A0A5K4FDE0_SCHMA Loading...

Ion_trans_2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FDE0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 621 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.9	Very low	35.9	Very low	247 Å²	247	133 Å²	133	100%	1.217	75%	0.75	S	S	*	*				0	126.6	0	-74.6	172.5	167	0	0	107.1
2	A	32.6	Very low	36.1	Very low	98 Å²	98	132.9 Å²	132.9	81%	0.81	76%	0.759	S	S	*	*			trans	-100	122.1	170.1	0	0	0	0	0	108.6	V4	A2-V4 PolarHBondContact O-N 3.39Å
3	T	34.4	Very low	36.4	Very low	114 Å²	114	137.3 Å²	137.3	70%	0.699	77%	0.769	S	S	*	*			trans	-82.1	104.5	176.2	35.1	0	0	0	0	109.6	H5	T3-H5 PolarHBondContact O-CD2 2.95Å; T3-H5 VanDerWaalsContact O-CD2 3.29Å; T3-H5 PolarHBondContact O-N 2.97Å
4	V	34.2	Very low	36.4	Very low	111 Å²	111	131.7 Å²	131.7	67%	0.673	74%	0.744	S	S	*	*			trans	-74.6	106	177.1	-179.2	0	0	0	0	109.4	A2 F6	A2-V4 PolarHBondContact O-N 3.39Å; V4-F6 HydrophobicContact CG1-CD2 4.47Å; V4-F6 HydrophobicContact CG1-CE2 3.96Å; V4-F6 HydrophobicContact CG1-CZ 4.11Å
5	H	33.2	Very low	36.5	Very low	152 Å²	152	134.6 Å²	134.6	70%	0.704	76%	0.756	S	S	*	*			trans	-90.5	128.5	173	-73.6	-91.7	0	0	0	111	T3	T3-H5 PolarHBondContact O-CD2 2.95Å; T3-H5 VanDerWaalsContact O-CD2 3.29Å; T3-H5 PolarHBondContact O-N 2.97Å
6	F	33.2	Very low	36.5	Very low	161 Å²	161	133.6 Å²	133.6	71%	0.706	75%	0.747	S	S	*	*			trans	-95	106.2	171.2	-67.8	-88.8	0	0	0	109.6	V4 F19	V4-F6 HydrophobicContact CG1-CD2 4.47Å; V4-F6 HydrophobicContact CG1-CE2 3.96Å; V4-F6 HydrophobicContact CG1-CZ 4.11Å; F6-F19 HydrophobicContact CD1-CD1 4.31Å
7	V	37.9	Very low	36.3	Very low	108 Å²	108	131.8 Å²	131.8	66%	0.655	74%	0.742	S	S	*	*			trans	-92.4	124.7	172.3	-177.6	0	0	0	0	109.2	T9	V7-T9 HydrophobicContact CG1-CG2 4.48Å
8	A	34.3	Very low	36.2	Very low	88 Å²	88	135.6 Å²	135.6	73%	0.727	74%	0.743	S	S	*	*			trans	-82.9	119.3	173	0	0	0	0	0	110.1
9	T	40.1	Very low	36.1	Very low	91 Å²	91	136.2 Å²	136.2	56%	0.558	74%	0.738	S	S	*	*			trans	-109.4	121.6	173	47	0	0	0	0	110.3	V7	V7-T9 HydrophobicContact CG1-CG2 4.48Å
10	Q	37.6	Very low	36.1	Very low	196 Å²	196	138 Å²	138	92%	0.916	74%	0.739	S	S	*	*			trans	-84	131.8	169.2	-77.2	-177.1	-36.9	0	0	109.8
11	V	41.4	Very low	35.8	Very low	97 Å²	97	140.6 Å²	140.6	59%	0.588	74%	0.738	S	S	*	*			trans	-96.5	131.3	166.2	-179.3	0	0	0	0	107.2	Q13 S14	V11-Q13 PolarHBondContact O-N 3.38Å; V11-S14 PolarHBondContact O-N 2.88Å
12	P	38.4	Very low	35.7	Very low	132 Å²	132	133.5 Å²	133.5	86%	0.857	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	1.8	-166	-27.1	35.9	0	0	0	118.3
13	Q	40.3	Very low	35.7	Very low	190 Å²	190	136 Å²	136	89%	0.888	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.9	21	-172.5	-64.3	-172.1	-12	0	0	114.4	V11	V11-Q13 PolarHBondContact O-N 3.38Å
14	S	36.4	Very low	35.7	Very low	59 Å²	59	137.6 Å²	137.6	41%	0.413	71%	0.709	S	S	.	*			trans	-150	123.9	173.3	64.5	0	0	0	0	114.7	V11 I16	V11-S14 PolarHBondContact O-N 2.88Å; S14-I16 PolarHBondContact O-N 3.16Å
15	N	37.1	Very low	35.7	Very low	175 Å²	175	138.7 Å²	138.7	94%	0.936	72%	0.717	S	S	*	*	S	Bend	trans	-75.3	36.8	175.1	-69.8	-6.6	0	0	0	113.5
16	I	36.8	Very low	35.5	Very low	118 Å²	118	141.1 Å²	141.1	61%	0.605	73%	0.728	S	S	*	*			trans	-129.4	109.8	-179	-55.6	177.7	0	0	0	108.5	S14 R18	S14-I16 PolarHBondContact O-N 3.16Å; I16-R18 PolarHBondContact O-N 3.27Å
17	P	33.1	Very low	35.3	Very low	103 Å²	103	139.1 Å²	139.1	67%	0.669	73%	0.725	S	S	*	*			trans	-66.8	129.7	175.1	27.7	-33	0	0	0	110.2
18	R	34.3	Very low	34.8	Very low	201 Å²	201	142 Å²	142	76%	0.758	73%	0.729	S	S	*	*			trans	-115.6	118	171.4	-64.8	-168.8	-172.3	-152.4	5.5	109.7	I16 K20	I16-R18 PolarHBondContact O-N 3.27Å; R18-K20 PolarHBondContact O-N 3.08Å
19	F	34.9	Very low	34.7	Very low	147 Å²	147	146 Å²	146	65%	0.645	74%	0.736	S	S	*	*			trans	-78.5	112.4	171.4	-60	-80	0	0	0	109.6	F6	F6-F19 HydrophobicContact CD1-CD1 4.31Å
20	K	35.8	Very low	34.2	Very low	172 Å²	172	147.7 Å²	147.7	75%	0.748	75%	0.746	S	S	*	*			trans	-90.1	118.2	171.2	-171.6	-178.8	-179.5	-173.3	0	108.7	R18 V22	R18-K20 PolarHBondContact O-N 3.08Å; K20-V22 PolarHBondContact O-N 3.18Å; K20-V22 VanDerWaalsContact O-N 3.15Å
21	R	29.3	Very low	33.8	Very low	193 Å²	193	144.8 Å²	144.8	73%	0.728	73%	0.732	S	S	*	*			trans	-70.1	107	171.2	-170.5	-175	-66.4	-171	-4.9	108.4
22	V	34.2	Very low	33.3	Very low	98 Å²	98	149.1 Å²	149.1	59%	0.594	74%	0.743	S	S	*	*			trans	-92.4	130.6	167.4	-177.4	0	0	0	0	107.3	K20 D24	K20-V22 PolarHBondContact O-N 3.18Å; K20-V22 VanDerWaalsContact O-N 3.15Å; V22-D24 WeakPolarHBondContact CG1-OD1 3.38Å
23	M	32.1	Very low	33.1	Very low	151 Å²	151	146.8 Å²	146.8	74%	0.744	73%	0.73	S	S	*	*			trans	-106.1	113.6	163.8	-68	-68.4	-154.9	0	0	105.5	T25	M23-T25 PolarHBondContact O-N 3.27Å
24	D	34.2	Very low	32.7	Very low	146 Å²	146	142 Å²	142	78%	0.781	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-72.6	124.3	172.1	-63.9	-38.2	0	0	0	108.4	V22	V22-D24 WeakPolarHBondContact CG1-OD1 3.38Å
25	T	34.2	Very low	32.5	Very low	135 Å²	135	145.9 Å²	145.9	83%	0.828	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-71.8	138.2	179	43	0	0	0	0	110.7	M23 D27	M23-T25 PolarHBondContact O-N 3.27Å; T25-D27 PolarHBondContact O-N 3.4Å
26	E	28.9	Very low	32.3	Very low	202 Å²	202	144.3 Å²	144.3	94%	0.944	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-62.1	124.1	-174	-59.7	178.2	129.3	0	0	112.4
27	D	30.1	Very low	32.1	Very low	119 Å²	119	146.2 Å²	146.2	64%	0.636	72%	0.723	S	S	*	*			trans	-140.5	112.4	170.1	-145.8	-6.7	0	0	0	111.1	T25	T25-D27 PolarHBondContact O-N 3.4Å
28	K	28.2	Very low	32	Very low	170 Å²	170	144.9 Å²	144.9	74%	0.739	72%	0.716	S	S	*	*			trans	54.1	73.8	160.3	-59.9	160.7	-167.2	107.2	0	118.9
29	I	30.5	Very low	31.9	Very low	171 Å²	171	142.1 Å²	142.1	88%	0.877	72%	0.716	S	S	*	*			trans	-126.6	114.3	143.8	-60.9	-176.6	0	0	0	109.4
30	V	30.3	Very low	31.8	Very low	127 Å²	127	141.9 Å²	141.9	77%	0.77	72%	0.72	S	S	*	*			trans	-76.3	149.5	-175.1	174.6	0	0	0	0	111.8	K32	V30-K32 PolarHBondContact O-N 3.45Å
31	H	28.4	Very low	31.3	Very low	134 Å²	134	139.4 Å²	139.4	62%	0.62	72%	0.72	S	S	*	*			trans	-36.4	120.8	175.5	-70.2	-101.2	0	0	0	114.1	D34	H31-D34 HydrophobicContact CB-CB 4.48Å; H31-D34 IonicContact CE1-OD1 3.59Å; H31-D34 IonicContact CE1-OD2 3.9Å; H31-D34 PolarHBondContact CE1-OD2 3.18Å; H31-D34 IonicContact CG-OD1 2.75Å; H31-D34 IonicContact ND1-OD1 2.68Å; H31-D34 PolarHBondContact ND1-OD1 2.9Å; H31-D34 IonicContact ND1-OD2 2.81Å; H31-D34 PolarHBondContact ND1-OD2 2.99Å
32	K	31.1	Very low	31.3	Very low	188 Å²	188	135.9 Å²	135.9	82%	0.817	72%	0.724	S	S	*	*	S	Bend	trans	-127.8	1.8	166.6	-151.6	170	-175.2	174.6	0	113.3	V30	V30-K32 PolarHBondContact O-N 3.45Å
33	S	33.9	Very low	31.2	Very low	84 Å²	84	136.6 Å²	136.6	59%	0.587	73%	0.734	S	S	*	*	S	Bend	trans	-76.7	-43.1	169.5	28.9	0	0	0	0	112.2	L35 L36	S33-L35 PolarHBondContact O-N 2.95Å; S33-L35 VanDerWaalsContact O-N 3.16Å; S33-L36 PolarHBondContact O-N 3.19Å
34	D	32.9	Very low	30.9	Very low	90 Å²	90	139.7 Å²	139.7	48%	0.481	74%	0.743	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78	-6.3	-162	-53.3	50.4	0	0	0	113.3	H31 L36	H31-D34 HydrophobicContact CB-CB 4.48Å; H31-D34 IonicContact CE1-OD1 3.59Å; H31-D34 IonicContact CE1-OD2 3.9Å; H31-D34 PolarHBondContact CE1-OD2 3.18Å; H31-D34 IonicContact CG-OD1 2.75Å; H31-D34 IonicContact ND1-OD1 2.68Å; H31-D34 PolarHBondContact ND1-OD1 2.9Å; H31-D34 IonicContact ND1-OD2 2.81Å; H31-D34 PolarHBondContact ND1-OD2 2.99Å; D34-L36 VanDerWaalsContact C-N 3.32Å
35	L	33	Very low	30.7	Very low	140 Å²	140	137.1 Å²	137.1	73%	0.733	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	4	175.4	-75.5	169.2	0	0	0	114	S33	S33-L35 PolarHBondContact O-N 2.95Å; S33-L35 VanDerWaalsContact O-N 3.16Å
36	L	32.2	Very low	30.4	Very low	142 Å²	142	141.4 Å²	141.4	74%	0.743	74%	0.738	S	S	*	*	S	Bend	trans	-114.5	-11	177.2	-87.7	164.2	0	0	0	114.7	S33 D34	S33-L36 PolarHBondContact O-N 3.19Å; D34-L36 VanDerWaalsContact C-N 3.32Å
37	E	32.9	Very low	30.4	Very low	158 Å²	158	138.5 Å²	138.5	74%	0.738	73%	0.728	S	S	*	*	S	Bend	trans	-97.8	-7.8	-173.9	-155.4	154.3	-151.7	0	0	113.5	N39	E37-N39 VanDerWaalsContact C-N 3.3Å; E37-N39 PolarHBondContact O-N 3.43Å
38	S	31.4	Very low	30.4	Very low	75 Å²	75	139.9 Å²	139.9	52%	0.524	73%	0.734	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.1	-13.9	178.5	53.5	0	0	0	0	115.3	T41	S38-T41 PolarHBondContact O-OG1 3.34Å
39	N	30.5	Very low	30.5	Very low	143 Å²	143	138.8 Å²	138.8	77%	0.765	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	5.2	-174.6	-78.9	-28.8	0	0	0	114.9	E37	E37-N39 VanDerWaalsContact C-N 3.3Å; E37-N39 PolarHBondContact O-N 3.43Å
40	I	32.8	Very low	30.4	Very low	141 Å²	141	136.7 Å²	136.7	72%	0.723	73%	0.734	S	S	*	*			trans	-125.1	40.2	-177.8	-39.2	-175.5	0	0	0	111.7
41	T	27.2	Very low	30.4	Very low	121 Å²	121	136.6 Å²	136.6	74%	0.742	73%	0.729	S	S	*	*			trans	-112.6	39.2	-178.7	45.9	0	0	0	0	113.2	S38	S38-T41 PolarHBondContact O-OG1 3.34Å
42	S	29.2	Very low	30.4	Very low	118 Å²	118	137.2 Å²	137.2	83%	0.825	73%	0.73	S	S	*	*	S	Bend	trans	-145	54.7	177.9	-161	0	0	0	0	114.9
43	S	31.2	Very low	30.3	Very low	113 Å²	113	135.2 Å²	135.2	79%	0.79	73%	0.728	S	S	*	*			trans	-172.3	53.3	166.5	43.7	0	0	0	0	113.8
44	K	26.3	Very low	30	Very low	216 Å²	216	138.6 Å²	138.6	94%	0.939	74%	0.738	S	S	*	*			trans	-119.1	83.5	179.3	-147.7	176.1	-168.5	176.5	0	112.6
45	S	29.4	Very low	29.8	Very low	93 Å²	93	139.4 Å²	139.4	65%	0.65	75%	0.75	S	S	*	*			trans	-153.7	138.7	164.4	88.1	0	0	0	0	112.3
46	R	27.5	Very low	29.5	Very low	224 Å²	224	142.6 Å²	142.6	85%	0.845	76%	0.758	S	S	*	*			trans	72.7	142.8	168	-49.1	176.1	-151.7	-149.3	3.2	116.8
47	L	29.1	Very low	29.3	Very low	141 Å²	141	139.3 Å²	139.3	74%	0.738	76%	0.758	S	S	*	*			cis	-159.9	130.3	-17.2	-105.4	172	0	0	0	109.6
48	I	31.4	Very low	29	Very low	148 Å²	148	136.6 Å²	136.6	76%	0.759	76%	0.757	S	S	*	*			trans	62.4	144.8	146.5	-65.7	176.2	0	0	0	122
49	N	29.2	Very low	28.9	Very low	147 Å²	147	139.3 Å²	139.3	79%	0.786	77%	0.766	S	S	*	*			trans	-56.3	157.5	-179.8	-54.6	-14.4	0	0	0	117.1
50	P	29	Very low	29	Very low	127 Å²	127	138.6 Å²	138.6	83%	0.825	76%	0.762	S	S	*	*			trans	-93.7	146.1	150.1	36.4	-29.5	0	0	0	112.4
51	D	29.3	Very low	28.7	Very low	126 Å²	126	137.6 Å²	137.6	67%	0.674	76%	0.762	S	S	*	*			trans	-152.8	139.3	164.3	-158.4	14.6	0	0	0	112.4
52	K	28.3	Very low	28.8	Very low	147 Å²	147	138.8 Å²	138.8	64%	0.639	76%	0.764	S	S	*	*			trans	37.8	118.2	165.4	-69.8	160.9	-165.7	80.6	0	122
53	N	29.9	Very low	28.7	Very low	145 Å²	145	141 Å²	141	78%	0.775	76%	0.761	S	S	*	*				163.7	109	114.6	-80.9	-30.4	0	0	0	109.3
54	I	26.8	Very low	28.4	Very low	156 Å²	156	139.9 Å²	139.9	80%	0.8	75%	0.753	S	S	*	*				60.6	87.9	74.2	-52.7	174.9	0	0	0	114.4
55	S	29.6	Very low	28.2	Very low	106 Å²	106	137 Å²	137	74%	0.741	75%	0.747	S	S	*	*				-170.5	120.3	123.8	75.1	0	0	0	0	107.7
56	K	26.3	Very low	28.1	Very low	208 Å²	208	139.3 Å²	139.3	90%	0.904	75%	0.751	S	S	*	*				67.6	131.2	90.9	-78.8	-169.4	173.4	-175.9	0	115.1
57	G	28.4	Very low	28.1	Very low	72 Å²	72	136.3 Å²	136.3	74%	0.742	75%	0.747	S	S	*	*			trans	101.1	123.8	171.1	0	0	0	0	0	113
58	S	27	Very low	27.9	Very low	102 Å²	102	136.1 Å²	136.1	71%	0.713	75%	0.746	S	S	*	*			cis	157.5	146.3	-25.1	48.2	0	0	0	0	105.9
59	N	29.6	Very low	27.6	Very low	131 Å²	131	135.2 Å²	135.2	70%	0.701	74%	0.743	S	S	*	*			trans	82.8	127.7	162.4	-71.2	44	0	0	0	119.6
60	D	30.7	Very low	27.4	Very low	129 Å²	129	133 Å²	133	69%	0.69	74%	0.739	S	S	*	*			trans	61.8	110.6	135.8	-45	-25.6	0	0	0	118.6
61	V	27.6	Very low	27.5	Very low	119 Å²	119	134.1 Å²	134.1	72%	0.721	74%	0.738	S	S	*	*				91.9	136.6	52.1	168.5	0	0	0	0	112
62	N	28.8	Very low	27.4	Very low	146 Å²	146	135.6 Å²	135.6	78%	0.781	74%	0.741	S	S	*	*			trans	71.1	158	-173.8	-53.2	-22.9	0	0	0	115.9
63	E	26.5	Very low	27.5	Very low	166 Å²	166	134.7 Å²	134.7	78%	0.776	75%	0.75	S	S	*	*			cis	-163.7	161.7	-47.2	-158.1	171.5	-169.3	0	0	106.9
64	S	25	Very low	27.3	Very low	89 Å²	89	135.7 Å²	135.7	62%	0.622	75%	0.75	S	S	*	*			trans	56.5	117.5	153.9	63	0	0	0	0	121.3
65	I	23.7	Very low	27.2	Very low	156 Å²	156	134.9 Å²	134.9	80%	0.8	76%	0.756	S	S	*	*			trans	55.9	107.9	134.7	-41.6	161.1	0	0	0	118.4
66	L	26.6	Very low	27	Very low	141 Å²	141	132.7 Å²	132.7	74%	0.738	75%	0.751	S	S	*	*				-164.7	137.3	122.7	-129.6	74.6	0	0	0	114.1
67	Q	28.3	Very low	27.2	Very low	161 Å²	161	133.2 Å²	133.2	75%	0.752	75%	0.753	S	S	*	*			trans	39	114.2	137.6	-77.1	170.5	-11.3	0	0	123.3
68	D	24.2	Very low	27.2	Very low	136 Å²	136	136.7 Å²	136.7	73%	0.727	76%	0.755	S	S	*	*				72.7	133.6	109.6	-106.3	25.1	0	0	0	124.5
69	N	25	Very low	27.2	Very low	130 Å²	130	141 Å²	141	70%	0.695	76%	0.761	S	S	*	*			trans	82.7	142.1	142.3	-67.8	-40.8	0	0	0	124.5
70	S	25.9	Very low	27.1	Very low	99 Å²	99	140 Å²	140	69%	0.692	76%	0.764	S	S	*	*			trans	72.6	119.7	156.4	82.5	0	0	0	0	116.3
71	N	30.3	Very low	27.1	Very low	151 Å²	151	143.6 Å²	143.6	81%	0.807	77%	0.773	S	S	*	*			cis	-162.1	158.1	36.7	-77.9	-68.8	0	0	0	112.5
72	Q	26.2	Very low	26.9	Very low	157 Å²	157	145.3 Å²	145.3	73%	0.734	78%	0.777	S	S	*	*			trans	-91.3	173.7	160.3	-67.7	-173.5	-17.8	0	0	110.7
73	P	30.8	Very low	26.9	Very low	128 Å²	128	143.9 Å²	143.9	83%	0.831	78%	0.776	S	S	*	*				-140.2	164.5	99.7	36.2	-22.5	0	0	0	116.5
74	H	25.4	Very low	26.9	Very low	167 Å²	167	140.2 Å²	140.2	77%	0.773	77%	0.773	S	S	*	*			trans	-59.7	147	-174.4	-67.3	-106.6	0	0	0	117.2
75	C	25.9	Very low	27.2	Very low	138 Å²	138	143.8 Å²	143.8	93%	0.932	78%	0.784	S	S	*	*				-176.9	141.7	121.5	-104.6	0	0	0	0	111.3
76	G	25	Very low	27.3	Very low	61 Å²	61	143.5 Å²	143.5	63%	0.629	78%	0.784	S	S	*	*			cis	140.1	56.4	-11	0	0	0	0	0	116.8
77	F	29.9	Very low	27.5	Very low	219 Å²	219	142.4 Å²	142.4	96%	0.961	78%	0.779	S	S	*	*			trans	-144.9	166.7	168.6	-107.7	-78	0	0	0	114.5
78	N	29.3	Very low	27.5	Very low	145 Å²	145	142.1 Å²	142.1	78%	0.775	78%	0.775	S	S	*	*			trans	-113.8	164.4	-149.1	-107.6	-52.1	0	0	0	117.3
79	K	25.7	Very low	27.9	Very low	192 Å²	192	142.2 Å²	142.2	84%	0.835	78%	0.781	S	S	*	*			trans	-48.7	149.3	175.3	-53.7	161.1	-179.4	171	0	114.5
80	S	28.8	Very low	28.1	Very low	110 Å²	110	141.3 Å²	141.3	77%	0.769	78%	0.78	S	S	*	*				-165.4	141.5	124.9	61.3	0	0	0	0	116.1
