	126	142.5 Å²	142.5	77%	0.773	76%	0.758	S	S	*	*			cis	-160.9	146.9	45.5	-0.9	0	0	0	0	110.2
693	V	38.2	Very low	39.3	Very low	133 Å²	133	135.3 Å²	135.3	81%	0.806	75%	0.749	S	S	*	*				57.3	135.4	100.4	167.3	0	0	0	0	115.4
694	S	36.6	Very low	38.9	Very low	79 Å²	79	139.8 Å²	139.8	55%	0.552	76%	0.759	S	S	*	*			cis	-176.9	177.4	-7.8	173.9	0	0	0	0	111
695	H	40.1	Very low	38.7	Very low	158 Å²	158	138 Å²	138	73%	0.731	75%	0.752	S	S	*	*			trans	74.6	158.8	167.6	-45.8	-76	0	0	0	117.1
696	H	39.3	Very low	38.5	Very low	166 Å²	166	140 Å²	140	77%	0.769	75%	0.751	S	S	*	*			cis	-138	-156.5	6.9	-135.4	-58.7	0	0	0	112.8
697	T	38.6	Very low	38.2	Very low	100 Å²	100	136 Å²	136	61%	0.613	74%	0.744	S	S	*	*			trans	-132.6	153	-151.8	49.5	0	0	0	0	116.1
698	N	34.9	Very low	37.8	Very low	151 Å²	151	135 Å²	135	81%	0.807	75%	0.745	S	S	*	*			trans	37.8	125.9	145.7	-55.4	-7.7	0	0	0	121
699	Y	38.1	Very low	37.8	Very low	205 Å²	205	132.4 Å²	132.4	80%	0.804	74%	0.742	S	S	*	*				-152.3	161.6	126	-145.5	-101.9	0	0	0	112.2
700	V	35.2	Very low	38.1	Very low	124 Å²	124	131.4 Å²	131.4	75%	0.752	74%	0.743	S	S	*	*			trans	-142.8	140.9	180	-155.1	0	0	0	0	107.6
701	D	40.5	Very low	38.1	Very low	132 Å²	132	132.6 Å²	132.6	71%	0.706	75%	0.749	S	S	*	*			trans	-153.7	158.3	161.7	-126.2	-39.2	0	0	0	114.7
702	N	36.1	Very low	38.2	Very low	149 Å²	149	134.3 Å²	134.3	80%	0.797	75%	0.75	S	S	*	*			trans	-107.5	165	-179.2	-68.7	-84.9	0	0	0	111.2
703	A	38.4	Very low	38	Very low	85 Å²	85	133.5 Å²	133.5	70%	0.702	75%	0.745	S	S	*	*				179.3	132.5	124.5	0	0	0	0	0	114.3
704	F	35.5	Very low	38	Very low	193 Å²	193	133.3 Å²	133.3	85%	0.846	74%	0.744	S	S	*	*			trans	44.1	156.3	133.4	-75.9	-115.5	0	0	0	122.6
705	S	36.1	Very low	37.8	Very low	86 Å²	86	133.6 Å²	133.6	60%	0.601	75%	0.752	S	S	*	*			cis	170.7	168.4	-31.7	-90.6	0	0	0	0	108.4
706	Q	38.8	Very low	37.8	Very low	183 Å²	183	132.5 Å²	132.5	86%	0.855	76%	0.756	S	S	*	*			trans	75.7	144.9	168.5	-54.1	178.8	80.6	0	0	115.3
707	S	37.4	Very low	37.9	Very low	104 Å²	104	131.1 Å²	131.1	73%	0.727	75%	0.753	S	S	*	*			cis	-163.7	158.7	-7.8	45.2	0	0	0	0	112.9
708	A	37.6	Very low	38.2	Very low	86 Å²	86	131.3 Å²	131.3	71%	0.711	76%	0.756	S	S	*	*			trans	10.8	149.1	141.5	0	0	0	0	0	121
709	T	41.9	Very low	38.5	Very low	137 Å²	137	128.4 Å²	128.4	84%	0.84	74%	0.744	S	S	*	*			cis	-166.4	169.3	7	10.6	0	0	0	0	110.6