81	K	30.2	Very low	28.1	Very low	205 Å²	205	145.3 Å²	145.3	89%	0.891	79%	0.785	S	S	*	*			trans	60.9	143.3	148.9	-69	178.3	177.9	179.2	0	123
82	I	24.2	Very low	28.2	Very low	154 Å²	154	144.9 Å²	144.9	79%	0.79	78%	0.783	S	S	*	*			trans	-117.1	149	173.7	-49.2	160.3	0	0	0	106.9
83	P	28.5	Very low	28.3	Very low	117 Å²	117	144.5 Å²	144.5	76%	0.76	78%	0.784	S	S	*	*				-129.8	137.8	111.3	7.7	14	0	0	0	110.7
84	A	25.7	Very low	28.2	Very low	88 Å²	88	144.9 Å²	144.9	73%	0.727	78%	0.778	S	S	*	*				68.6	95.1	61.2	0	0	0	0	0	113.2
85	I	31.2	Very low	28.2	Very low	164 Å²	164	143.8 Å²	143.8	84%	0.841	78%	0.778	S	S	*	*			trans	-131.2	115.3	163.5	-62.1	179.7	0	0	0	108
86	N	25.9	Very low	28.3	Very low	151 Å²	151	146.6 Å²	146.6	81%	0.807	78%	0.777	S	S	*	*			trans	-98.8	133.8	157.8	-68.2	-30	0	0	0	107.1
87	D	30.9	Very low	28.2	Very low	117 Å²	117	154.8 Å²	154.8	63%	0.626	79%	0.789	S	S	*	*				-175.9	136.5	117.3	-105.6	-5	0	0	0	116.8
88	K	27.8	Very low	28	Very low	155 Å²	155	149 Å²	149	67%	0.674	78%	0.776	S	S	*	*			trans	36.6	98	136	-56.1	173.9	-172.8	80.1	0	119.7
89	T	33.6	Very low	28.1	Very low	138 Å²	138	150.3 Å²	150.3	85%	0.847	78%	0.777	S	S	*	*			trans	-169.4	88.7	131.2	10.7	0	0	0	0	107.9
90	T	28.8	Very low	28	Very low	111 Å²	111	145.7 Å²	145.7	68%	0.681	77%	0.769	S	S	*	*				58.7	83.3	67.3	-45.4	0	0	0	0	110.2
91	K	26.9	Very low	27.7	Very low	184 Å²	184	148.5 Å²	148.5	80%	0.8	77%	0.768	S	S	*	*				80.2	154.1	94.3	-91	-169	173.6	-174	0	113.9
92	N	31.7	Very low	27.6	Very low	142 Å²	142	145.8 Å²	145.8	76%	0.759	76%	0.762	S	S	*	*			trans	75.1	138.9	-173.5	-38.4	-18	0	0	0	110.4
93	I	29.1	Very low	27.6	Very low	148 Å²	148	144 Å²	144	76%	0.759	75%	0.753	S	S	*	*			cis	-140.8	140.2	0	-63.2	-178.4	0	0	0	105.2
94	I	27.2	Very low	27.7	Very low	137 Å²	137	147.4 Å²	147.4	70%	0.703	76%	0.759	S	S	*	*			cis	85.8	85.8	16.6	-48.3	-177.9	0	0	0	115.1
95	D	25.9	Very low	27.7	Very low	144 Å²	144	151.1 Å²	151.1	77%	0.77	76%	0.761	S	S	*	*			trans	66.3	159.2	177.4	-55.6	-38.2	0	0	0	114.1
96	E	28.8	Very low	27.5	Very low	196 Å²	196	149 Å²	149	92%	0.916	76%	0.756	S	S	*	*			cis	-135.2	-167.5	26.3	-70.8	-170.3	108.3	0	0	115.1
97	R	22.9	Very low	27.6	Very low	233 Å²	233	148 Å²	148	88%	0.879	76%	0.755	S	S	*	*			trans	-137.8	148.2	-174.5	-178.8	-176.8	-173.4	174.9	2.1	109.6
98	S	24.8	Very low	27.3	Very low	99 Å²	99	151 Å²	151	69%	0.692	77%	0.766	S	S	*	*			trans	89.1	-179.3	172.8	86.6	0	0	0	0	117.4
99	H	30.5	Very low	27.3	Very low	171 Å²	171	152.7 Å²	152.7	79%	0.792	78%	0.776	S	S	*	*			trans	68.5	120.1	-162	-61.3	-73.7	0	0	0	115
100	S	25.2	Very low	26.7	Very low	95 Å²	95	151 Å²	151	66%	0.664	77%	0.77	S	S	*	*			cis	86.2	103	38	79.8	0	0	0	0	112.8
101	F	22.7	Very low	26.7	Very low	170 Å²	170	153.3 Å²	153.3	75%	0.746	78%	0.776	S	S	*	*				102.2	162	83.3	-170.7	-93	0	0	0	110.6	I103	F101-I103 HydrophobicContact CE1-CD1 3.75Å; F101-I103 HydrophobicContact CE2-CD1 4.32Å; F101-I103 HydrophobicContact CZ-CD1 3.57Å
102	L	26.9	Very low	26.5	Very low	147 Å²	147	151.1 Å²	151.1	77%	0.77	77%	0.772	S	S	*	*			trans	80.1	126.3	-161	-53.1	170.6	0	0	0	112.4
103	I	24.3	Very low	26.2	Very low	116 Å²	116	149.5 Å²	149.5	60%	0.595	77%	0.772	S	S	*	*			cis	93.8	100.2	21	-54.5	173.8	0	0	0	114.9	F101	F101-I103 HydrophobicContact CE1-CD1 3.75Å; F101-I103 HydrophobicContact CE2-CD1 4.32Å; F101-I103 HydrophobicContact CZ-CD1 3.57Å
104	E	30.5	Very low	26.2	Very low	189 Å²	189	147.4 Å²	147.4	88%	0.883	77%	0.768	S	S	*	*			trans	-151	128.2	148.3	-97.9	179.1	149.8	0	0	103.2
105	Q	26.6	Very low	26.1	Very low	166 Å²	166	149.4 Å²	149.4	78%	0.776	77%	0.774	S	S	*	*			cis	53	116.7	38	-72.9	-167.2	-16.6	0	0	111.5
106	T	27	Very low	26.1	Very low	121 Å²	121	151.7 Å²	151.7	74%	0.742	78%	0.777	S	S	*	*			cis	-143.2	-174.3	24.1	55.5	0	0	0	0	110.9
107	T	27.9	Very low	26	Very low	128 Å²	128	150.1 Å²	150.1	79%	0.785	77%	0.77	S	S	*	*			cis	-154.2	153.7	9.8	-23.2	0	0	0	0	109.8
108	E	23.1	Very low	26.4	Very low	182 Å²	182	146.4 Å²	146.4	85%	0.85	77%	0.767	S	S	*	*			trans	-84.8	152	168.3	-58.8	173.4	120.4	0	0	111.7
109	Q	28.4	Very low	26.4	Very low	189 Å²	189	145.5 Å²	145.5	88%	0.883	76%	0.761	S	S	*	*			trans	-157.2	112.5	145.7	-119.5	171.2	26.9	0	0	113
110	S	22.4	Very low	26.4	Very low	104 Å²	104	145.3 Å²	145.3	73%	0.727	77%	0.766	S	S	*	*			trans	-100.6	134.6	169.2	56.8	0	0	0	0	110.5
111	I	27.5	Very low	26.4	Very low	158 Å²	158	147.5 Å²	147.5	81%	0.81	77%	0.77	S	S	*	*			trans	-130.2	146.5	169.5	-61.8	-176.8	0	0	0	109.4
112	I	23.4	Very low	26.8	Very low	138 Å²	138	148.3 Å²	148.3	71%	0.708	78%	0.776	S	S	*	*			trans	-136	141.6	-163.3	-70.9	169.9	0	0	0	109.6
113	S	24.6	Very low	26.8	Very low	109 Å²	109	148 Å²	148	76%	0.762	77%	0.774	S	S	*	*			trans	66.7	172.5	161.9	-77.4	0	0	0	0	118.3
114	P	29.8	Very low	26.9	Very low	103 Å²	103	147.9 Å²	147.9	67%	0.669	78%	0.782	S	S	*	*			cis	-136.3	178.8	-34.9	34.5	-16.6	0	0	0	114.8
115	E	23.9	Very low	26.9	Very low	180 Å²	180	144.8 Å²	144.8	84%	0.841	78%	0.776	S	S	*	*			trans	26.5	131	148	-65.2	-177.8	118.2	0	0	122.6
116	K	27.6	Very low	26.9	Very low	191 Å²	191	142.7 Å²	142.7	83%	0.83	78%	0.777	S	S	*	*				-165.5	151.7	107.5	-108.1	166.3	-178.2	175.9	0	114.7
117	H	26.1	Very low	27.1	Very low	163 Å²	163	145.4 Å²	145.4	76%	0.755	79%	0.786	S	S	*	*			trans	11.3	138	147.6	-75.3	-110.1	0	0	0	118.5
118	D	30.6	Very low	27.2	Very low	156 Å²	156	150.5 Å²	150.5	83%	0.834	79%	0.791	S	S	*	*				-147.2	169	68.2	-126.9	-25.1	0	0	0	117.9
119	S	25.2	Very low	27.6	Very low	80 Å²	80	147.9 Å²	147.9	56%	0.559	79%	0.79	S	S	*	*			trans	-111.5	150.3	-173.2	61.2	0	0	0	0	114.4
120	N	31	Very low	27.9	Very low	167 Å²	167	147 Å²	147	89%	0.893	79%	0.789	S	S	*	*			trans	-155.1	156.3	150.5	-100.3	-45.1	0	0	0	112.2
121	N	25.9	Very low	28.2	Very low	140 Å²	140	151.8 Å²	151.8	75%	0.749	80%	0.797	S	S	*	*			trans	-114.6	142.9	-169.2	-61.9	-73.2	0	0	0	113
122	E	31.3	Very low	28.2	Very low	188 Å²	188	147.8 Å²	147.8	88%	0.879	80%	0.795	S	S	*	*			trans	-178	110.6	144	-104	167.6	-173	0	0	107.6
123	I	26.5	Very low	28.5	Very low	139 Å²	139	152.9 Å²	152.9	71%	0.713	81%	0.805	S	S	*	*				83.2	98.5	61.2	-64.3	172.6	0	0	0	113.9
124	C	25.5	Very low	28.6	Very low	114 Å²	114	159.3 Å²	159.3	77%	0.77	81%	0.813	S	S	*	*			trans	63.6	152.7	150.7	-68.2	0	0	0	0	119.5
125	T	30.2	Very low	28.9	Very low	125 Å²	125	160.2 Å²	160.2	77%	0.767	82%	0.816	S	S	*	*			cis	-158.8	152.4	5	-0.8	0	0	0	0	110.7
126	P	27.1	Very low	29.1	Very low	121 Å²	121	159.8 Å²	159.8	79%	0.786	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-89.3	155.9	164.8	34.9	-33.4	0	0	0	113.4
127	L	31.6	Very low	29.3	Very low	179 Å²	179	157.3 Å²	157.3	94%	0.937	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-77.5	153.3	-173	-71.1	162	0	0	0	114.6
128	R	30.4	Very low	29.6	Very low	234 Å²	234	158.4 Å²	158.4	88%	0.883	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-102	145.3	173.9	-68	179.9	178.1	167.4	0.5	112.3
129	P	30.4	Very low	29.5	Very low	128 Å²	128	157.4 Å²	157.4	83%	0.831	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-77.3	154.7	163.8	32.8	-34	0	0	0	112.4
130	I	35.4	Very low	30.1	Very low	170 Å²	170	163.2 Å²	163.2	87%	0.872	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-89.1	145	-171.3	-66.6	171.6	0	0	0	112.3
131	K	28.6	Very low	30.1	Very low	205 Å²	205	161.7 Å²	161.7	89%	0.891	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-88.2	125	174.1	-90.6	-178.2	174.9	175.2	0	112.9
132	G	27.8	Very low	30.6	Very low	74 Å²	74	160.7 Å²	160.7	76%	0.763	82%	0.82	S	S	*	*				93.9	138.3	120.1	0	0	0	0	0	119.8
133	R	28.8	Very low	30.5	Very low	245 Å²	245	158.9 Å²	158.9	93%	0.925	82%	0.816	S	S	*	*			trans	-147.1	143.7	138.7	-115.4	175.7	-173.5	170.7	3.3	109.9
134	R	26.7	Very low	30.9	Very low	244 Å²	244	159.3 Å²	159.3	92%	0.921	83%	0.825	S	S	*	*			trans	-141.4	119.8	172.9	-168.8	-173.8	-161.6	-179.3	6.1	105.6
135	T	36.1	Very low	31.2	Very low	121 Å²	121	158.8 Å²	158.8	74%	0.742	82%	0.823	S	S	*	*			trans	-116.7	143.1	-178.7	41	0	0	0	0	110.3
136	H	29	Very low	31.5	Very low	171 Å²	171	160.6 Å²	160.6	79%	0.792	83%	0.828	S	S	*	*			trans	-66.3	171.5	168.5	-69.8	-124.8	0	0	0	108.5
137	L	30.3	Very low	31.7	Very low	140 Å²	140	163.9 Å²	163.9	73%	0.733	83%	0.832	S	S	*	*				-175.8	175.5	63.7	-163.7	57.1	0	0	0	112.3
138	F	32.9	Very low	31.9	Very low	185 Å²	185	161.3 Å²	161.3	81%	0.811	83%	0.829	S	S	*	*			trans	83.5	105.7	167.2	-80.8	-72.4	0	0	0	120.2
139	N	29.3	Very low	31.9	Very low	136 Å²	136	159.3 Å²	159.3	73%	0.727	83%	0.827	S	S	*	*			trans	-69.2	161.9	151.5	-56.1	-31.1	0	0	0	110.3
140	Q	37.5	Very low	32.2	Very low	201 Å²	201	162 Å²	162	94%	0.939	83%	0.828	S	S	*	*				-143.3	156.6	125.4	-120.3	174.4	5.8	0	0	110.5
141	I	30.4	Very low	31.9	Very low	135 Å²	135	160.7 Å²	160.7	69%	0.692	82%	0.823	S	S	*	*			trans	-127	137.3	-167.8	-63.7	165.8	0	0	0	108.3
142	S	36.4	Very low	32.3	Very low	120 Å²	120	157.6 Å²	157.6	84%	0.839	82%	0.817	S	S	*	*			trans	-157.4	127	153	33.6	0	0	0	0	110.3
143	N	29.1	Very low	32.7	Very low	149 Å²	149	159.9 Å²	159.9	80%	0.797	81%	0.811	S	S	*	*			trans	-102.3	139.2	169.2	-61.1	-34.7	0	0	0	108.3
144	T	35.3	Very low	32.8	Very low	149 Å²	149	155.8 Å²	155.8	91%	0.914	81%	0.806	S	S	*	*			trans	-146.4	135.3	139.9	33.6	0	0	0	0	109.1
145	S	32.6	Very low	33.2	Very low	102 Å²	102	149.5 Å²	149.5	71%	0.713	80%	0.799	S	S	*	*			trans	-88.1	152.9	161.5	50.1	0	0	0	0	109.2
146	D	35.7	Very low	33.1	Very low	164 Å²	164	150.5 Å²	150.5	88%	0.877	80%	0.799	S	S	*	*			trans	-162.7	158.5	130.2	-106.9	-28.3	0	0	0	113.6
147	H	31.4	Very low	33.1	Very low	189 Å²	189	152.7 Å²	152.7	88%	0.875	81%	0.806	S	S	*	*			trans	-97.6	135.9	178.9	-80.8	-80	0	0	0	112
148	S	35.8	Very low	33.5	Very low	125 Å²	125	154.4 Å²	154.4	87%	0.874	81%	0.81	S	S	*	*			trans	-153.8	155	145.2	49.8	0	0	0	0	111.6
149	K	31.3	Very low	33.5	Very low	192 Å²	192	154.9 Å²	154.9	84%	0.835	81%	0.812	S	S	*	*			trans	-102.4	147	173.3	-56	164.3	-176.8	167.3	0	108
150	Q	35.8	Very low	34.2	Very low	184 Å²	184	154 Å²	154	86%	0.86	81%	0.814	S	S	*	*				-163	157	118.9	-150.6	79.8	-11.4	0	0	108.1
151	N	28.9	Very low	34.4	Very low	143 Å²	143	149.5 Å²	149.5	77%	0.765	80%	0.802	S	S	*	*			trans	-79	154.9	162.8	-60.3	-44.7	0	0	0	109
152	D	36.2	Very low	35.1	Very low	141 Å²	141	149.2 Å²	149.2	75%	0.754	80%	0.802	S	S	*	*				-163.4	132.3	114.3	-101.7	-19.5	0	0	0	115.3
153	N	36.3	Very low	35.9	Very low	121 Å²	121	150.1 Å²	150.1	65%	0.647	80%	0.797	S	S	*	*			trans	46.5	113.4	141	-55.9	-40.5	0	0	0	122.9
154	I	32.9	Very low	36.9	Very low	160 Å²	160	151.9 Å²	151.9	82%	0.821	80%	0.797	S	S	*	*			trans	63	98.3	131.4	-51	168.5	0	0	0	117.4
155	S	33.2	Very low	37.7	Very low	111 Å²	111	148.7 Å²	148.7	78%	0.776	78%	0.78	S	S	*	*			trans	-151.8	123.9	137.4	46	0	0	0	0	113.9
156	I	34.6	Very low	39.1	Very low	142 Å²	142	151.9 Å²	151.9	73%	0.728	78%	0.781	S	S	*	*			trans	45	101.9	149.6	-47.4	176.5	0	0	0	118.1	Q158	I156-Q158 HydrophobicContact CG2-CG 4.01Å; I156-Q158 PolarHBondContact O-N 3.49Å
157	K	29.7	Very low	40.3	Very low	218 Å²	218	150.9 Å²	150.9	95%	0.948	77%	0.769	S	S	*	*			trans	-66	91.2	164	-75.2	-179.7	176.9	172.7	0	111.9
158	Q	37.7	Very low	42.2	Very low	175 Å²	175	148.6 Å²	148.6	82%	0.818	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-77.3	129.6	167	-66.7	-164	3.7	0	0	111.7	I156	I156-Q158 HydrophobicContact CG2-CG 4.01Å; I156-Q158 PolarHBondContact O-N 3.49Å
159	K	32.8	Very low	43.9	Very low	195 Å²	195	150.3 Å²	150.3	85%	0.848	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-90.8	119.5	-176.7	-170.2	178.1	-175.6	178.3	0	109.5	P161	K159-P161 WeakPolarHBondContact O-CD 3.49Å
160	P	45.6	Very low	45.8	Very low	119 Å²	119	149.3 Å²	149.3	77%	0.773	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-71	122.8	-168.5	26.2	-34.6	0	0	0	113
161	P	40.3	Very low	47.4	Very low	106 Å²	106	148.6 Å²	148.6	69%	0.688	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-87.6	131.3	-175.3	32	-33.5	0	0	0	114.4	K159 L163	K159-P161 WeakPolarHBondContact O-CD 3.49Å; P161-L163 PolarHBondContact O-N 3Å
162	N	45.4	Very low	49.6	Very low	129 Å²	129	145.3 Å²	145.3	69%	0.69	72%	0.716	S	S	*	*			trans	52.9	50.8	149.8	-71.8	-33.7	0	0	0	119.5	K164 C165	N162-K164 VanDerWaalsContact C-N 3.26Å; N162-K164 PolarHBondContact O-N 3.24Å; N162-C165 HydrophobicContact CB-CB 4.47Å; N162-C165 PolarHBondContact O-N 3.46Å
163	L	52.8	Low	51.5	Low	139 Å²	139	146.3 Å²	146.3	73%	0.728	71%	0.714	S	S	*	*	H	α-helix	trans	-58.2	-31.4	172.6	-127	75.4	0	0	0	114.5	P161 C165	P161-L163 PolarHBondContact O-N 3Å; L163-C165 PolarHBondContact O-N 3.04Å
164	K	50.7	Low	53	Low	186 Å²	186	144.4 Å²	144.4	81%	0.809	71%	0.71	S	S	*	*	H	α-helix	trans	-62.1	-41.1	178.7	-71.6	-173.9	178.2	-179.4	0	112.4	N162 K166 K167 F168	N162-K164 VanDerWaalsContact C-N 3.26Å; N162-K164 PolarHBondContact O-N 3.24Å; K164-K166 PolarHBondContact O-N 3.37Å; K164-K167 PolarHBondContact O-N 3.28Å; K164-F168 PolarHBondContact O-N 3.38Å; K164-F168 VanDerWaalsContact O-N 3.13Å
165	C	52.2	Low	55	Low	82 Å²	82	142.1 Å²	142.1	55%	0.554	70%	0.695	S	S	*	*	H	α-helix	trans	-67.5	-36.4	-175.8	-164.9	0	0	0	0	112.4	N162 L163 K167 F168 K169	N162-C165 HydrophobicContact CB-CB 4.47Å; N162-C165 PolarHBondContact O-N 3.46Å; L163-C165 PolarHBondContact O-N 3.04Å; C165-K167 PolarHBondContact O-N 3.34Å; C165-F168 PolarHBondContact O-N 3.11Å; C165-K169 PolarHBondContact O-N 3.27Å
166	K	61.6	Low	57	Low	169 Å²	169	141.6 Å²	141.6	74%	0.735	68%	0.682	S	S	*	*	H	α-helix	trans	-63.6	-37.3	174.8	-74	-172.9	176.9	-179.6	0	112.4	K164 K170	K164-K166 PolarHBondContact O-N 3.37Å; K166-K170 PolarHBondContact O-N 3.11Å
167	K	60.5	Low	58.7	Low	143 Å²	143	137.8 Å²	137.8	62%	0.622	67%	0.672	S	S	*	*	H	α-helix	trans	-66	-49	173.6	-72.1	-168.3	176.3	-172.8	0	111.4	K164 C165 K169 K170 Y171	K164-K167 PolarHBondContact O-N 3.28Å; C165-K167 PolarHBondContact O-N 3.34Å; K167-K169 PolarHBondContact O-N 2.6Å; K167-K170 WeakPolarHBondContact O-CB 3.18Å; K167-K170 PolarHBondContact O-N 3.13Å; K167-K170 VanDerWaalsContact O-N 3.07Å; K167-Y171 HydrophobicContact CB-CE2 4.43Å; K167-Y171 VanDerWaalsContact O-CD2 3.23Å; K167-Y171 WeakPolarHBondContact O-CD2 3.39Å; K167-Y171 PolarHBondContact O-N 3.46Å
168	F	71.7	Confident	60.7	Low	141 Å²	141	130.9 Å²	130.9	62%	0.618	64%	0.642	S	S	*	*	H	α-helix	trans	-57.3	-46.6	179.1	-175.5	-102.2	0	0	0	112.5	K164 C165 K170 Y171 L172	K164-F168 PolarHBondContact O-N 3.38Å; K164-F168 VanDerWaalsContact O-N 3.13Å; C165-F168 PolarHBondContact O-N 3.11Å; F168-K170 PolarHBondContact O-N 3.48Å; F168-Y171 PolarHBondContact O-N 2.92Å; F168-L172 HydrophobicContact CE1-CD2 4.32Å; F168-L172 WeakPolarHBondContact O-CB 3.31Å; F168-L172 PolarHBondContact O-N 3.48Å
169	K	71.4	Confident	62.3	Low	161 Å²	161	125.5 Å²	125.5	70%	0.7	62%	0.619	S	S	*	*	H	α-helix	trans	-61.9	-29.5	177.3	-166.4	168.7	-175.6	173	0	113	C165 K167 K173	C165-K169 PolarHBondContact O-N 3.27Å; K167-K169 PolarHBondContact O-N 2.6Å; K169-K173 PolarHBondContact O-N 3.48Å
170	K	71	Confident	64.3	Low	170 Å²	170	124.6 Å²	124.6	74%	0.739	62%	0.615	S	S	*	*	H	α-helix	trans	-73.9	-44.3	175.5	-140.9	179.6	-173.5	-173.8	0	111.8	K166 K167 F168 K173 S174	K166-K170 PolarHBondContact O-N 3.11Å; K167-K170 WeakPolarHBondContact O-CB 3.18Å; K167-K170 PolarHBondContact O-N 3.13Å; K167-K170 VanDerWaalsContact O-N 3.07Å; F168-K170 PolarHBondContact O-N 3.48Å; K170-K173 PolarHBondContact O-N 3.25Å; K170-S174 WeakPolarHBondContact O-CB 3.4Å; K170-S174 PolarHBondContact O-N 3.18Å
171	Y	70.9	Confident	65.8	Low	169 Å²	169	122.5 Å²	122.5	66%	0.663	60%	0.603	S	S	*	*	H	α-helix	trans	-61.8	-43	171.9	-73.5	-68.1	0	0	0	111.8	K167 F168 S174 F175	K167-Y171 HydrophobicContact CB-CE2 4.43Å; K167-Y171 VanDerWaalsContact O-CD2 3.23Å; K167-Y171 WeakPolarHBondContact O-CD2 3.39Å; K167-Y171 PolarHBondContact O-N 3.46Å; F168-Y171 PolarHBondContact O-N 2.92Å; Y171-S174 WeakPolarHBondContact O-CB 3.18Å; Y171-S174 PolarHBondContact O-N 3.28Å; Y171-F175 VanDerWaalsContact O-CB 3.31Å; Y171-F175 WeakPolarHBondContact O-CB 3.44Å; Y171-F175 PolarHBondContact O-N 2.81Å
172	L	74.3	Confident	67.7	Low	74 Å²	74	119 Å²	119	39%	0.387	58%	0.578	S	S	.	*	H	α-helix	trans	-62.5	-44.2	177.8	-176	62	0	0	0	112.2	F168 S174 F175 I176	F168-L172 HydrophobicContact CE1-CD2 4.32Å; F168-L172 WeakPolarHBondContact O-CB 3.31Å; F168-L172 PolarHBondContact O-N 3.48Å; L172-S174 VanDerWaalsContact C-N 3.34Å; L172-S174 PolarHBondContact O-N 3.48Å; L172-F175 PolarHBondContact O-N 3.32Å; L172-I176 HydrophobicContact CD1-CD1 4.06Å; L172-I176 HydrophobicContact CD1-CG1 4.33Å; L172-I176 HydrophobicContact CG-CD1 3.92Å; L172-I176 VanDerWaalsContact O-CG1 3.3Å; L172-I176 WeakPolarHBondContact O-CG1 3.39Å; L172-I176 PolarHBondContact O-N 3.01Å
173	K	76.4	Confident	69.6	Low	163 Å²	163	116.7 Å²	116.7	71%	0.709	57%	0.565	S	S	*	*	H	α-helix	trans	-62.5	-41.1	173.8	-174.4	174.7	-179.7	178.7	0	111.8	K169 K170 F175 I176 A177	K169-K173 PolarHBondContact O-N 3.48Å; K170-K173 PolarHBondContact O-N 3.25Å; K173-F175 VanDerWaalsContact C-N 3.34Å; K173-I176 PolarHBondContact O-N 3.13Å; K173-A177 WeakPolarHBondContact O-CB 3.5Å; K173-A177 PolarHBondContact O-N 3Å
174	S	67.8	Low	71.2	Confident	81 Å²	81	111.4 Å²	111.4	57%	0.566	54%	0.543	S	S	*	.	H	α-helix	trans	-64.3	-39.5	176.5	-162.4	0	0	0	0	112	K170 Y171 L172 F178	K170-S174 WeakPolarHBondContact O-CB 3.4Å; K170-S174 PolarHBondContact O-N 3.18Å; Y171-S174 WeakPolarHBondContact O-CB 3.18Å; Y171-S174 PolarHBondContact O-N 3.28Å; L172-S174 VanDerWaalsContact C-N 3.34Å; L172-S174 PolarHBondContact O-N 3.48Å; S174-F178 WeakPolarHBondContact O-CB 3.15Å; S174-F178 PolarHBondContact O-N 2.96Å
175	F	74.8	Confident	73.1	Confident	111 Å²	111	103.9 Å²	103.9	49%	0.487	51%	0.512	S	S	.	.	H	α-helix	trans	-69	-42	177.9	-176.8	-114.5	0	0	0	111.6	Y171 L172 K173 F178 L179	Y171-F175 VanDerWaalsContact O-CB 3.31Å; Y171-F175 WeakPolarHBondContact O-CB 3.44Å; Y171-F175 PolarHBondContact O-N 2.81Å; L172-F175 PolarHBondContact O-N 3.32Å; K173-F175 VanDerWaalsContact C-N 3.34Å; F175-F178 PolarHBondContact O-N 3.44Å; F175-L179 HydrophobicContact CD1-CD1 3.83Å; F175-L179 HydrophobicContact CD1-CG 4.34Å; F175-L179 HydrophobicContact CD2-CG 4.49Å; F175-L179 HydrophobicContact CE1-CD1 3.5Å; F175-L179 HydrophobicContact CE1-CG 4.12Å; F175-L179 HydrophobicContact CE2-CD2 4.29Å; F175-L179 HydrophobicContact CE2-CG 4.26Å; F175-L179 HydrophobicContact CG-CD1 4.48Å; F175-L179 HydrophobicContact CZ-CD1 3.88Å; F175-L179 HydrophobicContact CZ-CD2 4.07Å; F175-L179 HydrophobicContact CZ-CG 4.07Å; F175-L179 WeakPolarHBondContact O-CB 3.49Å; F175-L179 VanDerWaalsContact O-CG 3.26Å; F175-L179 WeakPolarHBondContact O-CG 3.49Å; F175-L179 PolarHBondContact O-N 3.35Å
176	I	74.5	Confident	74.9	Confident	100 Å²	100	102.1 Å²	102.1	51%	0.513	50%	0.5	S	S	.	.	H	α-helix	trans	-64.4	-43.2	175.4	-68.6	165.5	0	0	0	111.3	L172 K173 L179 F180	L172-I176 HydrophobicContact CD1-CD1 4.06Å; L172-I176 HydrophobicContact CD1-CG1 4.33Å; L172-I176 HydrophobicContact CG-CD1 3.92Å; L172-I176 VanDerWaalsContact O-CG1 3.3Å; L172-I176 WeakPolarHBondContact O-CG1 3.39Å; L172-I176 PolarHBondContact O-N 3.01Å; K173-I176 PolarHBondContact O-N 3.13Å; I176-L179 PolarHBondContact O-N 2.85Å; I176-F180 WeakPolarHBondContact O-CB 3.38Å; I176-F180 PolarHBondContact O-N 3.04Å
177	A	71.8	Confident	76.3	Confident	63 Å²	63	99.4 Å²	99.4	52%	0.521	49%	0.493	S	S	.	.	H	α-helix	trans	-65	-40.1	176	0	0	0	0	0	112.2	K173 F180 S181	K173-A177 WeakPolarHBondContact O-CB 3.5Å; K173-A177 PolarHBondContact O-N 3Å; A177-F180 PolarHBondContact O-N 3.45Å; A177-S181 PolarHBondContact O-N 3.37Å
178	F	70.5	Confident	77.9	Confident	72 Å²	72	96.5 Å²	96.5	32%	0.316	49%	0.487	S	S	.	.	H	α-helix	trans	-62.9	-48.7	174	-178.9	-89.3	0	0	0	111.7	S174 F175 F180 S181 H182 F508	S174-F178 WeakPolarHBondContact O-CB 3.15Å; S174-F178 PolarHBondContact O-N 2.96Å; F175-F178 PolarHBondContact O-N 3.44Å; F178-F180 VanDerWaalsContact C-N 3.34Å; F178-F180 PolarHBondContact O-N 3.23Å; F178-S181 PolarHBondContact O-N 3.24Å; F178-H182 AromaticContact CD2-CD2 3.84Å; F178-H182 AromaticContact CD2-NE2 3.95Å; F178-H182 AromaticContact CE1-CD2 3.64Å; F178-H182 AromaticContact CE2-CD2 3.41Å; F178-H182 VanDerWaalsContact CE2-CD2 3.41Å; F178-H182 WeakPolarHBondContact CE2-CD2 3.38Å; F178-H182 AromaticContact CE2-NE2 3.21Å; F178-H182 WeakPolarHBondContact CE2-NE2 3.37Å; F178-H182 AromaticContact CZ-CD2 3.28Å; F178-H182 WeakPolarHBondContact CZ-CD2 3.42Å; F178-H182 AromaticContact CZ-NE2 3.32Å; F178-H182 VanDerWaalsContact CZ-NE2 3.32Å; F178-H182 WeakPolarHBondContact CZ-NE2 3.36Å; F178-H182 PolarHBondContact O-CD2 3.41Å; F178-H182 PolarHBondContact O-N 3.07Å; F178-H182 VanDerWaalsContact O-N 3.12Å; F178-F508 AromaticContact CE1-CD2 3.35Å; F178-F508 HydrophobicContact CE1-CD2 3.35Å; F178-F508 AromaticContact CE1-CE2 3.59Å; F178-F508 HydrophobicContact CE1-CE2 3.59Å; F178-F508 AromaticContact CE1-CG 3.95Å; F178-F508 HydrophobicContact CE1-CG 3.95Å; F178-F508 HydrophobicContact CE1-CZ 4.38Å; F178-F508 HydrophobicContact CZ-CB 3.95Å; F178-F508 AromaticContact CZ-CD2 3.28Å; F178-F508 HydrophobicContact CZ-CD2 3.28Å; F178-F508 AromaticContact CZ-CE2 4Å; F178-F508 HydrophobicContact CZ-CE2 4Å; F178-F508 AromaticContact CZ-CG 3.8Å; F178-F508 HydrophobicContact CZ-CG 3.8Å
179	L	72.4	Confident	79	Confident	62 Å²	62	90.7 Å²	90.7	33%	0.325	46%	0.463	S	S	.	.	H	α-helix	trans	-56	-48.2	174.9	-76.3	176.8	0	0	0	110.7	F175 I176 S181 H182 I183	F175-L179 HydrophobicContact CD1-CD1 3.83Å; F175-L179 HydrophobicContact CD1-CG 4.34Å; F175-L179 HydrophobicContact CD2-CG 4.49Å; F175-L179 HydrophobicContact CE1-CD1 3.5Å; F175-L179 HydrophobicContact CE1-CG 4.12Å; F175-L179 HydrophobicContact CE2-CD2 4.29Å; F175-L179 HydrophobicContact CE2-CG 4.26Å; F175-L179 HydrophobicContact CG-CD1 4.48Å; F175-L179 HydrophobicContact CZ-CD1 3.88Å; F175-L179 HydrophobicContact CZ-CD2 4.07Å; F175-L179 HydrophobicContact CZ-CG 4.07Å; F175-L179 WeakPolarHBondContact O-CB 3.49Å; F175-L179 VanDerWaalsContact O-CG 3.26Å; F175-L179 WeakPolarHBondContact O-CG 3.49Å; F175-L179 PolarHBondContact O-N 3.35Å; I176-L179 PolarHBondContact O-N 2.85Å; L179-S181 VanDerWaalsContact C-N 3.29Å; L179-S181 PolarHBondContact O-N 3.03Å; L179-H182 PolarHBondContact O-N 3.06Å; L179-I183 HydrophobicContact CB-CD1 4.31Å; L179-I183 HydrophobicContact CD2-CD1 3.55Å; L179-I183 HydrophobicContact CD2-CG1 4.49Å; L179-I183 WeakPolarHBondContact O-CA 3.45Å; L179-I183 VanDerWaalsContact O-CB 3.25Å; L179-I183 WeakPolarHBondContact O-CB 3.5Å; L179-I183 WeakPolarHBondContact O-CD1 3.48Å; L179-I183 PolarHBondContact O-N 3.05Å
180	F	74.4	Confident	80.2	Confident	176 Å²	176	87.1 Å²	87.1	77%	0.772	45%	0.454	S	S	*	.	H	α-helix	trans	-57.2	-41.3	-178.3	-171.5	-99	0	0	0	112.7	I176 A177 F178 G184	I176-F180 WeakPolarHBondContact O-CB 3.38Å; I176-F180 PolarHBondContact O-N 3.04Å; A177-F180 PolarHBondContact O-N 3.45Å; F178-F180 VanDerWaalsContact C-N 3.34Å; F178-F180 PolarHBondContact O-N 3.23Å; F180-G184 WeakPolarHBondContact O-CA 3.33Å; F180-G184 PolarHBondContact O-N 3.49Å
181	S	76.1	Confident	81.3	Confident	75 Å²	75	80.9 Å²	80.9	52%	0.524	44%	0.438	S	S	.	.	H	α-helix	trans	-68	-47	177.4	-178.2	0	0	0	0	112.9	A177 F178 L179 L185	A177-S181 PolarHBondContact O-N 3.37Å; F178-S181 PolarHBondContact O-N 3.24Å; L179-S181 VanDerWaalsContact C-N 3.29Å; L179-S181 PolarHBondContact O-N 3.03Å; S181-L185 PolarHBondContact O-N 3.43Å
182	H	80	Confident	82.6	Confident	34 Å²	34	75.1 Å²	75.1	16%	0.157	42%	0.416	C	S	.	.	H	α-helix	trans	-78.6	-45.4	-176.4	-74.2	-87.6	0	0	0	112.9	F178 L179 G184 L185 C186 N504	F178-H182 AromaticContact CD2-CD2 3.84Å; F178-H182 AromaticContact CD2-NE2 3.95Å; F178-H182 AromaticContact CE1-CD2 3.64Å; F178-H182 AromaticContact CE2-CD2 3.41Å; F178-H182 VanDerWaalsContact CE2-CD2 3.41Å; F178-H182 WeakPolarHBondContact CE2-CD2 3.38Å; F178-H182 AromaticContact CE2-NE2 3.21Å; F178-H182 WeakPolarHBondContact CE2-NE2 3.37Å; F178-H182 AromaticContact CZ-CD2 3.28Å; F178-H182 WeakPolarHBondContact CZ-CD2 3.42Å; F178-H182 AromaticContact CZ-NE2 3.32Å; F178-H182 VanDerWaalsContact CZ-NE2 3.32Å; F178-H182 WeakPolarHBondContact CZ-NE2 3.36Å; F178-H182 PolarHBondContact O-CD2 3.41Å; F178-H182 PolarHBondContact O-N 3.07Å; F178-H182 VanDerWaalsContact O-N 3.12Å; L179-H182 PolarHBondContact O-N 3.06Å; H182-G184 VanDerWaalsContact C-N 3.34Å; H182-L185 PolarHBondContact O-N 3.33Å; H182-C186 PolarHBondContact O-N 2.82Å; H182-C186 VanDerWaalsContact O-N 3.12Å; H182-C186 PolarHBondContact O-SG 3.45Å; H182-N504 PolarHBondContact CE1-O 2.96Å; H182-N504 PolarHBondContact ND1-O 3.46Å
183	I	84.8	Confident	83.6	Confident	80 Å²	80	72.2 Å²	72.2	41%	0.41	40%	0.401	S	S	.	.	H	α-helix	trans	-67.7	-36.6	177.1	-77.3	60.1	0	0	0	110	L179 L185 C186 L187	L179-I183 HydrophobicContact CB-CD1 4.31Å; L179-I183 HydrophobicContact CD2-CD1 3.55Å; L179-I183 HydrophobicContact CD2-CG1 4.49Å; L179-I183 WeakPolarHBondContact O-CA 3.45Å; L179-I183 VanDerWaalsContact O-CB 3.25Å; L179-I183 WeakPolarHBondContact O-CB 3.5Å; L179-I183 WeakPolarHBondContact O-CD1 3.48Å; L179-I183 PolarHBondContact O-N 3.05Å; I183-L185 VanDerWaalsContact C-N 3.34Å; I183-L185 PolarHBondContact O-N 3.07Å; I183-C186 PolarHBondContact O-N 3.25Å; I183-L187 HydrophobicContact CG2-CD1 3.67Å; I183-L187 HydrophobicContact CG2-CG 3.92Å; I183-L187 WeakPolarHBondContact O-CB 3.23Å; I183-L187 VanDerWaalsContact O-CG 3.3Å; I183-L187 WeakPolarHBondContact O-CG 3.41Å; I183-L187 PolarHBondContact O-N 2.88Å
184	G	88.1	Confident	84.5	Confident	27 Å²	27	66.9 Å²	66.9	28%	0.278	39%	0.385	S	S	.	.	H	α-helix	trans	-54.8	-48.3	175	0	0	0	0	0	112.2	F180 H182 L187 V188	F180-G184 WeakPolarHBondContact O-CA 3.33Å; F180-G184 PolarHBondContact O-N 3.49Å; H182-G184 VanDerWaalsContact C-N 3.34Å; G184-L187 PolarHBondContact O-N 3.29Å; G184-V188 WeakPolarHBondContact O-CG2 3.47Å; G184-V188 PolarHBondContact O-N 2.99Å
185	L	89.3	Confident	85.9	Confident	29 Å²	29	68.6 Å²	68.6	15%	0.152	39%	0.387	C	S	.	.	H	α-helix	trans	-65.8	-41.4	176.3	-179.4	58.7	0	0	0	112.9	S181 H182 I183 L187 V188 V189 L497 L500 C501 N504	S181-L185 PolarHBondContact O-N 3.43Å; H182-L185 PolarHBondContact O-N 3.33Å; I183-L185 VanDerWaalsContact C-N 3.34Å; I183-L185 PolarHBondContact O-N 3.07Å; L185-L187 VanDerWaalsContact C-N 3.32Å; L185-L187 PolarHBondContact O-N 3.47Å; L185-V188 PolarHBondContact O-N 3.44Å; L185-V189 PolarHBondContact O-N 2.79Å; L185-L497 HydrophobicContact CD1-CD1 4.34Å; L185-L500 HydrophobicContact CD1-CD2 4.19Å; L185-L500 HydrophobicContact CD2-CD2 3.46Å; L185-L500 VanDerWaalsContact CD2-CD2 3.46Å; L185-L500 HydrophobicContact CG-CD2 4.49Å; L185-C501 HydrophobicContact CD2-CB 4.3Å; L185-C501 HydrophobicContact CG-CB 4.17Å; L185-N504 HydrophobicContact CD2-CB 4.05Å; L185-N504 WeakPolarHBondContact CD2-ND2 3.45Å
186	C	89.8	Confident	86.9	Confident	44 Å²	44	63.3 Å²	63.3	30%	0.297	36%	0.364	S	S	.	.	H	α-helix	trans	-62.7	-38.4	175.1	-63.8	0	0	0	0	112.2	H182 I183 V189 V190	H182-C186 PolarHBondContact O-N 2.82Å; H182-C186 VanDerWaalsContact O-N 3.12Å; H182-C186 PolarHBondContact O-SG 3.45Å; I183-C186 PolarHBondContact O-N 3.25Å; C186-V189 PolarHBondContact O-N 2.99Å; C186-V190 WeakPolarHBondContact O-CG2 3.34Å; C186-V190 PolarHBondContact O-N 3.22Å
187	L	92.4	Very high	87.9	Confident	112 Å²	112	58.6 Å²	58.6	59%	0.586	34%	0.34	S	S	*	.	H	α-helix	trans	-67.7	-35.7	175.1	-72	173.8	0	0	0	112.1	I183 G184 L185 V190 G191	I183-L187 HydrophobicContact CG2-CD1 3.67Å; I183-L187 HydrophobicContact CG2-CG 3.92Å; I183-L187 WeakPolarHBondContact O-CB 3.23Å; I183-L187 VanDerWaalsContact O-CG 3.3Å; I183-L187 WeakPolarHBondContact O-CG 3.41Å; I183-L187 PolarHBondContact O-N 2.88Å; G184-L187 PolarHBondContact O-N 3.29Å; L185-L187 VanDerWaalsContact C-N 3.32Å; L185-L187 PolarHBondContact O-N 3.47Å; L187-V190 PolarHBondContact O-N 3.02Å; L187-G191 PolarHBondContact O-N 3.49Å
188	V	94	Very high	89.1	Confident	83 Å²	83	60.4 Å²	60.4	50%	0.503	34%	0.34	S	S	.	.	H	α-helix	trans	-63	-42.8	172.1	172.3	0	0	0	0	110.9	G184 L185 G191 Y192 L497	G184-V188 WeakPolarHBondContact O-CG2 3.47Å; G184-V188 PolarHBondContact O-N 2.99Å; L185-V188 PolarHBondContact O-N 3.44Å; V188-G191 PolarHBondContact O-N 3.4Å; V188-Y192 WeakPolarHBondContact O-CB 3.5Å; V188-Y192 PolarHBondContact O-N 2.79Å; V188-L497 HydrophobicContact CG1-CD1 4Å; V188-L497 HydrophobicContact CG1-CD2 4.25Å