710	P	43.3	Very low	38.7	Very low	114 Å²	114	126.5 Å²	126.5	74%	0.74	74%	0.735	S	S	*	*			trans	-102	162.3	-172.9	39.7	-34.4	0	0	0	115.9
711	I	41.7	Very low	38.9	Very low	172 Å²	172	132.7 Å²	132.7	88%	0.882	75%	0.745	S	S	*	*			trans	-171.8	158.4	162.3	-97.1	144.8	0	0	0	107.1
712	N	35.4	Very low	38.9	Very low	137 Å²	137	132.8 Å²	132.8	73%	0.733	75%	0.747	S	S	*	*			cis	-169.3	157.9	-43.2	-161.6	8.5	0	0	0	106.8
713	T	35	Very low	39	Very low	109 Å²	109	131.9 Å²	131.9	67%	0.669	74%	0.744	S	S	*	*			trans	40.5	120.9	159.6	-29.1	0	0	0	0	120.9
714	T	37.7	Very low	39	Very low	129 Å²	129	134.5 Å²	134.5	79%	0.791	75%	0.746	S	S	*	*				171.3	138.3	107.4	-65.7	0	0	0	0	110.7
715	A	33	Very low	39.2	Very low	86 Å²	86	131.1 Å²	131.1	71%	0.711	74%	0.741	S	S	*	*			trans	-101.8	147.9	-178.9	0	0	0	0	0	113
716	V	39.8	Very low	39.4	Very low	135 Å²	135	133.9 Å²	133.9	82%	0.818	75%	0.749	S	S	*	*			trans	-143	127	151.5	-179	0	0	0	0	108.2
717	I	41.8	Very low	39.5	Very low	137 Å²	137	130.6 Å²	130.6	70%	0.703	74%	0.742	S	S	*	*			trans	-106.9	144.1	169.7	-61.1	168.5	0	0	0	107.6
718	P	43.6	Very low	39.6	Very low	104 Å²	104	132.5 Å²	132.5	68%	0.675	74%	0.743	S	S	*	*			trans	-140.5	105.8	132.6	23.7	-3	0	0	0	114.7
719	T	41.9	Very low	39.8	Very low	90 Å²	90	136.1 Å²	136.1	55%	0.552	75%	0.746	S	S	*	*				46.2	125.9	126.1	29.4	0	0	0	0	123.5
720	R	41.9	Very low	39.6	Very low	164 Å²	164	136 Å²	136	62%	0.619	74%	0.738	S	S	*	*			trans	64.9	119.9	133	-76.4	-174.7	175.4	-151.3	1.7	123.1	V13 D14 D15 E16	V13-R720 CarbonylContact O-C 3.54Å; D14-R720 WeakPolarHBondContact O-CA 3.4Å; D14-R720 PolarHBondContact O-N 3.38Å; D15-R720 WeakPolarHBondContact O-CG 3.46Å; D15-R720 PolarHBondContact O-NE 3.43Å; E16-R720 PolarHBondContact O-NH2 2.89Å
721	R	40.3	Very low	39.3	Very low	255 Å²	255	138 Å²	138	96%	0.962	74%	0.738	S	S	*	*			trans	-155.9	0	130.8	-168.4	179.6	-146.7	-141.7	1.4	112.1	T12 V13	T12-R721 WeakPolarHBondContact O-CB 3.22Å; V13-R721 PolarHBondContact N-O 3.13Å; V13-R721 CarbonylContact O-C 3.55Å; V13-R721 VanDerWaalsContact O-C 3.28Å; V13-R721 PolarHBondContact O-N 3.09Å; V13-R721 VanDerWaalsContact O-O 3.13Å

Retrieved 721 of 721 residues in 169.5 ms (Link to these results)

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