189	V	95	Very high	90.3	Very high	19 Å²	19	60.2 Å²	60.2	12%	0.115	34%	0.342	C	S	.	.	H	α-helix	trans	-62.7	-47.7	173.7	174.1	0	0	0	0	111.5	L185 C186 G191 Y192 C193 I468 L497 V498 C501	L185-V189 PolarHBondContact O-N 2.79Å; C186-V189 PolarHBondContact O-N 2.99Å; V189-G191 VanDerWaalsContact C-N 3.32Å; V189-G191 PolarHBondContact O-N 3.45Å; V189-Y192 WeakPolarHBondContact O-CB 3.48Å; V189-Y192 PolarHBondContact O-N 3.39Å; V189-Y192 VanDerWaalsContact O-N 3.15Å; V189-C193 PolarHBondContact O-N 3.38Å; V189-C193 PolarHBondContact O-SG 3.35Å; V189-I468 HydrophobicContact CG1-CD1 4.27Å; V189-L497 HydrophobicContact CG2-CD2 4.12Å; V189-L497 HydrophobicContact CG2-CG 3.93Å; V189-V498 HydrophobicContact CG1-CG2 4.39Å; V189-C501 HydrophobicContact CG2-CB 3.75Å
190	V	95	Very high	91.4	Very high	85 Å²	85	57.3 Å²	57.3	52%	0.515	33%	0.327	S	S	.	.	H	α-helix	trans	-63.5	-38.3	179.1	171.1	0	0	0	0	111.7	C186 L187 C193 S194	C186-V190 WeakPolarHBondContact O-CG2 3.34Å; C186-V190 PolarHBondContact O-N 3.22Å; L187-V190 PolarHBondContact O-N 3.02Å; V190-C193 PolarHBondContact O-N 3.47Å; V190-S194 WeakPolarHBondContact O-CB 3.31Å; V190-S194 PolarHBondContact O-N 3.02Å; V190-S194 PolarHBondContact O-OG 2.73Å
191	G	95.8	Very high	92.3	Very high	39 Å²	39	52.7 Å²	52.7	40%	0.402	30%	0.304	S	S	.	.	H	α-helix	trans	-63	-42.3	172	0	0	0	0	0	112.3	L187 V188 V189 S194 L195	L187-G191 PolarHBondContact O-N 3.49Å; V188-G191 PolarHBondContact O-N 3.4Å; V189-G191 VanDerWaalsContact C-N 3.32Å; V189-G191 PolarHBondContact O-N 3.45Å; G191-S194 PolarHBondContact O-N 3.49Å; G191-L195 WeakPolarHBondContact O-CB 3.36Å; G191-L195 PolarHBondContact O-N 3.29Å
192	Y	96.6	Very high	93.1	Very high	49 Å²	49	53.2 Å²	53.2	19%	0.192	31%	0.308	C	S	.	.	H	α-helix	trans	-62.6	-46.3	175.8	-165.9	-97.9	0	0	0	112	V188 V189 S194 L195 G196 I468 Y490 G494 L497	V188-Y192 WeakPolarHBondContact O-CB 3.5Å; V188-Y192 PolarHBondContact O-N 2.79Å; V189-Y192 WeakPolarHBondContact O-CB 3.48Å; V189-Y192 PolarHBondContact O-N 3.39Å; V189-Y192 VanDerWaalsContact O-N 3.15Å; Y192-S194 VanDerWaalsContact C-N 3.29Å; Y192-S194 PolarHBondContact O-N 2.93Å; Y192-L195 PolarHBondContact O-N 3.37Å; Y192-G196 PolarHBondContact O-N 3.44Å; Y192-I468 HydrophobicContact CD1-CD1 4.5Å; Y192-I468 HydrophobicContact CD1-CG2 4.26Å; Y192-I468 HydrophobicContact CE1-CG2 3.97Å; Y192-Y490 HydrophobicContact CD1-CD2 4.44Å; Y192-Y490 AromaticContact CD1-CE2 3.62Å; Y192-Y490 HydrophobicContact CD1-CE2 3.62Å; Y192-Y490 AromaticContact CD1-CZ 3.91Å; Y192-Y490 AromaticContact CE1-CD2 3.54Å; Y192-Y490 HydrophobicContact CE1-CD2 3.54Å; Y192-Y490 HydrophobicContact CE1-CE1 4.36Å; Y192-Y490 AromaticContact CE1-CE2 3.13Å; Y192-Y490 HydrophobicContact CE1-CE2 3.13Å; Y192-Y490 HydrophobicContact CE1-CG 4.28Å; Y192-Y490 AromaticContact CE1-CZ 3.59Å; Y192-Y490 HydrophobicContact CE2-CE2 4.49Å; Y192-Y490 HydrophobicContact CG-CE2 4.47Å; Y192-Y490 AromaticContact CZ-CD2 3.61Å; Y192-Y490 AromaticContact CZ-CE2 3.64Å; Y192-Y490 WeakPolarHBondContact OH-CD2 3.32Å; Y192-Y490 PolarHBondContact OH-O 3.26Å; Y192-G494 VanDerWaalsContact CE1-CA 3.48Å; Y192-L497 HydrophobicContact CD1-CD2 4.31Å; Y192-L497 HydrophobicContact CD2-CD2 4.29Å; Y192-L497 HydrophobicContact CG-CD2 3.9Å
193	C	96.1	Very high	93.8	Very high	13 Å²	13	53 Å²	53	9%	0.088	31%	0.308	C	S	.	.	H	α-helix	trans	-56.6	-43.4	172.2	-63.9	0	0	0	0	112	V189 V190 G196 A197 V465 I468	V189-C193 PolarHBondContact O-N 3.38Å; V189-C193 PolarHBondContact O-SG 3.35Å; V190-C193 PolarHBondContact O-N 3.47Å; C193-G196 PolarHBondContact O-N 3.39Å; C193-A197 WeakPolarHBondContact O-CB 3.49Å; C193-A197 PolarHBondContact O-N 3.44Å; C193-V465 HydrophobicContact CB-CG2 4.13Å; C193-I468 WeakPolarHBondContact SG-CD1 3.21Å
194	S	96.1	Very high	94.1	Very high	51 Å²	51	49.2 Å²	49.2	36%	0.357	29%	0.288	S	S	.	.	H	α-helix	trans	-68.5	-40.6	-177.9	-56.6	0	0	0	0	111.7	V190 G191 Y192 A197 L198	V190-S194 WeakPolarHBondContact O-CB 3.31Å; V190-S194 PolarHBondContact O-N 3.02Å; V190-S194 PolarHBondContact O-OG 2.73Å; G191-S194 PolarHBondContact O-N 3.49Å; Y192-S194 VanDerWaalsContact C-N 3.29Å; Y192-S194 PolarHBondContact O-N 2.93Å; S194-A197 PolarHBondContact O-N 3.08Å; S194-L198 WeakPolarHBondContact O-CG 3.3Å; S194-L198 PolarHBondContact O-N 3.24Å; S194-L198 VanDerWaalsContact O-N 3.11Å
195	L	96.6	Very high	94	Very high	116 Å²	116	50.7 Å²	50.7	61%	0.607	29%	0.288	S	S	*	.	H	α-helix	trans	-65	-45	174.3	-177.2	63.2	0	0	0	111.2	G191 Y192 A197 L198 L199	G191-L195 WeakPolarHBondContact O-CB 3.36Å; G191-L195 PolarHBondContact O-N 3.29Å; Y192-L195 PolarHBondContact O-N 3.37Å; L195-A197 VanDerWaalsContact C-N 3.35Å; L195-A197 PolarHBondContact O-N 3.48Å; L195-L198 PolarHBondContact O-N 3.01Å; L195-L199 WeakPolarHBondContact O-CB 3.38Å; L195-L199 PolarHBondContact O-N 2.84Å
196	G	96.4	Very high	93.8	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-59	-43.7	173.8	0	0	0	0	0	112.5	Y192 C193 L198 L199 F200	Y192-G196 PolarHBondContact O-N 3.44Å; C193-G196 PolarHBondContact O-N 3.39Å; G196-L198 PolarHBondContact O-N 2.79Å; G196-L199 PolarHBondContact O-N 3.46Å; G196-F200 WeakPolarHBondContact O-CD2 3.49Å; G196-F200 PolarHBondContact O-N 2.85Å
197	A	95.6	Very high	93.7	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.008	32%	0.315	C	S	.	.	H	α-helix	trans	-58.8	-45.2	176.7	0	0	0	0	0	112.3	C193 S194 L195 R201 A460 L461	C193-A197 WeakPolarHBondContact O-CB 3.49Å; C193-A197 PolarHBondContact O-N 3.44Å; S194-A197 PolarHBondContact O-N 3.08Å; L195-A197 VanDerWaalsContact C-N 3.35Å; L195-A197 PolarHBondContact O-N 3.48Å; A197-R201 WeakPolarHBondContact O-CB 3.43Å; A197-R201 PolarHBondContact O-N 3.25Å; A197-A460 HydrophobicContact CB-CB 4.43Å; A197-A460 WeakPolarHBondContact O-CB 3.3Å; A197-L461 HydrophobicContact CB-CB 3.81Å; A197-L461 HydrophobicContact CB-CG 4.44Å
198	L	96	Very high	93.3	Very high	100 Å²	100	53 Å²	53	52%	0.524	29%	0.291	S	S	.	.	H	α-helix	trans	-67.1	-39.5	176.2	-67.3	173.5	0	0	0	111.9	S194 L195 G196 S202 L457	S194-L198 WeakPolarHBondContact O-CG 3.3Å; S194-L198 PolarHBondContact O-N 3.24Å; S194-L198 VanDerWaalsContact O-N 3.11Å; L195-L198 PolarHBondContact O-N 3.01Å; G196-L198 PolarHBondContact O-N 2.79Å; L198-S202 VanDerWaalsContact O-CB 3.29Å; L198-S202 WeakPolarHBondContact O-CB 3.39Å; L198-S202 PolarHBondContact O-N 3.03Å; L198-L457 HydrophobicContact CD2-CD1 4.15Å
199	L	95.5	Very high	92.5	Very high	69 Å²	69	51.6 Å²	51.6	36%	0.361	29%	0.288	S	S	.	.	H	α-helix	trans	-63.8	-57.2	179.9	-177.1	62.5	0	0	0	112	L195 G196 R201 S202 I203 I486	L195-L199 WeakPolarHBondContact O-CB 3.38Å; L195-L199 PolarHBondContact O-N 2.84Å; G196-L199 PolarHBondContact O-N 3.46Å; L199-R201 VanDerWaalsContact C-N 3.3Å; L199-R201 PolarHBondContact O-N 3.01Å; L199-S202 PolarHBondContact O-N 2.88Å; L199-I203 HydrophobicContact CD1-CD1 4.02Å; L199-I203 HydrophobicContact CG-CD1 3.98Å; L199-I203 WeakPolarHBondContact O-CD1 3.29Å; L199-I203 VanDerWaalsContact O-CG1 3.32Å; L199-I203 WeakPolarHBondContact O-CG1 3.35Å; L199-I203 PolarHBondContact O-N 2.78Å; L199-I203 VanDerWaalsContact O-N 3.11Å; L199-I486 HydrophobicContact CD2-CG2 3.6Å; L199-I486 HydrophobicContact CG-CG2 4.17Å
200	F	95.6	Very high	91.8	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63.1	-37.2	-179.9	-66.4	-61.5	0	0	0	112.2	G196 I203 E204 W455 Y463 A464 I486 T487 Y490	G196-F200 WeakPolarHBondContact O-CD2 3.49Å; G196-F200 PolarHBondContact O-N 2.85Å; F200-I203 PolarHBondContact O-N 3.36Å; F200-E204 WeakPolarHBondContact O-CB 3.34Å; F200-E204 PolarHBondContact O-N 2.94Å; F200-W455 HydrophobicContact CB-CE3 4.18Å; F200-W455 HydrophobicContact CB-CH2 4.35Å; F200-W455 HydrophobicContact CB-CZ3 3.68Å; F200-Y463 HydrophobicContact CB-CD1 4.37Å; F200-Y463 AromaticContact CD1-CE1 3.96Å; F200-Y463 HydrophobicContact CD1-CE1 3.96Å; F200-Y463 AromaticContact CD2-CD1 3.71Å; F200-Y463 HydrophobicContact CD2-CD1 3.71Å; F200-Y463 AromaticContact CD2-CE1 3.73Å; F200-Y463 HydrophobicContact CD2-CE1 3.73Å; F200-Y463 HydrophobicContact CE1-CE1 4.04Å; F200-Y463 HydrophobicContact CE2-CD1 4.15Å; F200-Y463 AromaticContact CE2-CE1 3.82Å; F200-Y463 HydrophobicContact CE2-CE1 3.82Å; F200-Y463 AromaticContact CG-CD1 3.96Å; F200-Y463 HydrophobicContact CG-CD1 3.96Å; F200-Y463 AromaticContact CG-CE1 3.83Å; F200-Y463 HydrophobicContact CG-CE1 3.83Å; F200-Y463 AromaticContact CZ-CE1 3.98Å; F200-Y463 HydrophobicContact CZ-CE1 3.98Å; F200-A464 HydrophobicContact CD2-CB 4.41Å; F200-I486 HydrophobicContact CE1-CG2 3.91Å; F200-I486 HydrophobicContact CZ-CG2 4.34Å; F200-T487 VanDerWaalsContact CE1-OG1 3.24Å; F200-T487 WeakPolarHBondContact CE1-OG1 3.38Å; F200-Y490 AromaticContact CE2-CD1 3.66Å; F200-Y490 HydrophobicContact CE2-CD1 3.66Å; F200-Y490 HydrophobicContact CE2-CD2 4.35Å; F200-Y490 AromaticContact CE2-CE1 3.88Å; F200-Y490 HydrophobicContact CE2-CE1 3.88Å; F200-Y490 AromaticContact CE2-CG 3.93Å; F200-Y490 HydrophobicContact CE2-CG 3.93Å; F200-Y490 AromaticContact CZ-CD1 3.81Å; F200-Y490 HydrophobicContact CZ-CD1 3.81Å; F200-Y490 HydrophobicContact CZ-CE1 4.48Å; F200-Y490 AromaticContact CZ-CG 3.89Å; F200-Y490 HydrophobicContact CZ-CG 3.89Å
201	R	93.9	Very high	91.1	Very high	79 Å²	79	55 Å²	55	30%	0.298	30%	0.302	S	S	.	.	H	α-helix	trans	-59.5	-49.8	172.9	-178.2	171.2	-177.7	-145.5	-4.3	111.7	A197 L199 I203 Q205 W455 A460	A197-R201 WeakPolarHBondContact O-CB 3.43Å; A197-R201 PolarHBondContact O-N 3.25Å; L199-R201 VanDerWaalsContact C-N 3.3Å; L199-R201 PolarHBondContact O-N 3.01Å; R201-I203 PolarHBondContact O-N 3.26Å; R201-Q205 VanDerWaalsContact CG-CD 3.46Å; R201-Q205 HydrophobicContact CG-CG 3.76Å; R201-Q205 VanDerWaalsContact CG-OE1 3.24Å; R201-Q205 VanDerWaalsContact O-CB 3.23Å; R201-Q205 WeakPolarHBondContact O-CB 3.45Å; R201-Q205 WeakPolarHBondContact O-CG 3.22Å; R201-Q205 PolarHBondContact O-N 3.28Å; R201-W455 WeakPolarHBondContact CG-O 3.3Å; R201-W455 PolarHBondContact NE-O 2.89Å; R201-A460 HydrophobicContact CB-CB 3.95Å
202	S	93	Very high	90	Very high	87 Å²	87	55.4 Å²	55.4	61%	0.608	29%	0.294	S	S	*	.	H	α-helix	trans	-60.9	-32.1	179.6	-168.1	0	0	0	0	113.3	L198 L199	L198-S202 VanDerWaalsContact O-CB 3.29Å; L198-S202 WeakPolarHBondContact O-CB 3.39Å; L198-S202 PolarHBondContact O-N 3.03Å; L199-S202 PolarHBondContact O-N 2.88Å
203	I	93.3	Very high	88.8	Confident	30 Å²	30	58.7 Å²	58.7	15%	0.154	31%	0.311	C	S	.	.	H	α-helix	trans	-77.6	-55	178.8	-65.1	158.8	0	0	0	111.4	L199 F200 R201 L482 I486	L199-I203 HydrophobicContact CD1-CD1 4.02Å; L199-I203 HydrophobicContact CG-CD1 3.98Å; L199-I203 WeakPolarHBondContact O-CD1 3.29Å; L199-I203 VanDerWaalsContact O-CG1 3.32Å; L199-I203 WeakPolarHBondContact O-CG1 3.35Å; L199-I203 PolarHBondContact O-N 2.78Å; L199-I203 VanDerWaalsContact O-N 3.11Å; F200-I203 PolarHBondContact O-N 3.36Å; R201-I203 PolarHBondContact O-N 3.26Å; I203-L482 HydrophobicContact CB-CD2 4.36Å; I203-L482 HydrophobicContact CD1-CD2 3.89Å; I203-L482 HydrophobicContact CG1-CD2 3.78Å; I203-L482 HydrophobicContact CG2-CD2 3.62Å; I203-I486 HydrophobicContact CD1-CD1 3.62Å; I203-I486 HydrophobicContact CD1-CG2 4.27Å
204	E	92.8	Very high	87.8	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-88.3	-20.6	-166	-70.6	-83	140.3	0	0	114	F200 N206 Y207 Q208 W455 P478 K479 T480	F200-E204 WeakPolarHBondContact O-CB 3.34Å; F200-E204 PolarHBondContact O-N 2.94Å; E204-N206 VanDerWaalsContact C-N 3.3Å; E204-N206 PolarHBondContact O-N 3.46Å; E204-Y207 PolarHBondContact O-N 3.42Å; E204-Y207 VanDerWaalsContact O-N 3.12Å; E204-Q208 PolarHBondContact O-N 2.94Å; E204-W455 VanDerWaalsContact CB-CD1 3.49Å; E204-W455 HydrophobicContact CB-CD2 3.81Å; E204-W455 VanDerWaalsContact CB-CE2 3.47Å; E204-W455 HydrophobicContact CB-CG 3.85Å; E204-W455 HydrophobicContact CB-CZ2 4.04Å; E204-W455 VanDerWaalsContact CB-NE1 3.26Å; E204-W455 HydrophobicContact CG-CD2 4.37Å; E204-W455 HydrophobicContact CG-CH2 4.39Å; E204-W455 HydrophobicContact CG-CZ2 3.74Å; E204-P478 VanDerWaalsContact CD-CA 3.48Å; E204-P478 HydrophobicContact CG-CB 4.22Å; E204-P478 WeakPolarHBondContact OE1-CA 3.17Å; E204-P478 WeakPolarHBondContact OE1-CB 3.45Å; E204-K479 VanDerWaalsContact CD-N 3.29Å; E204-K479 PolarHBondContact OE1-N 2.93Å; E204-K479 PolarHBondContact OE2-N 2.92Å; E204-T480 VanDerWaalsContact OE1-CB 3.29Å; E204-T480 WeakPolarHBondContact OE1-CB 3.25Å; E204-T480 WeakPolarHBondContact OE1-CG2 3.25Å; E204-T480 PolarHBondContact OE1-N 3.43Å; E204-T480 PolarHBondContact OE1-OG1 3.42Å
205	Q	85.6	Confident	86.6	Confident	58 Å²	58	66 Å²	66	27%	0.271	34%	0.337	S	S	.	.	H	α-helix	trans	-58	-40.8	-179.3	-85.2	-165.4	-61.8	0	0	112.5	R201 Y207 Q208 A209 W455	R201-Q205 VanDerWaalsContact CG-CD 3.46Å; R201-Q205 HydrophobicContact CG-CG 3.76Å; R201-Q205 VanDerWaalsContact CG-OE1 3.24Å; R201-Q205 VanDerWaalsContact O-CB 3.23Å; R201-Q205 WeakPolarHBondContact O-CB 3.45Å; R201-Q205 WeakPolarHBondContact O-CG 3.22Å; R201-Q205 PolarHBondContact O-N 3.28Å; Q205-Y207 VanDerWaalsContact C-N 3.32Å; Q205-Y207 PolarHBondContact O-N 3.45Å; Q205-Q208 PolarHBondContact O-N 3.22Å; Q205-A209 WeakPolarHBondContact O-CB 3.26Å; Q205-A209 PolarHBondContact O-N 3.37Å; Q205-W455 HydrophobicContact CG-CB 3.88Å
206	N	85.4	Confident	85.1	Confident	115 Å²	115	63.3 Å²	63.3	62%	0.615	33%	0.326	S	S	*	.	H	α-helix	trans	-64.7	-37.9	178.8	-67	-35.2	0	0	0	111.9	E204 N210	E204-N206 VanDerWaalsContact C-N 3.3Å; E204-N206 PolarHBondContact O-N 3.46Å; N206-N210 WeakPolarHBondContact O-CB 3.48Å; N206-N210 PolarHBondContact O-N 2.85Å; N206-N210 VanDerWaalsContact O-N 3.13Å; N206-N210 PolarHBondContact O-ND2 3.14Å
207	Y	87.3	Confident	83.7	Confident	101 Å²	101	65.6 Å²	65.6	40%	0.396	34%	0.34	S	S	.	.	H	α-helix	trans	-68.5	-48.2	177.2	-180	-87.4	0	0	0	111.4	E204 Q205 N210 L211 K479 T480	E204-Y207 PolarHBondContact O-N 3.42Å; E204-Y207 VanDerWaalsContact O-N 3.12Å; Q205-Y207 VanDerWaalsContact C-N 3.32Å; Q205-Y207 PolarHBondContact O-N 3.45Å; Y207-N210 PolarHBondContact O-N 3.27Å; Y207-L211 HydrophobicContact CE1-CD2 4.27Å; Y207-L211 WeakPolarHBondContact O-CB 3.48Å; Y207-L211 PolarHBondContact O-N 2.88Å; Y207-K479 HydrophobicContact CD1-CB 3.91Å; Y207-K479 HydrophobicContact CE1-CB 3.42Å; Y207-K479 VanDerWaalsContact CE1-CB 3.42Å; Y207-K479 HydrophobicContact CE1-CG 4Å; Y207-T480 HydrophobicContact CD2-CG2 3.9Å; Y207-T480 HydrophobicContact CG-CG2 3.83Å
208	Q	82.9	Confident	82.5	Confident	18 Å²	18	69 Å²	69	8%	0.084	36%	0.356	C	S	.	.	H	α-helix	trans	-68.2	-37.3	178.5	-60.8	-53.2	-32.9	0	0	112.5	E204 Q205 N210 L211 I212 P454 W455	E204-Q208 PolarHBondContact O-N 2.94Å; Q205-Q208 PolarHBondContact O-N 3.22Å; Q208-N210 PolarHBondContact O-N 3.07Å; Q208-L211 PolarHBondContact O-N 3.01Å; Q208-I212 WeakPolarHBondContact O-CB 3.3Å; Q208-I212 VanDerWaalsContact O-CG1 3.25Å; Q208-I212 WeakPolarHBondContact O-CG1 3.2Å; Q208-I212 PolarHBondContact O-N 3.15Å; Q208-P454 HydrophobicContact CG-CG 4.19Å; Q208-W455 VanDerWaalsContact CG-CD1 3.44Å
209	A	77.2	Confident	81	Confident	53 Å²	53	69 Å²	69	44%	0.438	36%	0.355	S	S	.	.	H	α-helix	trans	-60.7	-45.3	175.3	0	0	0	0	0	111.6	Q205 H213	Q205-A209 WeakPolarHBondContact O-CB 3.26Å; Q205-A209 PolarHBondContact O-N 3.37Å; A209-H213 WeakPolarHBondContact O-CB 3.35Å; A209-H213 PolarHBondContact O-N 3.13Å
210	N	81.5	Confident	79.3	Confident	117 Å²	117	68.9 Å²	68.9	63%	0.626	36%	0.358	S	S	*	.	H	α-helix	trans	-65.2	-37.5	175.3	-72.4	-16.3	0	0	0	112.3	N206 Y207 Q208 N214	N206-N210 WeakPolarHBondContact O-CB 3.48Å; N206-N210 PolarHBondContact O-N 2.85Å; N206-N210 VanDerWaalsContact O-N 3.13Å; N206-N210 PolarHBondContact O-ND2 3.14Å; Y207-N210 PolarHBondContact O-N 3.27Å; Q208-N210 PolarHBondContact O-N 3.07Å; N210-N214 WeakPolarHBondContact O-CB 3.18Å; N210-N214 PolarHBondContact O-N 3.38Å
211	L	79.4	Confident	78	Confident	57 Å²	57	73.4 Å²	73.4	30%	0.298	38%	0.377	S	S	.	.	H	α-helix	trans	-65.7	-49.9	177.3	-169.5	67.7	0	0	0	111.6	Y207 Q208 H213 N214 Y215	Y207-L211 HydrophobicContact CE1-CD2 4.27Å; Y207-L211 WeakPolarHBondContact O-CB 3.48Å; Y207-L211 PolarHBondContact O-N 2.88Å; Q208-L211 PolarHBondContact O-N 3.01Å; L211-H213 VanDerWaalsContact C-N 3.35Å; L211-H213 PolarHBondContact O-N 2.91Å; L211-N214 PolarHBondContact O-N 3.5Å; L211-Y215 HydrophobicContact CD1-CD2 4.15Å; L211-Y215 HydrophobicContact CD1-CE2 3.63Å; L211-Y215 HydrophobicContact CD2-CE2 4.47Å; L211-Y215 HydrophobicContact CG-CD2 4Å; L211-Y215 HydrophobicContact CG-CE2 3.8Å; L211-Y215 VanDerWaalsContact O-CD2 3.27Å; L211-Y215 WeakPolarHBondContact O-CD2 3.29Å; L211-Y215 PolarHBondContact O-N 2.97Å
212	I	73.1	Confident	76.6	Confident	48 Å²	48	73.4 Å²	73.4	25%	0.246	38%	0.383	C	S	.	.	H	α-helix	trans	-62.2	-42.4	176.7	-67.2	165.2	0	0	0	110.3	Q208 T216 D453	Q208-I212 WeakPolarHBondContact O-CB 3.3Å; Q208-I212 VanDerWaalsContact O-CG1 3.25Å; Q208-I212 WeakPolarHBondContact O-CG1 3.2Å; Q208-I212 PolarHBondContact O-N 3.15Å; I212-T216 HydrophobicContact CG2-CG2 4.4Å; I212-T216 WeakPolarHBondContact O-CB 3.39Å; I212-T216 WeakPolarHBondContact O-CG2 3.36Å; I212-T216 PolarHBondContact O-N 3.36Å; I212-T216 PolarHBondContact O-OG1 3.19Å; I212-D453 HydrophobicContact CD1-CB 4.28Å
213	H	71.8	Confident	75.1	Confident	119 Å²	119	71.7 Å²	71.7	55%	0.551	37%	0.365	S	S	*	.	H	α-helix	trans	-59.3	-50.7	174.3	-178.2	-82.3	0	0	0	111.3	A209 L211 Y215 T216 T217	A209-H213 WeakPolarHBondContact O-CB 3.35Å; A209-H213 PolarHBondContact O-N 3.13Å; L211-H213 VanDerWaalsContact C-N 3.35Å; L211-H213 PolarHBondContact O-N 2.91Å; H213-Y215 PolarHBondContact O-N 3.22Å; H213-T216 WeakPolarHBondContact CA-OG1 3.2Å; H213-T216 PolarHBondContact O-N 3.18Å; H213-T216 PolarHBondContact O-OG1 2.84Å; H213-T217 VanDerWaalsContact CE1-CG2 3.5Å; H213-T217 WeakPolarHBondContact CE1-CG2 3.4Å; H213-T217 PolarHBondContact O-N 2.83Å; H213-T217 PolarHBondContact O-OG1 3.39Å; H213-T217 VanDerWaalsContact O-OG1 3.05Å
214	N	74.5	Confident	73.7	Confident	93 Å²	93	74.4 Å²	74.4	50%	0.497	38%	0.378	S	S	.	.	H	α-helix	trans	-59.4	-48.7	-178.8	-168.3	23.8	0	0	0	112.1	N210 L211 T216 T217 E218	N210-N214 WeakPolarHBondContact O-CB 3.18Å; N210-N214 PolarHBondContact O-N 3.38Å; L211-N214 PolarHBondContact O-N 3.5Å; N214-T216 PolarHBondContact O-N 2.92Å; N214-T217 WeakPolarHBondContact CA-OG1 3.34Å; N214-T217 PolarHBondContact O-N 3.26Å; N214-T217 PolarHBondContact O-OG1 3.38Å; N214-E218 PolarHBondContact O-N 2.77Å
215	Y	70.8	Confident	72.6	Confident	123 Å²	123	77.4 Å²	77.4	48%	0.482	40%	0.395	S	S	.	.	H	α-helix	trans	-62.7	-41.4	176.3	-78.2	-62.4	0	0	0	112.8	L211 H213 E218 L219 Y451	L211-Y215 HydrophobicContact CD1-CD2 4.15Å; L211-Y215 HydrophobicContact CD1-CE2 3.63Å; L211-Y215 HydrophobicContact CD2-CE2 4.47Å; L211-Y215 HydrophobicContact CG-CD2 4Å; L211-Y215 HydrophobicContact CG-CE2 3.8Å; L211-Y215 VanDerWaalsContact O-CD2 3.27Å; L211-Y215 WeakPolarHBondContact O-CD2 3.29Å; L211-Y215 PolarHBondContact O-N 2.97Å; H213-Y215 PolarHBondContact O-N 3.22Å; Y215-E218 PolarHBondContact O-N 3.27Å; Y215-L219 WeakPolarHBondContact O-CB 3.41Å; Y215-L219 VanDerWaalsContact O-CG 3.26Å; Y215-L219 WeakPolarHBondContact O-CG 3.38Å; Y215-L219 PolarHBondContact O-N 3.28Å; Y215-Y451 HydrophobicContact CD2-CE1 4.46Å; Y215-Y451 HydrophobicContact CG-CE1 4.26Å
216	T	65.4	Low	71.6	Confident	60 Å²	60	79.1 Å²	79.1	37%	0.368	41%	0.405	S	S	.	.	H	α-helix	trans	-69.1	-31.9	176.8	51.9	0	0	0	0	112.5	I212 H213 N214 T220	I212-T216 HydrophobicContact CG2-CG2 4.4Å; I212-T216 WeakPolarHBondContact O-CB 3.39Å; I212-T216 WeakPolarHBondContact O-CG2 3.36Å; I212-T216 PolarHBondContact O-N 3.36Å; I212-T216 PolarHBondContact O-OG1 3.19Å; H213-T216 WeakPolarHBondContact CA-OG1 3.2Å; H213-T216 PolarHBondContact O-N 3.18Å; H213-T216 PolarHBondContact O-OG1 2.84Å; N214-T216 PolarHBondContact O-N 2.92Å; T216-T220 WeakPolarHBondContact O-CB 3.48Å; T216-T220 WeakPolarHBondContact O-CG2 3.28Å; T216-T220 PolarHBondContact O-N 2.85Å; T216-T220 PolarHBondContact O-OG1 3.29Å
217	T	67.7	Low	70.5	Confident	50 Å²	50	77.8 Å²	77.8	31%	0.307	40%	0.395	S	S	.	.	H	α-helix	trans	-68.4	-40.9	171	50.1	0	0	0	0	113	H213 N214 T220 K221	H213-T217 VanDerWaalsContact CE1-CG2 3.5Å; H213-T217 WeakPolarHBondContact CE1-CG2 3.4Å; H213-T217 PolarHBondContact O-N 2.83Å; H213-T217 PolarHBondContact O-OG1 3.39Å; H213-T217 VanDerWaalsContact O-OG1 3.05Å; N214-T217 WeakPolarHBondContact CA-OG1 3.34Å; N214-T217 PolarHBondContact O-N 3.26Å; N214-T217 PolarHBondContact O-OG1 3.38Å; T217-T220 WeakPolarHBondContact CA-OG1 3.41Å; T217-T220 PolarHBondContact O-OG1 3.42Å; T217-T220 VanDerWaalsContact O-OG1 3.13Å; T217-K221 WeakPolarHBondContact O-CB 3.32Å; T217-K221 PolarHBondContact O-N 2.83Å
218	E	69	Low	69.6	Low	73 Å²	73	80.8 Å²	80.8	34%	0.341	41%	0.405	S	S	.	.	H	α-helix	trans	-69.4	-38.1	173.9	-77.5	-59.7	140.2	0	0	112.2	N214 Y215 K221 N222	N214-E218 PolarHBondContact O-N 2.77Å; Y215-E218 PolarHBondContact O-N 3.27Å; E218-K221 PolarHBondContact O-N 3.23Å; E218-K221 WeakPolarHBondContact OE1-CD 3.21Å; E218-K221 IonicContact OE1-NZ 2.59Å; E218-K221 PolarHBondContact OE1-NZ 3.5Å; E218-K221 IonicContact OE2-NZ 2.88Å; E218-K221 PolarHBondContact OE2-NZ 3.19Å; E218-N222 VanDerWaalsContact O-CB 3.32Å; E218-N222 WeakPolarHBondContact O-CB 3.09Å; E218-N222 VanDerWaalsContact O-CG 3.31Å; E218-N222 PolarHBondContact O-N 3.47Å; E218-N222 PolarHBondContact O-ND2 3.12Å
219	L	64.9	Low	68.7	Low	99 Å²	99	85.6 Å²	85.6	52%	0.518	43%	0.431	S	S	.	.	H	α-helix	trans	-62.7	-46.5	174.9	-75.6	167.5	0	0	0	111.9	Y215 N222 Q223	Y215-L219 WeakPolarHBondContact O-CB 3.41Å; Y215-L219 VanDerWaalsContact O-CG 3.26Å; Y215-L219 WeakPolarHBondContact O-CG 3.38Å; Y215-L219 PolarHBondContact O-N 3.28Å; L219-N222 PolarHBondContact O-N 2.94Å; L219-Q223 WeakPolarHBondContact O-CB 3.25Å; L219-Q223 PolarHBondContact O-N 3.25Å
220	T	59.3	Low	68.1	Low	67 Å²	67	86.6 Å²	86.6	41%	0.411	43%	0.426	S	S	.	.	H	α-helix	trans	-68.9	-37.2	177.7	50.3	0	0	0	0	112.6	T216 T217 Q223 M224	T216-T220 WeakPolarHBondContact O-CB 3.48Å; T216-T220 WeakPolarHBondContact O-CG2 3.28Å; T216-T220 PolarHBondContact O-N 2.85Å; T216-T220 PolarHBondContact O-OG1 3.29Å; T217-T220 WeakPolarHBondContact CA-OG1 3.41Å; T217-T220 PolarHBondContact O-OG1 3.42Å; T217-T220 VanDerWaalsContact O-OG1 3.13Å; T220-Q223 PolarHBondContact O-N 3.35Å; T220-M224 WeakPolarHBondContact O-CB 3.5Å; T220-M224 WeakPolarHBondContact O-CG 3.36Å; T220-M224 PolarHBondContact O-N 3.34Å
221	K	68.6	Low	67.4	Low	95 Å²	95	86.7 Å²	86.7	41%	0.413	43%	0.425	S	S	.	.	H	α-helix	trans	-60.4	-44.5	170.8	175	-178.8	163.7	-146.1	0	111.9	T217 E218 M224 N225	T217-K221 WeakPolarHBondContact O-CB 3.32Å; T217-K221 PolarHBondContact O-N 2.83Å; E218-K221 PolarHBondContact O-N 3.23Å; E218-K221 WeakPolarHBondContact OE1-CD 3.21Å; E218-K221 IonicContact OE1-NZ 2.59Å; E218-K221 PolarHBondContact OE1-NZ 3.5Å; E218-K221 IonicContact OE2-NZ 2.88Å; E218-K221 PolarHBondContact OE2-NZ 3.19Å; K221-M224 PolarHBondContact O-N 3.06Å; K221-N225 WeakPolarHBondContact O-CB 3.45Å; K221-N225 PolarHBondContact O-N 2.85Å; K221-N225 PolarHBondContact O-ND2 2.95Å
222	N	65.2	Low	66.8	Low	78 Å²	78	90.7 Å²	90.7	42%	0.417	44%	0.44	S	S	.	.	H	α-helix	trans	-68.2	-39.7	175.9	-74.5	-51.5	0	0	0	112.1	E218 L219 N225 I226	E218-N222 VanDerWaalsContact O-CB 3.32Å; E218-N222 WeakPolarHBondContact O-CB 3.09Å; E218-N222 VanDerWaalsContact O-CG 3.31Å; E218-N222 PolarHBondContact O-N 3.47Å; E218-N222 PolarHBondContact O-ND2 3.12Å; L219-N222 PolarHBondContact O-N 2.94Å; N222-N225 PolarHBondContact O-N 3.23Å; N222-I226 WeakPolarHBondContact O-CB 3.41Å; N222-I226 VanDerWaalsContact O-CG1 3.28Å; N222-I226 WeakPolarHBondContact O-CG1 3.48Å; N222-I226 PolarHBondContact O-N 3.05Å
223	Q	60.9	Low	66.5	Low	51 Å²	51	93.3 Å²	93.3	24%	0.238	45%	0.45	C	S	.	.	H	α-helix	trans	-59.3	-46.1	171.2	179.8	179.3	-21.8	0	0	111.8	L219 T220 N225 I226 Q227	L219-Q223 WeakPolarHBondContact O-CB 3.25Å; L219-Q223 PolarHBondContact O-N 3.25Å; T220-Q223 PolarHBondContact O-N 3.35Å; Q223-N225 VanDerWaalsContact C-N 3.35Å; Q223-N225 PolarHBondContact O-N 3.07Å; Q223-I226 PolarHBondContact O-N 3.42Å; Q223-Q227 WeakPolarHBondContact O-CB 3.47Å; Q223-Q227 WeakPolarHBondContact O-CG 3.29Å; Q223-Q227 PolarHBondContact O-N 2.87Å
224	M	64	Low	66.1	Low	87 Å²	87	92.8 Å²	92.8	43%	0.429	45%	0.447	S	S	.	.	H	α-helix	trans	-63.8	-37.8	176	-76.7	-172.9	-75.4	0	0	112.3	T220 K221 Q227 R228	T220-M224 WeakPolarHBondContact O-CB 3.5Å; T220-M224 WeakPolarHBondContact O-CG 3.36Å; T220-M224 PolarHBondContact O-N 3.34Å; K221-M224 PolarHBondContact O-N 3.06Å; M224-Q227 PolarHBondContact O-N 3.33Å; M224-R228 WeakPolarHBondContact O-CB 3.39Å; M224-R228 WeakPolarHBondContact O-CD 3.43Å; M224-R228 WeakPolarHBondContact O-CG 3.39Å; M224-R228 PolarHBondContact O-N 3.24Å
225	N	70.9	Confident	65.9	Low	64 Å²	64	93.8 Å²	93.8	34%	0.342	45%	0.449	S	S	.	.	H	α-helix	trans	-65	-43.5	174.5	-72.8	-20.4	0	0	0	111.5	K221 N222 Q223 R228 L229	K221-N225 WeakPolarHBondContact O-CB 3.45Å; K221-N225 PolarHBondContact O-N 2.85Å; K221-N225 PolarHBondContact O-ND2 2.95Å; N222-N225 PolarHBondContact O-N 3.23Å; Q223-N225 VanDerWaalsContact C-N 3.35Å; Q223-N225 PolarHBondContact O-N 3.07Å; N225-R228 PolarHBondContact O-N 3.47Å; N225-L229 WeakPolarHBondContact O-CB 3.3Å; N225-L229 VanDerWaalsContact O-CG 3.3Å; N225-L229 WeakPolarHBondContact O-CG 3.36Å; N225-L229 PolarHBondContact O-N 3.09Å
226	I	63.6	Low	65.9	Low	94 Å²	94	91.7 Å²	91.7	48%	0.482	44%	0.443	S	S	.	.	H	α-helix	trans	-62.5	-46.6	175.1	-70.1	164.4	0	0	0	110.7	N222 Q223 R228 L229 F230	N222-I226 WeakPolarHBondContact O-CB 3.41Å; N222-I226 VanDerWaalsContact O-CG1 3.28Å; N222-I226 WeakPolarHBondContact O-CG1 3.48Å; N222-I226 PolarHBondContact O-N 3.05Å; Q223-I226 PolarHBondContact O-N 3.42Å; I226-R228 PolarHBondContact O-N 3.48Å; I226-L229 PolarHBondContact O-N 3.33Å; I226-F230 HydrophobicContact CG2-CD2 3.75Å; I226-F230 HydrophobicContact CG2-CE2 3.5Å; I226-F230 VanDerWaalsContact CG2-CE2 3.5Å; I226-F230 VanDerWaalsContact O-CD2 3.24Å; I226-F230 WeakPolarHBondContact O-CD2 3.41Å; I226-F230 PolarHBondContact O-N 3.16Å
227	Q	61.7	Low	65.6	Low	86 Å²	86	91.3 Å²	91.3	40%	0.402	44%	0.443	S	S	.	.	H	α-helix	trans	-60.8	-42.1	175.6	-74.7	176.9	-23.5	0	0	112.2	Q223 M224 F230 I231	Q223-Q227 WeakPolarHBondContact O-CB 3.47Å; Q223-Q227 WeakPolarHBondContact O-CG 3.29Å; Q223-Q227 PolarHBondContact O-N 2.87Å; M224-Q227 PolarHBondContact O-N 3.33Å; Q227-F230 PolarHBondContact O-N 3.32Å; Q227-I231 VanDerWaalsContact O-CG1 3.31Å; Q227-I231 WeakPolarHBondContact O-CG1 3.46Å; Q227-I231 PolarHBondContact O-N 3.21Å
228	R	69	Low	65.5	Low	164 Å²	164	94 Å²	94	62%	0.619	46%	0.455	S	S	*	.	H	α-helix	trans	-63.8	-39.4	174.3	-75.8	168.2	176.8	171.1	-2.2	112.5	M224 N225 I226 I231 K232	M224-R228 WeakPolarHBondContact O-CB 3.39Å; M224-R228 WeakPolarHBondContact O-CD 3.43Å; M224-R228 WeakPolarHBondContact O-CG 3.39Å; M224-R228 PolarHBondContact O-N 3.24Å; N225-R228 PolarHBondContact O-N 3.47Å; I226-R228 PolarHBondContact O-N 3.48Å; R228-I231 PolarHBondContact O-N 3.12Å; R228-K232 VanDerWaalsContact O-CB 3.32Å; R228-K232 WeakPolarHBondContact O-CB 3.31Å; R228-K232 PolarHBondContact O-N 3.4Å
229	L	65.3	Low	65.7	Low	119 Å²	119	95.1 Å²	95.1	62%	0.623	46%	0.459	S	S	*	.	H	α-helix	trans	-63.9	-42.6	174.4	-74.4	167.8	0	0	0	111.2	N225 I226 K232 F233	N225-L229 WeakPolarHBondContact O-CB 3.3Å; N225-L229 VanDerWaalsContact O-CG 3.3Å; N225-L229 WeakPolarHBondContact O-CG 3.36Å; N225-L229 PolarHBondContact O-N 3.09Å; I226-L229 PolarHBondContact O-N 3.33Å; L229-K232 PolarHBondContact O-N 3.27Å; L229-F233 VanDerWaalsContact O-CB 3.28Å; L229-F233 WeakPolarHBondContact O-CB 3.2Å; L229-F233 PolarHBondContact O-N 3.41Å
230	F	62.9	Low	65.8	Low	75 Å²	75	95.1 Å²	95.1	33%	0.329	46%	0.459	S	S	.	.	H	α-helix	trans	-61.5	-48.5	173.2	-81.3	-58.5	0	0	0	112.7	I226 Q227 K232 F233 H234 L351	I226-F230 HydrophobicContact CG2-CD2 3.75Å; I226-F230 HydrophobicContact CG2-CE2 3.5Å; I226-F230 VanDerWaalsContact CG2-CE2 3.5Å; I226-F230 VanDerWaalsContact O-CD2 3.24Å; I226-F230 WeakPolarHBondContact O-CD2 3.41Å; I226-F230 PolarHBondContact O-N 3.16Å; Q227-F230 PolarHBondContact O-N 3.32Å; F230-K232 VanDerWaalsContact C-N 3.32Å; F230-K232 PolarHBondContact O-N 2.81Å; F230-F233 PolarHBondContact O-N 3.45Å; F230-H234 WeakPolarHBondContact O-CB 3.43Å; F230-H234 PolarHBondContact O-CD2 3.01Å; F230-H234 PolarHBondContact O-N 3.34Å; F230-L351 HydrophobicContact CD1-CD2 4.45Å; F230-L351 HydrophobicContact CE1-CD1 3.56Å; F230-L351 HydrophobicContact CE1-CD2 3.74Å; F230-L351 HydrophobicContact CE1-CG 4.18Å; F230-L351 HydrophobicContact CZ-CD1 3.82Å; F230-L351 HydrophobicContact CZ-CD2 4.45Å
231	I	67.2	Low	66	Low	119 Å²	119	95.3 Å²	95.3	61%	0.61	46%	0.462	S	S	*	.	H	α-helix	trans	-60.4	-43.8	178.2	-68.2	163.9	0	0	0	110.5	Q227 R228 H234 H235	Q227-I231 VanDerWaalsContact O-CG1 3.31Å; Q227-I231 WeakPolarHBondContact O-CG1 3.46Å; Q227-I231 PolarHBondContact O-N 3.21Å; R228-I231 PolarHBondContact O-N 3.12Å; I231-H234 PolarHBondContact O-N 3.47Å; I231-H235 VanDerWaalsContact O-CB 3.3Å; I231-H235 WeakPolarHBondContact O-CB 3.38Å; I231-H235 PolarHBondContact O-N 2.99Å
232	K	67.8	Low	66.1	Low	141 Å²	141	94.5 Å²	94.5	61%	0.613	46%	0.461	S	S	*	.	H	α-helix	trans	-65.3	-40.1	176.9	-171.3	174.8	-178.4	179.5	0	112.3	R228 L229 F230 H235 E236	R228-K232 VanDerWaalsContact O-CB 3.32Å; R228-K232 WeakPolarHBondContact O-CB 3.31Å; R228-K232 PolarHBondContact O-N 3.4Å; L229-K232 PolarHBondContact O-N 3.27Å; F230-K232 VanDerWaalsContact C-N 3.32Å; F230-K232 PolarHBondContact O-N 2.81Å; K232-H235 PolarHBondContact O-N 2.96Å; K232-E236 HydrophobicContact CG-CG 4.48Å; K232-E236 PolarHBondContact O-N 2.85Å
233	F	66.4	Low	66.3	Low	103 Å²	103	95.3 Å²	95.3	45%	0.452	46%	0.462	S	S	.	.	H	α-helix	trans	-64.3	-46.4	175.8	177.2	-98.9	0	0	0	111.7	L229 F230 H235 S237 L347	L229-F233 VanDerWaalsContact O-CB 3.28Å; L229-F233 WeakPolarHBondContact O-CB 3.2Å; L229-F233 PolarHBondContact O-N 3.41Å; F230-F233 PolarHBondContact O-N 3.45Å; F233-H235 PolarHBondContact O-N 2.79Å; F233-S237 VanDerWaalsContact O-CB 3.28Å; F233-S237 WeakPolarHBondContact O-CB 3.42Å; F233-S237 PolarHBondContact O-N 2.79Å; F233-S237 PolarHBondContact O-OG 3.39Å; F233-L347 HydrophobicContact CE1-CD2 4.36Å; F233-L347 HydrophobicContact CZ-CD2 3.97Å
234	H	63.9	Low	66.6	Low	108 Å²	108	97.3 Å²	97.3	50%	0.5	48%	0.475	S	S	.	.	H	α-helix	trans	-62.1	-41.1	174.3	-77.5	-63.2	0	0	0	112	F230 I231 S237 L238	F230-H234 WeakPolarHBondContact O-CB 3.43Å; F230-H234 PolarHBondContact O-CD2 3.01Å; F230-H234 PolarHBondContact O-N 3.34Å; I231-H234 PolarHBondContact O-N 3.47Å; H234-S237 WeakPolarHBondContact CA-OG 3.23Å; H234-S237 PolarHBondContact O-OG 3.5Å; H234-L238 WeakPolarHBondContact O-CB 3.47Å; H234-L238 PolarHBondContact O-N 3.13Å
235	H	69.9	Low	66.6	Low	113 Å²	113	97.1 Å²	97.1	52%	0.523	48%	0.479	S	S	.	.	H	α-helix	trans	-66.2	-49.3	178.2	-174.9	-89.5	0	0	0	112.7	I231 K232 F233 L238 K239	I231-H235 VanDerWaalsContact O-CB 3.3Å; I231-H235 WeakPolarHBondContact O-CB 3.38Å; I231-H235 PolarHBondContact O-N 2.99Å; K232-H235 PolarHBondContact O-N 2.96Å; F233-H235 PolarHBondContact O-N 2.79Å; H235-L238 PolarHBondContact O-N 2.96Å; H235-K239 WeakPolarHBondContact O-CB 3.36Å; H235-K239 PolarHBondContact O-N 3.41Å
236	E	69.4	Low	66.3	Low	80 Å²	80	99.7 Å²	99.7	37%	0.374	49%	0.489	S	S	.	.	H	α-helix	trans	-69.6	-34.4	179.4	-69	-61.5	152.5	0	0	112.5	K232 K239 L240	K232-E236 HydrophobicContact CG-CG 4.48Å; K232-E236 PolarHBondContact O-N 2.85Å; E236-K239 IonicContact OE1-NZ 2.65Å; E236-K239 PolarHBondContact OE1-NZ 3.34Å; E236-K239 IonicContact OE2-NZ 2.68Å; E236-K239 PolarHBondContact OE2-NZ 3.01Å; E236-L240 VanDerWaalsContact O-CB 3.28Å; E236-L240 WeakPolarHBondContact O-CB 3.36Å; E236-L240 PolarHBondContact O-N 3.05Å
237	S	60.1	Low	66.6	Low	51 Å²	51	99.1 Å²	99.1	36%	0.357	49%	0.486	S	S	.	.	H	α-helix	trans	-69.8	-39.7	174.2	56.4	0	0	0	0	112.6	F233 H234 C241	F233-S237 VanDerWaalsContact O-CB 3.28Å; F233-S237 WeakPolarHBondContact O-CB 3.42Å; F233-S237 PolarHBondContact O-N 2.79Å; F233-S237 PolarHBondContact O-OG 3.39Å; H234-S237 WeakPolarHBondContact CA-OG 3.23Å; H234-S237 PolarHBondContact O-OG 3.5Å; S237-C241 VanDerWaalsContact O-CB 3.25Å; S237-C241 WeakPolarHBondContact O-CB 3.02Å; S237-C241 PolarHBondContact O-N 3.46Å
238	L	66.1	Low	66.7	Low	108 Å²	108	100.1 Å²	100.1	57%	0.565	49%	0.486	S	S	*	.	H	α-helix	trans	-63.1	-45.6	171.7	-170.7	99.6	0	0	0	111.1	H234 H235 C241 I242	H234-L238 WeakPolarHBondContact O-CB 3.47Å; H234-L238 PolarHBondContact O-N 3.13Å; H235-L238 PolarHBondContact O-N 2.96Å; L238-C241 WeakPolarHBondContact O-CB 3.32Å; L238-C241 PolarHBondContact O-N 3.45Å; L238-I242 HydrophobicContact CD2-CD1 3.8Å; L238-I242 HydrophobicContact CG-CD1 3.9Å; L238-I242 WeakPolarHBondContact O-CB 3.42Å; L238-I242 VanDerWaalsContact O-CG1 3.32Å; L238-I242 WeakPolarHBondContact O-CG1 3.25Å; L238-I242 PolarHBondContact O-N 2.93Å
239	K	71.9	Confident	66.4	Low	96 Å²	96	99.1 Å²	99.1	42%	0.417	48%	0.484	S	S	.	.	H	α-helix	trans	-61.9	-44	177.4	174.1	179.2	154.9	-145.7	0	112.3	H235 E236 C241 I242 Q243	H235-K239 WeakPolarHBondContact O-CB 3.36Å; H235-K239 PolarHBondContact O-N 3.41Å; E236-K239 IonicContact OE1-NZ 2.65Å; E236-K239 PolarHBondContact OE1-NZ 3.34Å; E236-K239 IonicContact OE2-NZ 2.68Å; E236-K239 PolarHBondContact OE2-NZ 3.01Å; K239-C241 VanDerWaalsContact C-N 3.34Å; K239-I242 PolarHBondContact O-N 3.25Å; K239-Q243 VanDerWaalsContact O-CB 3.3Å; K239-Q243 WeakPolarHBondContact O-CB 3.41Å; K239-Q243 PolarHBondContact O-N 2.72Å
240	L	66.9	Low	66.2	Low	99 Å²	99	99.8 Å²	99.8	52%	0.518	48%	0.483	S	S	.	.	H	α-helix	trans	-66.9	-36.3	175.6	-171.4	68.7	0	0	0	111.6	E236 N244	E236-L240 VanDerWaalsContact O-CB 3.28Å; E236-L240 WeakPolarHBondContact O-CB 3.36Å; E236-L240 PolarHBondContact O-N 3.05Å; L240-N244 VanDerWaalsContact O-CB 3.31Å; L240-N244 WeakPolarHBondContact O-CB 3.32Å; L240-N244 VanDerWaalsContact O-CG 3.28Å; L240-N244 PolarHBondContact O-N 3.46Å; L240-N244 PolarHBondContact O-ND2 3.5Å
241	C	65.2	Low	66.2	Low	70 Å²	70	101.4 Å²	101.4	47%	0.473	50%	0.496	S	S	.	.	H	α-helix	trans	-63.2	-50.8	172.6	-175.6	0	0	0	0	111.2	S237 L238 K239 Q243 N244 V245	S237-C241 VanDerWaalsContact O-CB 3.25Å; S237-C241 WeakPolarHBondContact O-CB 3.02Å; S237-C241 PolarHBondContact O-N 3.46Å; L238-C241 WeakPolarHBondContact O-CB 3.32Å; L238-C241 PolarHBondContact O-N 3.45Å; K239-C241 VanDerWaalsContact C-N 3.34Å; C241-Q243 PolarHBondContact O-N 3.42Å; C241-N244 PolarHBondContact O-N 2.82Å; C241-V245 WeakPolarHBondContact O-CB 3.37Å; C241-V245 VanDerWaalsContact O-CG2 3.32Å; C241-V245 WeakPolarHBondContact O-CG2 3.41Å; C241-V245 PolarHBondContact O-N 2.9Å
242	I	69.5	Low	65.7	Low	79 Å²	79	97.6 Å²	97.6	41%	0.405	48%	0.475	S	S	.	.	H	α-helix	trans	-59.3	-45.5	176.3	-70.3	166.7	0	0	0	110.7	L238 K239 N244 V245 Q246	L238-I242 HydrophobicContact CD2-CD1 3.8Å; L238-I242 HydrophobicContact CG-CD1 3.9Å; L238-I242 WeakPolarHBondContact O-CB 3.42Å; L238-I242 VanDerWaalsContact O-CG1 3.32Å; L238-I242 WeakPolarHBondContact O-CG1 3.25Å; L238-I242 PolarHBondContact O-N 2.93Å; K239-I242 PolarHBondContact O-N 3.25Å; I242-N244 PolarHBondContact O-N 2.98Å; I242-V245 PolarHBondContact O-N 3.43Å; I242-Q246 HydrophobicContact CG2-CG 4.21Å; I242-Q246 VanDerWaalsContact O-CB 3.32Å; I242-Q246 WeakPolarHBondContact O-CB 3.42Å; I242-Q246 VanDerWaalsContact O-CG 3.28Å; I242-Q246 WeakPolarHBondContact O-CG 3.47Å; I242-Q246 PolarHBondContact O-N 3.23Å
243	Q	70.4	Confident	65.2	Low	94 Å²	94	93.7 Å²	93.7	44%	0.439	46%	0.46	S	S	.	.	H	α-helix	trans	-65.6	-37.8	179.3	-171.7	174.5	6.2	0	0	112.1	K239 C241 Q246 N247	K239-Q243 VanDerWaalsContact O-CB 3.3Å; K239-Q243 WeakPolarHBondContact O-CB 3.41Å; K239-Q243 PolarHBondContact O-N 2.72Å; C241-Q243 PolarHBondContact O-N 3.42Å; Q243-Q246 PolarHBondContact O-N 2.83Å; Q243-N247 VanDerWaalsContact O-CB 3.28Å; Q243-N247 WeakPolarHBondContact O-CB 3.35Å; Q243-N247 PolarHBondContact O-N 3.37Å; Q243-N247 PolarHBondContact O-ND2 3.42Å
244	N	67.3	Low	64.7	Low	94 Å²	94	93.8 Å²	93.8	50%	0.503	46%	0.462	S	S	.	.	H	α-helix	trans	-68.4	-40.4	173.4	-76.7	-18.5	0	0	0	111.9	L240 C241 I242 W248	L240-N244 VanDerWaalsContact O-CB 3.31Å; L240-N244 WeakPolarHBondContact O-CB 3.32Å; L240-N244 VanDerWaalsContact O-CG 3.28Å; L240-N244 PolarHBondContact O-N 3.46Å; L240-N244 PolarHBondContact O-ND2 3.5Å; C241-N244 PolarHBondContact O-N 2.82Å; I242-N244 PolarHBondContact O-N 2.98Å; N244-W248 WeakPolarHBondContact O-CB 3.43Å; N244-W248 PolarHBondContact O-N 3.25Å
245	V	64.2	Low	64.2	Low	83 Å²	83	91 Å²	91	50%	0.503	45%	0.447	S	S	.	.	H	α-helix	trans	-66	-37.5	174.7	170.2	0	0	0	0	111.4	C241 I242 Y249	C241-V245 WeakPolarHBondContact O-CB 3.37Å; C241-V245 VanDerWaalsContact O-CG2 3.32Å; C241-V245 WeakPolarHBondContact O-CG2 3.41Å; C241-V245 PolarHBondContact O-N 2.9Å; I242-V245 PolarHBondContact O-N 3.43Å; V245-Y249 WeakPolarHBondContact O-CB 3.42Å; V245-Y249 PolarHBondContact O-N 2.73Å
246	Q	64.7	Low	63.5	Low	118 Å²	118	92 Å²	92	55%	0.551	45%	0.45	S	S	*	.	H	α-helix	trans	-69.2	-46.8	174.8	-77	175.5	-23.4	0	0	112	I242 Q243 W248 Y249 H250	I242-Q246 HydrophobicContact CG2-CG 4.21Å; I242-Q246 VanDerWaalsContact O-CB 3.32Å; I242-Q246 WeakPolarHBondContact O-CB 3.42Å; I242-Q246 VanDerWaalsContact O-CG 3.28Å; I242-Q246 WeakPolarHBondContact O-CG 3.47Å; I242-Q246 PolarHBondContact O-N 3.23Å; Q243-Q246 PolarHBondContact O-N 2.83Å; Q246-W248 VanDerWaalsContact C-N 3.3Å; Q246-W248 PolarHBondContact O-N 3.35Å; Q246-Y249 PolarHBondContact O-N 3.07Å; Q246-H250 VanDerWaalsContact O-CB 3.29Å; Q246-H250 WeakPolarHBondContact O-CB 3.44Å; Q246-H250 PolarHBondContact O-N 3.12Å
247	N	69.1	Low	62.9	Low	81 Å²	81	92.7 Å²	92.7	43%	0.433	46%	0.456	S	S	.	.	H	α-helix	trans	-60.5	-41.6	174.7	-76.1	-15.4	0	0	0	111.2	Q243 N251	Q243-N247 VanDerWaalsContact O-CB 3.28Å; Q243-N247 WeakPolarHBondContact O-CB 3.35Å; Q243-N247 PolarHBondContact O-N 3.37Å; Q243-N247 PolarHBondContact O-ND2 3.42Å; N247-N251 VanDerWaalsContact O-CB 3.29Å; N247-N251 WeakPolarHBondContact O-CB 3.41Å; N247-N251 PolarHBondContact O-N 3.43Å; N247-N251 PolarHBondContact O-ND2 3.48Å
248	W	63.6	Low	63	Low	107 Å²	107	93 Å²	93	41%	0.405	45%	0.454	S	S	.	.	H	α-helix	trans	-60	-58.5	172.7	-179.2	73.7	0	0	0	110.2	N244 Q246 H250 N251 E252 F329 L333	N244-W248 WeakPolarHBondContact O-CB 3.43Å; N244-W248 PolarHBondContact O-N 3.25Å; Q246-W248 VanDerWaalsContact C-N 3.3Å; Q246-W248 PolarHBondContact O-N 3.35Å; W248-H250 VanDerWaalsContact C-N 3.26Å; W248-H250 PolarHBondContact O-N 3.48Å; W248-H250 VanDerWaalsContact O-N 3.17Å; W248-N251 PolarHBondContact O-N 3.1Å; W248-E252 HydrophobicContact CD2-CG 3.95Å; W248-E252 HydrophobicContact CG-CG 4.02Å; W248-E252 HydrophobicContact CZ2-CG 3.96Å; W248-E252 VanDerWaalsContact NE1-CD 3.31Å; W248-E252 PolarHBondContact NE1-OE1 2.94Å; W248-E252 WeakPolarHBondContact O-CB 3Å; W248-E252 WeakPolarHBondContact O-CG 3.4Å; W248-E252 PolarHBondContact O-N 2.76Å; W248-F329 HydrophobicContact CZ2-CZ 4.28Å; W248-L333 HydrophobicContact CH2-CD1 3.82Å; W248-L333 HydrophobicContact CH2-CD2 4.41Å; W248-L333 HydrophobicContact CH2-CG 4.24Å; W248-L333 HydrophobicContact CZ2-CD1 3.61Å; W248-L333 HydrophobicContact CZ2-CD2 4.25Å; W248-L333 HydrophobicContact CZ2-CG 3.74Å
249	Y	62.2	Low	62.7	Low	143 Å²	143	89.6 Å²	89.6	56%	0.561	44%	0.436	S	S	*	.	H	α-helix	trans	-53.4	-38.8	178.2	-173.7	-98.2	0	0	0	113.3	V245 Q246 I253	V245-Y249 WeakPolarHBondContact O-CB 3.42Å; V245-Y249 PolarHBondContact O-N 2.73Å; Q246-Y249 PolarHBondContact O-N 3.07Å; Y249-I253 HydrophobicContact CD1-CD1 3.96Å; Y249-I253 HydrophobicContact CD2-CD1 3.79Å; Y249-I253 HydrophobicContact CE1-CD1 3.59Å; Y249-I253 HydrophobicContact CE2-CD1 3.4Å; Y249-I253 VanDerWaalsContact CE2-CD1 3.4Å; Y249-I253 HydrophobicContact CG-CD1 4.05Å; Y249-I253 VanDerWaalsContact O-CB 3.25Å; Y249-I253 WeakPolarHBondContact O-CB 3.46Å; Y249-I253 WeakPolarHBondContact O-CG1 3.3Å; Y249-I253 PolarHBondContact O-N 3.23Å
250	H	61.5	Low	62.1	Low	134 Å²	134	90.6 Å²	90.6	62%	0.62	44%	0.443	S	S	*	.	H	α-helix	trans	-75.9	-42.2	-179.2	-150	59.1	0	0	0	112.6	Q246 W248 Q254	Q246-H250 VanDerWaalsContact O-CB 3.29Å; Q246-H250 WeakPolarHBondContact O-CB 3.44Å; Q246-H250 PolarHBondContact O-N 3.12Å; W248-H250 VanDerWaalsContact C-N 3.26Å; W248-H250 PolarHBondContact O-N 3.48Å; W248-H250 VanDerWaalsContact O-N 3.17Å; H250-Q254 WeakPolarHBondContact O-CB 2.98Å; H250-Q254 WeakPolarHBondContact O-CG 2.94Å; H250-Q254 PolarHBondContact O-N 3.2Å
251	N	62.1	Low	61.8	Low	109 Å²	109	91.7 Å²	91.7	58%	0.583	44%	0.444	S	S	*	.	H	α-helix	trans	-68.5	-35.6	174.7	-68.2	-20.5	0	0	0	112	N247 W248 Q254 W255	N247-N251 VanDerWaalsContact O-CB 3.29Å; N247-N251 WeakPolarHBondContact O-CB 3.41Å; N247-N251 PolarHBondContact O-N 3.43Å; N247-N251 PolarHBondContact O-ND2 3.48Å; W248-N251 PolarHBondContact O-N 3.1Å; N251-Q254 WeakPolarHBondContact O-CB 3.17Å; N251-W255 PolarHBondContact O-N 3.34Å
252	E	57.4	Low	61.5	Low	39 Å²	39	91.6 Å²	91.6	18%	0.182	44%	0.438	C	S	.	.	H	α-helix	trans	-75	-34.6	179.4	-64.4	-89.3	178.9	0	0	111.6	W248 W255 K256 F329	W248-E252 HydrophobicContact CD2-CG 3.95Å; W248-E252 HydrophobicContact CG-CG 4.02Å; W248-E252 HydrophobicContact CZ2-CG 3.96Å; W248-E252 VanDerWaalsContact NE1-CD 3.31Å; W248-E252 PolarHBondContact NE1-OE1 2.94Å; W248-E252 WeakPolarHBondContact O-CB 3Å; W248-E252 WeakPolarHBondContact O-CG 3.4Å; W248-E252 PolarHBondContact O-N 2.76Å; E252-W255 VanDerWaalsContact CA-CD1 3.47Å; E252-W255 VanDerWaalsContact O-CG 3.24Å; E252-W255 PolarHBondContact O-N 3Å; E252-W255 PolarHBondContact O-NE1 3.22Å; E252-W255 PolarHBondContact OE2-NE1 3.34Å; E252-K256 PolarHBondContact O-N 3.25Å; E252-F329 WeakPolarHBondContact OE2-CE2 3.4Å; E252-F329 WeakPolarHBondContact OE2-CZ 3.29Å
253	I	57.3	Low	61	Low	58 Å²	58	92.1 Å²	92.1	30%	0.297	44%	0.441	S	S	.	.	H	α-helix	trans	-84.4	-21.7	175.5	-66.4	175.4	0	0	0	112.4	Y249 K256 N257	Y249-I253 HydrophobicContact CD1-CD1 3.96Å; Y249-I253 HydrophobicContact CD2-CD1 3.79Å; Y249-I253 HydrophobicContact CE1-CD1 3.59Å; Y249-I253 HydrophobicContact CE2-CD1 3.4Å; Y249-I253 VanDerWaalsContact CE2-CD1 3.4Å; Y249-I253 HydrophobicContact CG-CD1 4.05Å; Y249-I253 VanDerWaalsContact O-CB 3.25Å; Y249-I253 WeakPolarHBondContact O-CB 3.46Å; Y249-I253 WeakPolarHBondContact O-CG1 3.3Å; Y249-I253 PolarHBondContact O-N 3.23Å; I253-K256 PolarHBondContact O-N 2.96Å; I253-N257 PolarHBondContact O-N 2.98Å
254	Q	55.1	Low	60.5	Low	105 Å²	105	93.7 Å²	93.7	49%	0.491	45%	0.452	S	S	.	.	H	α-helix	trans	-55.4	-50.6	160.6	-88.1	-110.3	-84	0	0	110.8	H250 N251 K256 N257 D258	H250-Q254 WeakPolarHBondContact O-CB 2.98Å; H250-Q254 WeakPolarHBondContact O-CG 2.94Å; H250-Q254 PolarHBondContact O-N 3.2Å; N251-Q254 WeakPolarHBondContact O-CB 3.17Å; Q254-K256 VanDerWaalsContact C-N 3.29Å; Q254-K256 PolarHBondContact O-N 3.44Å; Q254-N257 PolarHBondContact O-N 3.43Å; Q254-N257 VanDerWaalsContact O-N 3.16Å; Q254-D258 PolarHBondContact O-N 3.42Å
255	W	54.9	Low	60	Low	50 Å²	50	98.1 Å²	98.1	19%	0.189	46%	0.463	C	S	.	.	H	α-helix	trans	-66.5	-30.8	176.9	78.5	-115.3	0	0	0	112.8	N251 E252 N257 D258 I259 F282 F325 F329	N251-W255 PolarHBondContact O-N 3.34Å; E252-W255 VanDerWaalsContact CA-CD1 3.47Å; E252-W255 VanDerWaalsContact O-CG 3.24Å; E252-W255 PolarHBondContact O-N 3Å; E252-W255 PolarHBondContact O-NE1 3.22Å; E252-W255 PolarHBondContact OE2-NE1 3.34Å; W255-N257 VanDerWaalsContact C-N 3.34Å; W255-N257 PolarHBondContact O-N 3.35Å; W255-D258 PolarHBondContact O-N 3.39Å; W255-I259 HydrophobicContact CE3-CB 4.4Å; W255-I259 HydrophobicContact CE3-CD1 3.57Å; W255-I259 HydrophobicContact CE3-CG1 4.04Å; W255-I259 HydrophobicContact CZ3-CD1 3.89Å; W255-I259 VanDerWaalsContact O-CB 3.29Å; W255-I259 WeakPolarHBondContact O-CB 3.49Å; W255-I259 WeakPolarHBondContact O-CG1 3.38Å; W255-I259 PolarHBondContact O-N 3.38Å; W255-F282 HydrophobicContact CB-CZ 4.2Å; W255-F325 AromaticContact CH2-CE1 3.96Å; W255-F325 HydrophobicContact CH2-CE1 3.96Å; W255-F325 HydrophobicContact CZ2-CE1 4.37Å; W255-F325 HydrophobicContact CZ3-CE1 4.3Å; W255-F329 HydrophobicContact CZ2-CE1 4.44Å; W255-F329 HydrophobicContact CZ2-CE2 4.38Å; W255-F329 HydrophobicContact CZ2-CZ 4.18Å
256	K	54.1	Low	59.5	Low	134 Å²	134	99.5 Å²	99.5	58%	0.583	46%	0.459	S	S	*	.	H	α-helix	trans	-61.3	-43.4	172.6	-126.8	-179.2	-172.2	-177.7	0	111.6	E252 I253 Q254 M260	E252-K256 PolarHBondContact O-N 3.25Å; I253-K256 PolarHBondContact O-N 2.96Å; Q254-K256 VanDerWaalsContact C-N 3.29Å; Q254-K256 PolarHBondContact O-N 3.44Å; K256-M260 WeakPolarHBondContact O-CB 3.4Å; K256-M260 PolarHBondContact O-N 2.9Å
257	N	58.2	Low	58.7	Low	94 Å²	94	95.7 Å²	95.7	50%	0.503	45%	0.451	S	S	.	.	H	α-helix	trans	-70	-36	175.1	-77	-23.6	0	0	0	113	I253 Q254 W255 M260 K261	I253-N257 PolarHBondContact O-N 2.98Å; Q254-N257 PolarHBondContact O-N 3.43Å; Q254-N257 VanDerWaalsContact O-N 3.16Å; W255-N257 VanDerWaalsContact C-N 3.34Å; W255-N257 PolarHBondContact O-N 3.35Å; N257-M260 WeakPolarHBondContact O-CB 3.43Å; N257-M260 PolarHBondContact O-N 2.9Å; N257-K261 WeakPolarHBondContact O-CG 3.42Å; N257-K261 PolarHBondContact O-N 3.35Å
258	D	61.6	Low	57.8	Low	59 Å²	59	102.3 Å²	102.3	32%	0.316	48%	0.477	S	S	.	.	H	α-helix	trans	-78.6	-32.5	179.5	-69.3	-25	0	0	0	112.5	Q254 W255 K261 I262	Q254-D258 PolarHBondContact O-N 3.42Å; W255-D258 PolarHBondContact O-N 3.39Å; D258-K261 WeakPolarHBondContact O-CB 3.39Å; D258-K261 PolarHBondContact O-N 2.88Å; D258-K261 WeakPolarHBondContact OD1-CD 3.4Å; D258-K261 WeakPolarHBondContact OD1-CE 3.37Å; D258-K261 IonicContact OD1-NZ 3.51Å; D258-K261 PolarHBondContact OD1-NZ 3.11Å; D258-I262 WeakPolarHBondContact O-CB 3.46Å; D258-I262 WeakPolarHBondContact O-CD1 3.25Å; D258-I262 WeakPolarHBondContact O-CG1 3.44Å; D258-I262 PolarHBondContact O-N 3.15Å
259	I	59.3	Low	56.8	Low	35 Å²	35	101.3 Å²	101.3	18%	0.179	49%	0.486	C	S	.	.	H	α-helix	trans	-65.8	-39.3	164.6	-71.3	-167.8	0	0	0	110.1	W255 K261 I262 L263 F282	W255-I259 HydrophobicContact CE3-CB 4.4Å; W255-I259 HydrophobicContact CE3-CD1 3.57Å; W255-I259 HydrophobicContact CE3-CG1 4.04Å; W255-I259 HydrophobicContact CZ3-CD1 3.89Å; W255-I259 VanDerWaalsContact O-CB 3.29Å; W255-I259 WeakPolarHBondContact O-CB 3.49Å; W255-I259 WeakPolarHBondContact O-CG1 3.38Å; W255-I259 PolarHBondContact O-N 3.38Å; I259-K261 VanDerWaalsContact C-N 3.32Å; I259-K261 PolarHBondContact O-N 3.23Å; I259-I262 PolarHBondContact O-N 3.45Å; I259-I262 VanDerWaalsContact O-N 3.17Å; I259-L263 HydrophobicContact CG2-CD1 3.74Å; I259-L263 HydrophobicContact CG2-CG 4.08Å; I259-L263 WeakPolarHBondContact O-CB 3.36Å; I259-L263 VanDerWaalsContact O-CG 3.28Å; I259-L263 WeakPolarHBondContact O-CG 3.08Å; I259-L263 PolarHBondContact O-N 2.88Å; I259-F282 HydrophobicContact CD1-CD1 4.48Å; I259-F282 HydrophobicContact CD1-CE1 3.77Å; I259-F282 HydrophobicContact CD1-CZ 4.07Å; I259-F282 HydrophobicContact CG1-CE1 4.42Å; I259-F282 HydrophobicContact CG1-CZ 4.26Å
260	M	59	Low	56	Low	117 Å²	117	100.5 Å²	100.5	58%	0.576	49%	0.49	S	S	*	.	H	α-helix	trans	-60.4	-42.9	173	-153.3	73.6	141.4	0	0	111.2	K256 N257 L263 I264	K256-M260 WeakPolarHBondContact O-CB 3.4Å; K256-M260 PolarHBondContact O-N 2.9Å; N257-M260 WeakPolarHBondContact O-CB 3.43Å; N257-M260 PolarHBondContact O-N 2.9Å; M260-L263 PolarHBondContact O-N 2.03Å; M260-I264 HydrophobicContact CG-CD1 4.09Å; M260-I264 WeakPolarHBondContact O-CB 3.07Å; M260-I264 WeakPolarHBondContact O-CD1 3.48Å; M260-I264 WeakPolarHBondContact O-CG1 3.39Å; M260-I264 PolarHBondContact O-N 2.02Å
261	K	61.3	Low	55.6	Low	123 Å²	123	98.1 Å²	98.1	54%	0.535	48%	0.482	S	S	.	.	H	α-helix	trans	-61.8	-42.5	171.9	-71.1	171.3	-162.4	159.3	0	112.3	N257 D258 I259 I264 Y265	N257-K261 WeakPolarHBondContact O-CG 3.42Å; N257-K261 PolarHBondContact O-N 3.35Å; D258-K261 WeakPolarHBondContact O-CB 3.39Å; D258-K261 PolarHBondContact O-N 2.88Å; D258-K261 WeakPolarHBondContact OD1-CD 3.4Å; D258-K261 WeakPolarHBondContact OD1-CE 3.37Å; D258-K261 IonicContact OD1-NZ 3.51Å; D258-K261 PolarHBondContact OD1-NZ 3.11Å; I259-K261 VanDerWaalsContact C-N 3.32Å; I259-K261 PolarHBondContact O-N 3.23Å; K261-I264 PolarHBondContact O-N 3.09Å; K261-Y265 WeakPolarHBondContact O-CB 3.15Å; K261-Y265 PolarHBondContact O-N 3.04Å
262	I	59.6	Low	55.3	Low	68 Å²	68	96.5 Å²	96.5	35%	0.349	48%	0.478	S	S	.	.	H	α-helix	trans	-63.7	-44.1	177.8	-72.8	162.4	0	0	0	110.4	D258 I259 I264 Y265 Y266	D258-I262 WeakPolarHBondContact O-CB 3.46Å; D258-I262 WeakPolarHBondContact O-CD1 3.25Å; D258-I262 WeakPolarHBondContact O-CG1 3.44Å; D258-I262 PolarHBondContact O-N 3.15Å; I259-I262 PolarHBondContact O-N 3.45Å; I259-I262 VanDerWaalsContact O-N 3.17Å; I262-I264 VanDerWaalsContact C-N 3.34Å; I262-I264 PolarHBondContact O-N 3Å; I262-Y265 PolarHBondContact O-N 3.18Å; I262-Y266 HydrophobicContact CG2-CD2 3.96Å; I262-Y266 HydrophobicContact CG2-CE2 4.43Å; I262-Y266 WeakPolarHBondContact O-CB 3.35Å; I262-Y266 WeakPolarHBondContact O-CD2 3.42Å; I262-Y266 PolarHBondContact O-N 2.65Å
263	L	58.7	Low	55.5	Low	89 Å²	89	98.7 Å²	98.7	47%	0.466	49%	0.494	S	S	.	.	H	α-helix	trans	-67.5	-31.2	176.9	-69.5	171.2	0	0	0	113	I259 M260 G267	I259-L263 HydrophobicContact CG2-CD1 3.74Å; I259-L263 HydrophobicContact CG2-CG 4.08Å; I259-L263 WeakPolarHBondContact O-CB 3.36Å; I259-L263 VanDerWaalsContact O-CG 3.28Å; I259-L263 WeakPolarHBondContact O-CG 3.08Å; I259-L263 PolarHBondContact O-N 2.88Å; M260-L263 PolarHBondContact O-N 2.03Å; L263-G267 WeakPolarHBondContact O-CA 3.29Å; L263-G267 PolarHBondContact O-N 3.19Å
264	I	59.9	Low	55.7	Low	128 Å²	128	100 Å²	100	66%	0.656	50%	0.501	S	S	*	.	H	α-helix	trans	-76.7	-41.7	173.4	-70.7	165.2	0	0	0	111	M260 K261 I262 G267	M260-I264 HydrophobicContact CG-CD1 4.09Å; M260-I264 WeakPolarHBondContact O-CB 3.07Å; M260-I264 WeakPolarHBondContact O-CD1 3.48Å; M260-I264 WeakPolarHBondContact O-CG1 3.39Å; M260-I264 PolarHBondContact O-N 2.02Å; K261-I264 PolarHBondContact O-N 3.09Å; I262-I264 VanDerWaalsContact C-N 3.34Å; I262-I264 PolarHBondContact O-N 3Å; I264-G267 PolarHBondContact O-N 3.38Å; I264-G267 VanDerWaalsContact O-N 3.16Å
265	Y	57.5	Low	55.8	Low	187 Å²	187	97.5 Å²	97.5	73%	0.733	49%	0.489	S	S	*	.	H	α-helix	trans	-72.5	-40	-176.9	-175.8	-95.1	0	0	0	112.5	K261 I262 G267	K261-Y265 WeakPolarHBondContact O-CB 3.15Å; K261-Y265 PolarHBondContact O-N 3.04Å; I262-Y265 PolarHBondContact O-N 3.18Å; Y265-G267 PolarHBondContact O-N 2.96Å
266	Y	53	Low	56	Low	112 Å²	112	100.2 Å²	100.2	44%	0.439	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	28.6	167.5	-64.2	-77.4	0	0	0	111.7	I262 F268	I262-Y266 HydrophobicContact CG2-CD2 3.96Å; I262-Y266 HydrophobicContact CG2-CE2 4.43Å; I262-Y266 WeakPolarHBondContact O-CB 3.35Å; I262-Y266 WeakPolarHBondContact O-CD2 3.42Å; I262-Y266 PolarHBondContact O-N 2.65Å; Y266-F268 PolarHBondContact O-N 3.41Å
267	G	47.8	Very low	56.6	Low	37 Å²	37	97.1 Å²	97.1	38%	0.381	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	107	-178.6	0	0	0	0	0	112	L263 I264 Y265 S269	L263-G267 WeakPolarHBondContact O-CA 3.29Å; L263-G267 PolarHBondContact O-N 3.19Å; I264-G267 PolarHBondContact O-N 3.38Å; I264-G267 VanDerWaalsContact O-N 3.16Å; Y265-G267 PolarHBondContact O-N 2.96Å; G267-S269 VanDerWaalsContact C-N 3.28Å; G267-S269 PolarHBondContact O-N 3.44Å; G267-S269 VanDerWaalsContact O-N 3.16Å
268	F	49.1	Very low	56.8	Low	220 Å²	220	96.9 Å²	96.9	97%	0.965	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	19.9	169.9	-69	-86.6	0	0	0	117.4	Y266	Y266-F268 PolarHBondContact O-N 3.41Å
269	S	43.5	Very low	56.8	Low	87 Å²	87	95.6 Å²	95.6	61%	0.608	48%	0.48	S	S	*	.			trans	-150.7	155.8	173.4	-161.3	0	0	0	0	114.6	G267	G267-S269 VanDerWaalsContact C-N 3.28Å; G267-S269 PolarHBondContact O-N 3.44Å; G267-S269 VanDerWaalsContact O-N 3.16Å
270	I	45.3	Very low	57	Low	126 Å²	126	98.1 Å²	98.1	65%	0.646	49%	0.491	S	S	*	.	S	Bend	trans	77.7	100.8	173.4	-48.4	171	0	0	0	116.4
271	N	53.5	Low	57.3	Low	84 Å²	84	97.5 Å²	97.5	45%	0.449	49%	0.485	S	S	.	.			trans	42.6	108	154.3	-164.9	-10.1	0	0	0	118.9	V273 N274 F275	N271-V273 PolarHBondContact O-N 3.41Å; N271-V273 VanDerWaalsContact O-N 3.11Å; N271-V273 WeakPolarHBondContact OD1-CB 3.32Å; N271-V273 WeakPolarHBondContact OD1-CG2 3.42Å; N271-V273 PolarHBondContact OD1-N 3.19Å; N271-N274 PolarHBondContact O-N 3.08Å; N271-N274 VanDerWaalsContact O-N 3.07Å; N271-F275 PolarHBondContact O-N 2.87Å
272	P	56	Low	57.2	Low	75 Å²	75	94 Å²	94	49%	0.487	47%	0.47	S	S	.	.	H	α-helix	trans	-63.3	-20.8	179.4	28	-35.8	0	0	0	114.3	F275 K276	P272-F275 PolarHBondContact O-N 3.1Å; P272-K276 WeakPolarHBondContact O-CB 3.34Å; P272-K276 PolarHBondContact O-N 2.87Å
273	V	61.1	Low	57.1	Low	85 Å²	85	92.4 Å²	92.4	52%	0.515	46%	0.462	S	S	.	.	H	α-helix	trans	-65.6	-40.6	174.8	-177.8	0	0	0	0	110.9	N271 K276 I277	N271-V273 PolarHBondContact O-N 3.41Å; N271-V273 VanDerWaalsContact O-N 3.11Å; N271-V273 WeakPolarHBondContact OD1-CB 3.32Å; N271-V273 WeakPolarHBondContact OD1-CG2 3.42Å; N271-V273 PolarHBondContact OD1-N 3.19Å; V273-K276 PolarHBondContact O-N 2.91Å; V273-I277 HydrophobicContact CG1-CD1 3.97Å; V273-I277 VanDerWaalsContact O-CG1 3.29Å; V273-I277 WeakPolarHBondContact O-CG1 3.41Å; V273-I277 PolarHBondContact O-N 3.28Å
274	N	60.8	Low	57.2	Low	85 Å²	85	95.1 Å²	95.1	46%	0.455	47%	0.472	S	S	.	.	H	α-helix	trans	-69.6	-40.6	177.5	-75.1	0.8	0	0	0	111.4	N271 K276 I277 E278	N271-N274 PolarHBondContact O-N 3.08Å; N271-N274 VanDerWaalsContact O-N 3.07Å; N274-K276 VanDerWaalsContact C-N 3.34Å; N274-K276 PolarHBondContact O-N 3.39Å; N274-I277 PolarHBondContact O-N 2.99Å; N274-E278 PolarHBondContact O-N 3.29Å
275	F	58.5	Low	57.1	Low	53 Å²	53	97.3 Å²	97.3	23%	0.232	48%	0.477	C	S	.	.	H	α-helix	trans	-59.9	-44.6	174.1	-178	-103	0	0	0	111.5	N271 P272 I277 E278 L279 N318	N271-F275 PolarHBondContact O-N 2.87Å; P272-F275 PolarHBondContact O-N 3.1Å; F275-I277 PolarHBondContact O-N 3Å; F275-E278 PolarHBondContact O-N 3.48Å; F275-L279 HydrophobicContact CE1-CD2 3.85Å; F275-L279 HydrophobicContact CZ-CD2 4.15Å; F275-L279 VanDerWaalsContact O-CB 3.26Å; F275-L279 WeakPolarHBondContact O-CB 3.31Å; F275-L279 PolarHBondContact O-N 2.86Å; F275-N318 WeakPolarHBondContact CD1-OD1 3.23Å; F275-N318 HydrophobicContact CE1-CB 4.41Å; F275-N318 WeakPolarHBondContact CE1-OD1 3.25Å
276	K	59.1	Low	56.6	Low	106 Å²	106	92 Å²	92	46%	0.461	46%	0.461	S	S	.	.	H	α-helix	trans	-58.4	-47.1	173.7	-179.4	179.2	169.6	-178.1	0	111.7	P272 V273 N274 L279 E280	P272-K276 WeakPolarHBondContact O-CB 3.34Å; P272-K276 PolarHBondContact O-N 2.87Å; V273-K276 PolarHBondContact O-N 2.91Å; N274-K276 VanDerWaalsContact C-N 3.34Å; N274-K276 PolarHBondContact O-N 3.39Å; K276-L279 PolarHBondContact O-N 3.38Å; K276-E280 WeakPolarHBondContact CE-OE1 3.5Å; K276-E280 HydrophobicContact CG-CG 4.32Å; K276-E280 IonicContact NZ-OE1 3.2Å; K276-E280 WeakPolarHBondContact O-CB 3.31Å; K276-E280 WeakPolarHBondContact O-CG 3.28Å; K276-E280 PolarHBondContact O-N 2.88Å
277	I	66.8	Low	56.2	Low	69 Å²	69	91.7 Å²	91.7	35%	0.354	47%	0.466	S	S	.	.	H	α-helix	trans	-62.4	-44	-179.2	-72.4	165.7	0	0	0	112	V273 N274 F275 E280 K281	V273-I277 HydrophobicContact CG1-CD1 3.97Å; V273-I277 VanDerWaalsContact O-CG1 3.29Å; V273-I277 WeakPolarHBondContact O-CG1 3.41Å; V273-I277 PolarHBondContact O-N 3.28Å; N274-I277 PolarHBondContact O-N 2.99Å; F275-I277 PolarHBondContact O-N 3Å; I277-E280 PolarHBondContact O-N 3.03Å; I277-K281 HydrophobicContact CG2-CD 4.36Å; I277-K281 VanDerWaalsContact O-CG 3.31Å; I277-K281 WeakPolarHBondContact O-CG 3.35Å; I277-K281 PolarHBondContact O-N 3.44Å
278	E	62.7	Low	55.8	Low	90 Å²	90	98 Å²	98	42%	0.421	48%	0.483	S	S	.	.	H	α-helix	trans	-69	-36.4	176.3	-70.8	-53.4	135.9	0	0	112.4	N274 F275 K281 F282	N274-E278 PolarHBondContact O-N 3.29Å; F275-E278 PolarHBondContact O-N 3.48Å; E278-K281 PolarHBondContact O-N 3.18Å; E278-K281 WeakPolarHBondContact OE1-CD 3.24Å; E278-K281 IonicContact OE1-NZ 2.63Å; E278-K281 PolarHBondContact OE1-NZ 3.3Å; E278-F282 WeakPolarHBondContact O-CB 3.5Å; E278-F282 PolarHBondContact O-N 3.47Å
279	L	60.7	Low	55	Low	32 Å²	32	92.1 Å²	92.1	17%	0.168	47%	0.467	C	S	.	.	H	α-helix	trans	-69.6	-33.2	175.8	-166.5	59.6	0	0	0	112.1	F275 K276 F282 N283 L321	F275-L279 HydrophobicContact CE1-CD2 3.85Å; F275-L279 HydrophobicContact CZ-CD2 4.15Å; F275-L279 VanDerWaalsContact O-CB 3.26Å; F275-L279 WeakPolarHBondContact O-CB 3.31Å; F275-L279 PolarHBondContact O-N 2.86Å; K276-L279 PolarHBondContact O-N 3.38Å; L279-F282 PolarHBondContact O-N 3.21Å; L279-N283 WeakPolarHBondContact O-CB 3.39Å; L279-N283 PolarHBondContact O-N 3.22Å; L279-N283 PolarHBondContact O-ND2 3.31Å; L279-L321 HydrophobicContact CD2-CB 4.29Å; L279-L321 HydrophobicContact CD2-CD1 4.18Å; L279-L321 HydrophobicContact CD2-CD2 3.92Å; L279-L321 HydrophobicContact CD2-CG 4.35Å; L279-L321 HydrophobicContact CG-CD2 4.49Å
280	E	63.7	Low	54.7	Low	87 Å²	87	94.6 Å²	94.6	41%	0.407	47%	0.471	S	S	.	.	H	α-helix	trans	-68.5	-42.4	170.8	-77.2	178.1	158.5	0	0	112	K276 I277 F282 N283 Q284	K276-E280 WeakPolarHBondContact CE-OE1 3.5Å; K276-E280 HydrophobicContact CG-CG 4.32Å; K276-E280 IonicContact NZ-OE1 3.2Å; K276-E280 WeakPolarHBondContact O-CB 3.31Å; K276-E280 WeakPolarHBondContact O-CG 3.28Å; K276-E280 PolarHBondContact O-N 2.88Å; I277-E280 PolarHBondContact O-N 3.03Å; E280-F282 VanDerWaalsContact C-N 3.3Å; E280-F282 PolarHBondContact O-N 2.91Å; E280-N283 PolarHBondContact O-N 3.44Å; E280-Q284 WeakPolarHBondContact O-CG 3.23Å; E280-Q284 PolarHBondContact O-N 3.01Å
281	K	66	Low	54.1	Low	105 Å²	105	95.2 Å²	95.2	46%	0.457	48%	0.475	S	S	.	.	H	α-helix	trans	-60	-40.1	170.8	-72.3	169.1	-174.1	173.7	0	111.9	I277 E278 Q284 K285	I277-K281 HydrophobicContact CG2-CD 4.36Å; I277-K281 VanDerWaalsContact O-CG 3.31Å; I277-K281 WeakPolarHBondContact O-CG 3.35Å; I277-K281 PolarHBondContact O-N 3.44Å; E278-K281 PolarHBondContact O-N 3.18Å; E278-K281 WeakPolarHBondContact OE1-CD 3.24Å; E278-K281 IonicContact OE1-NZ 2.63Å; E278-K281 PolarHBondContact OE1-NZ 3.3Å; K281-Q284 PolarHBondContact O-N 3.47Å; K281-K285 PolarHBondContact O-N 2.94Å; K281-K285 VanDerWaalsContact O-N 3.11Å
282	F	58	Low	53.1	Low	49 Å²	49	96.6 Å²	96.6	22%	0.215	49%	0.488	C	S	.	.	H	α-helix	trans	-67.8	-43.3	177.6	-168.4	-99.1	0	0	0	111.5	W255 I259 E278 L279 E280 Q284 K285 L286 F325	W255-F282 HydrophobicContact CB-CZ 4.2Å; I259-F282 HydrophobicContact CD1-CD1 4.48Å; I259-F282 HydrophobicContact CD1-CE1 3.77Å; I259-F282 HydrophobicContact CD1-CZ 4.07Å; I259-F282 HydrophobicContact CG1-CE1 4.42Å; I259-F282 HydrophobicContact CG1-CZ 4.26Å; E278-F282 WeakPolarHBondContact O-CB 3.5Å; E278-F282 PolarHBondContact O-N 3.47Å; L279-F282 PolarHBondContact O-N 3.21Å; E280-F282 VanDerWaalsContact C-N 3.3Å; E280-F282 PolarHBondContact O-N 2.91Å; F282-Q284 PolarHBondContact O-N 3.19Å; F282-K285 WeakPolarHBondContact O-CA 3.22Å; F282-K285 VanDerWaalsContact O-CB 3.27Å; F282-K285 WeakPolarHBondContact O-CB 3.23Å; F282-K285 PolarHBondContact O-N 2.93Å; F282-L286 HydrophobicContact CD1-CD1 3.87Å; F282-L286 HydrophobicContact CE1-CD1 3.4Å; F282-L286 HydrophobicContact CE1-CG 4.37Å; F282-L286 HydrophobicContact CZ-CD1 4.08Å; F282-L286 PolarHBondContact O-N 2.92Å; F282-L286 VanDerWaalsContact O-N 3.11Å; F282-F325 HydrophobicContact CE1-CZ 4.41Å
283	N	57.9	Low	51.7	Low	34 Å²	34	100.3 Å²	100.3	18%	0.182	50%	0.504	C	S	.	.	H	α-helix	trans	-59.7	-43.7	172	-81.2	-24.3	0	0	0	112.1	L279 E280 K285 L286 I287 F325	L279-N283 WeakPolarHBondContact O-CB 3.39Å; L279-N283 PolarHBondContact O-N 3.22Å; L279-N283 PolarHBondContact O-ND2 3.31Å; E280-N283 PolarHBondContact O-N 3.44Å; N283-K285 PolarHBondContact O-N 3.03Å; N283-L286 PolarHBondContact O-N 2.92Å; N283-I287 HydrophobicContact CB-CD1 4.36Å; N283-I287 WeakPolarHBondContact O-CB 3.5Å; N283-I287 VanDerWaalsContact O-CG1 3.25Å; N283-I287 WeakPolarHBondContact O-CG1 3.39Å; N283-I287 PolarHBondContact O-N 3.37Å; N283-F325 VanDerWaalsContact OD1-CD2 3.31Å; N283-F325 WeakPolarHBondContact OD1-CD2 3.14Å
284	Q	60	Low	50.3	Low	147 Å²	147	103.5 Å²	103.5	69%	0.687	52%	0.518	S	S	*	.	H	α-helix	trans	-62	-27.1	173.4	-72.9	178.4	4.4	0	0	113.2	E280 K281 F282	E280-Q284 WeakPolarHBondContact O-CG 3.23Å; E280-Q284 PolarHBondContact O-N 3.01Å; K281-Q284 PolarHBondContact O-N 3.47Å; F282-Q284 PolarHBondContact O-N 3.19Å
285	K	57.4	Low	48.9	Very low	174 Å²	174	108.4 Å²	108.4	76%	0.757	54%	0.538	S	S	*	.	H	α-helix	trans	-75	-35.5	176.9	-126.6	174.7	-176.1	177.1	0	112.8	K281 F282 N283	K281-K285 PolarHBondContact O-N 2.94Å; K281-K285 VanDerWaalsContact O-N 3.11Å; F282-K285 WeakPolarHBondContact O-CA 3.22Å; F282-K285 VanDerWaalsContact O-CB 3.27Å; F282-K285 WeakPolarHBondContact O-CB 3.23Å; F282-K285 PolarHBondContact O-N 2.93Å; N283-K285 PolarHBondContact O-N 3.03Å
286	L	49	Very low	47.7	Very low	75 Å²	75	114 Å²	114	39%	0.393	57%	0.569	S	S	.	*	H	α-helix	trans	-82.4	-39.1	175.8	-77.5	166.9	0	0	0	112.3	F282 N283 K288 F325	F282-L286 HydrophobicContact CD1-CD1 3.87Å; F282-L286 HydrophobicContact CE1-CD1 3.4Å; F282-L286 HydrophobicContact CE1-CG 4.37Å; F282-L286 HydrophobicContact CZ-CD1 4.08Å; F282-L286 PolarHBondContact O-N 2.92Å; F282-L286 VanDerWaalsContact O-N 3.11Å; N283-L286 PolarHBondContact O-N 2.92Å; L286-K288 PolarHBondContact O-N 3.32Å; L286-F325 HydrophobicContact CD1-CE2 3.51Å; L286-F325 HydrophobicContact CD1-CZ 3.64Å
287	I	44.5	Very low	46.3	Very low	105 Å²	105	116 Å²	116	54%	0.538	58%	0.584	S	S	.	*			trans	-84.3	67.9	175.5	-50.7	166.7	0	0	0	108.9	N283 P289	N283-I287 HydrophobicContact CB-CD1 4.36Å; N283-I287 WeakPolarHBondContact O-CB 3.5Å; N283-I287 VanDerWaalsContact O-CG1 3.25Å; N283-I287 WeakPolarHBondContact O-CG1 3.39Å; N283-I287 PolarHBondContact O-N 3.37Å; I287-P289 WeakPolarHBondContact O-CD 3.32Å
288	K	38.2	Very low	44.7	Very low	170 Å²	170	119.1 Å²	119.1	74%	0.739	60%	0.602	S	S	*	*			trans	-73.1	115	151	-82.3	-171.2	173.9	-177.8	0	107.1	L286 I290	L286-K288 PolarHBondContact O-N 3.32Å; K288-I290 PolarHBondContact O-N 3.25Å
289	P	32.5	Very low	43.1	Very low	97 Å²	97	121.9 Å²	121.9	63%	0.63	62%	0.62	S	S	*	*			trans	-72.2	100.5	-172.2	28.2	-34.3	0	0	0	111	I287 I291	I287-P289 WeakPolarHBondContact O-CD 3.32Å; P289-I291 VanDerWaalsContact C-N 3.28Å
290	I	37.5	Very low	41.8	Very low	138 Å²	138	126.1 Å²	126.1	71%	0.708	65%	0.647	S	S	*	*			trans	-81.9	-16.2	163.5	-61.9	176.5	0	0	0	110.1	K288	K288-I290 PolarHBondContact O-N 3.25Å
291	I	33.1	Very low	40.4	Very low	140 Å²	140	127.7 Å²	127.7	72%	0.718	66%	0.663	S	S	*	*	S	Bend	trans	-87.3	129.8	172.6	-54.8	175.5	0	0	0	108.9	P289	P289-I291 VanDerWaalsContact C-N 3.28Å
292	P	31.3	Very low	38.6	Very low	112 Å²	112	128.4 Å²	128.4	73%	0.727	68%	0.676	S	S	*	*			trans	-65.4	133.6	173.9	-20.2	32.6	0	0	0	112	N294	P292-N294 PolarHBondContact O-N 3.15Å; P292-N294 VanDerWaalsContact O-N 3.09Å
293	N	28	Very low	37.5	Very low	153 Å²	153	134 Å²	134	82%	0.818	71%	0.708	S	S	*	*			trans	-65.5	108.9	174.4	-87.8	-0.2	0	0	0	111.2
294	N	31.2	Very low	36.3	Very low	153 Å²	153	138.8 Å²	138.8	82%	0.818	73%	0.734	S	S	*	*			trans	-148.7	133.8	156	-100	-36.4	0	0	0	109.1	P292	P292-N294 PolarHBondContact O-N 3.15Å; P292-N294 VanDerWaalsContact O-N 3.09Å
295	Q	30.6	Very low	35.1	Very low	187 Å²	187	138.8 Å²	138.8	87%	0.874	74%	0.739	S	S	*	*			trans	62.1	69	172.9	-55.1	-171	-2	0	0	118.5
296	I	34.3	Very low	34	Very low	171 Å²	171	136.5 Å²	136.5	88%	0.877	74%	0.739	S	S	*	*			trans	-134.3	103.4	130.9	-55.3	-177.7	0	0	0	108.2
297	N	30	Very low	33.3	Very low	147 Å²	147	138.2 Å²	138.2	79%	0.786	75%	0.753	S	S	*	*			trans	-132.9	152.1	168.4	-113.6	7.3	0	0	0	107.9
298	N	31.3	Very low	32.8	Very low	136 Å²	136	139.8 Å²	139.8	73%	0.727	76%	0.763	S	S	*	*			trans	103.4	133.9	164.9	-53.8	-17.1	0	0	0	118.2
299	N	30.6	Very low	32.6	Very low	147 Å²	147	138.5 Å²	138.5	79%	0.786	76%	0.764	S	S	*	*			trans	65	118.6	158.1	-48.5	-15.7	0	0	0	116
300	T	32.4	Very low	32.8	Very low	121 Å²	121	138.4 Å²	138.4	74%	0.742	76%	0.758	S	S	*	*			cis	-155.6	120.4	43.2	45.7	0	0	0	0	109.9
301	T	34.3	Very low	32.9	Very low	121 Å²	121	138.3 Å²	138.3	74%	0.742	76%	0.759	S	S	*	*				42.2	104.5	91.1	58.3	0	0	0	0	115.7
302	T	28.7	Very low	33.2	Very low	119 Å²	119	137.8 Å²	137.8	73%	0.73	76%	0.758	S	S	*	*			trans	-3.3	137	146.1	49.8	0	0	0	0	119.3
303	D	33.9	Very low	33.8	Very low	166 Å²	166	134.7 Å²	134.7	89%	0.888	74%	0.738	S	S	*	*				-146.3	154.9	125.4	-103.7	-36.8	0	0	0	110.3
304	N	34.3	Very low	34.4	Very low	135 Å²	135	128.8 Å²	128.8	72%	0.722	71%	0.709	S	S	*	*			trans	-118	168	-174.5	-82.1	-31.8	0	0	0	112.2
305	N	34.8	Very low	35.1	Very low	148 Å²	148	126.3 Å²	126.3	79%	0.791	70%	0.695	S	S	*	*			trans	99	155.6	162.8	-50.1	-42.2	0	0	0	117.7
306	T	34.5	Very low	36	Very low	125 Å²	125	122.7 Å²	122.7	77%	0.767	68%	0.682	S	S	*	*			trans	51.8	82.4	-179.5	47	0	0	0	0	114.8
307	T	33.5	Very low	37	Very low	112 Å²	112	119.2 Å²	119.2	69%	0.687	66%	0.664	S	S	*	*				54.8	135.7	70.1	75.3	0	0	0	0	115.7
308	N	33.2	Very low	37.8	Very low	138 Å²	138	115 Å²	115	74%	0.738	64%	0.641	S	S	*	*	S	Bend	trans	77.2	66.6	169.1	-56.1	-12.6	0	0	0	117.2
309	N	34.6	Very low	38.8	Very low	143 Å²	143	113.1 Å²	113.1	77%	0.765	63%	0.629	S	S	*	*			trans	-175.5	45.3	136.8	-97	-38.7	0	0	0	113.7	N311 N312	N309-N311 PolarHBondContact O-N 3.36Å; N309-N312 PolarHBondContact O-N 2.86Å
310	D	37.3	Very low	40.2	Very low	95 Å²	95	113 Å²	113	51%	0.508	62%	0.622	S	S	.	*	H	α-helix	trans	-80.2	-9	-154.4	-60.6	-74.8	0	0	0	117.4	S313 S314	D310-S313 WeakPolarHBondContact CA-OG 3.27Å; D310-S313 PolarHBondContact O-OG 3.14Å; D310-S314 WeakPolarHBondContact O-CB 3.41Å; D310-S314 PolarHBondContact O-N 2.89Å; D310-S314 VanDerWaalsContact O-N 3.16Å; D310-S314 PolarHBondContact O-OG 3.35Å
311	N	39.3	Very low	41.4	Very low	136 Å²	136	108.9 Å²	108.9	73%	0.727	60%	0.595	S	S	*	*	H	α-helix	trans	-71.4	-30.7	175.5	-70.7	-3.1	0	0	0	112.4	N309 S314 I315	N309-N311 PolarHBondContact O-N 3.36Å; N311-S314 PolarHBondContact O-OG 3.1Å; N311-I315 WeakPolarHBondContact O-CD1 3.35Å; N311-I315 WeakPolarHBondContact O-CG1 3.41Å
312	N	40.2	Very low	42.2	Very low	129 Å²	129	108.2 Å²	108.2	69%	0.69	59%	0.586	S	S	*	*	H	α-helix	trans	-89.6	-27.4	177.1	-73.1	-13.9	0	0	0	112.5	N309 N316	N309-N312 PolarHBondContact O-N 2.86Å; N312-N316 PolarHBondContact O-N 3.09Å
313	S	42.8	Very low	43.8	Very low	46 Å²	46	108.4 Å²	108.4	32%	0.322	58%	0.577	S	S	.	*	H	α-helix	trans	-69.9	-45	175.7	68.5	0	0	0	0	111.4	D310 I315 N316 I317	D310-S313 WeakPolarHBondContact CA-OG 3.27Å; D310-S313 PolarHBondContact O-OG 3.14Å; S313-I315 PolarHBondContact O-N 3.19Å; S313-N316 PolarHBondContact O-N 3.45Å; S313-N316 VanDerWaalsContact O-N 3.16Å; S313-I317 WeakPolarHBondContact O-CG1 3.37Å; S313-I317 PolarHBondContact O-N 2.9Å
314	S	40.1	Very low	45.2	Very low	30 Å²	30	105.9 Å²	105.9	21%	0.21	56%	0.56	C	S	.	*	H	α-helix	trans	-61.8	-41.5	179.9	52.5	0	0	0	0	113.5	D310 N311 N316 I317 N318	D310-S314 WeakPolarHBondContact O-CB 3.41Å; D310-S314 PolarHBondContact O-N 2.89Å; D310-S314 VanDerWaalsContact O-N 3.16Å; D310-S314 PolarHBondContact O-OG 3.35Å; N311-S314 PolarHBondContact O-OG 3.1Å; S314-N316 VanDerWaalsContact C-N 3.32Å; S314-N316 PolarHBondContact O-N 3.16Å; S314-I317 PolarHBondContact O-N 2.86Å; S314-N318 WeakPolarHBondContact O-CB 3.05Å; S314-N318 PolarHBondContact O-N 3.06Å
315	I	46.3	Very low	46.2	Very low	101 Å²	101	100.9 Å²	100.9	52%	0.518	53%	0.532	S	S	.	.	H	α-helix	trans	-60.2	-42.4	173.6	-66.5	171.4	0	0	0	111.1	N311 S313 N318 M319	N311-I315 WeakPolarHBondContact O-CD1 3.35Å; N311-I315 WeakPolarHBondContact O-CG1 3.41Å; S313-I315 PolarHBondContact O-N 3.19Å; I315-N318 PolarHBondContact O-N 3Å; I315-M319 PolarHBondContact O-N 3.34Å
316	N	49.8	Very low	47.3	Very low	111 Å²	111	99.5 Å²	99.5	59%	0.594	52%	0.521	S	S	*	.	H	α-helix	trans	-69.7	-39.7	180	-162.1	0.7	0	0	0	112	N312 S313 S314 M319 K320	N312-N316 PolarHBondContact O-N 3.09Å; S313-N316 PolarHBondContact O-N 3.45Å; S313-N316 VanDerWaalsContact O-N 3.16Å; S314-N316 VanDerWaalsContact C-N 3.32Å; S314-N316 PolarHBondContact O-N 3.16Å; N316-M319 PolarHBondContact O-N 3.03Å; N316-K320 WeakPolarHBondContact O-CB 3.39Å; N316-K320 PolarHBondContact O-N 3.05Å
317	I	55	Low	48.8	Very low	98 Å²	98	100.1 Å²	100.1	50%	0.503	51%	0.513	S	S	.	.	H	α-helix	trans	-59.4	-48.3	172.7	-69.3	163.3	0	0	0	110.6	S313 S314 M319 K320 L321	S313-I317 WeakPolarHBondContact O-CG1 3.37Å; S313-I317 PolarHBondContact O-N 2.9Å; S314-I317 PolarHBondContact O-N 2.86Å; I317-M319 PolarHBondContact O-N 3.4Å; I317-K320 WeakPolarHBondContact O-CB 3.19Å; I317-K320 PolarHBondContact O-N 2.95Å; I317-L321 PolarHBondContact O-N 3.43Å
318	N	46.6	Very low	50.2	Low	58 Å²	58	99.2 Å²	99.2	31%	0.31	50%	0.504	S	S	.	.	H	α-helix	trans	-62.3	-42.1	178.4	-72.4	-10.7	0	0	0	111.8	F275 S314 I315 K320 L321 L322	F275-N318 WeakPolarHBondContact CD1-OD1 3.23Å; F275-N318 HydrophobicContact CE1-CB 4.41Å; F275-N318 WeakPolarHBondContact CE1-OD1 3.25Å; S314-N318 WeakPolarHBondContact O-CB 3.05Å; S314-N318 PolarHBondContact O-N 3.06Å; I315-N318 PolarHBondContact O-N 3Å; N318-K320 VanDerWaalsContact C-N 3.32Å; N318-K320 PolarHBondContact O-N 3.29Å; N318-L321 PolarHBondContact O-N 3.37Å; N318-L322 WeakPolarHBondContact O-CB 3.39Å; N318-L322 PolarHBondContact O-N 3.38Å
319	M	53.3	Low	51.2	Low	96 Å²	96	95.2 Å²	95.2	47%	0.473	48%	0.48	S	S	.	.	H	α-helix	trans	-65.3	-34.2	175.7	-165.8	-170.5	-65.7	0	0	112.5	I315 N316 I317 K323	I315-M319 PolarHBondContact O-N 3.34Å; N316-M319 PolarHBondContact O-N 3.03Å; I317-M319 PolarHBondContact O-N 3.4Å; M319-K323 WeakPolarHBondContact O-CG 3.4Å; M319-K323 PolarHBondContact O-N 3.31Å
320	K	59.2	Low	52.4	Low	145 Å²	145	92.3 Å²	92.3	63%	0.63	47%	0.467	S	S	*	.	H	α-helix	trans	-67.3	-44.4	175.1	-170.8	179.5	179.1	-175.2	0	111.6	N316 I317 N318 K323 E324	N316-K320 WeakPolarHBondContact O-CB 3.39Å; N316-K320 PolarHBondContact O-N 3.05Å; I317-K320 WeakPolarHBondContact O-CB 3.19Å; I317-K320 PolarHBondContact O-N 2.95Å; N318-K320 VanDerWaalsContact C-N 3.32Å; N318-K320 PolarHBondContact O-N 3.29Å; K320-K323 PolarHBondContact O-N 3.36Å; K320-E324 PolarHBondContact O-N 3.11Å; K320-E324 VanDerWaalsContact O-N 3.09Å
321	L	57	Low	53.9	Low	35 Å²	35	92.6 Å²	92.6	18%	0.183	47%	0.468	C	S	.	.	H	α-helix	trans	-65.5	-38.1	177.9	-123.7	163.8	0	0	0	111.9	L279 I317 N318 K323 E324 F325	L279-L321 HydrophobicContact CD2-CB 4.29Å; L279-L321 HydrophobicContact CD2-CD1 4.18Å; L279-L321 HydrophobicContact CD2-CD2 3.92Å; L279-L321 HydrophobicContact CD2-CG 4.35Å; L279-L321 HydrophobicContact CG-CD2 4.49Å; I317-L321 PolarHBondContact O-N 3.43Å; N318-L321 PolarHBondContact O-N 3.37Å; L321-K323 VanDerWaalsContact C-N 3.32Å; L321-K323 PolarHBondContact O-N 3.45Å; L321-E324 PolarHBondContact O-N 3.22Å; L321-F325 PolarHBondContact O-N 2.85Å
322	L	52.8	Low	54.9	Low	107 Å²	107	90 Å²	90	56%	0.56	45%	0.454	S	S	*	.	H	α-helix	trans	-61.5	-38.9	173.9	-154.4	85.6	0	0	0	112.2	N318 F325 E326	N318-L322 WeakPolarHBondContact O-CB 3.39Å; N318-L322 PolarHBondContact O-N 3.38Å; L322-F325 WeakPolarHBondContact O-CB 3.4Å; L322-F325 PolarHBondContact O-N 3.3Å; L322-E326 WeakPolarHBondContact O-CB 3.43Å; L322-E326 PolarHBondContact O-N 3.33Å
323	K	61.3	Low	55.9	Low	122 Å²	122	86.7 Å²	86.7	53%	0.53	44%	0.436	S	S	.	.	H	α-helix	trans	-71	-34.3	177.4	-74.6	171.6	178.6	173.1	0	113.2	M319 K320 L321 K327	M319-K323 WeakPolarHBondContact O-CG 3.4Å; M319-K323 PolarHBondContact O-N 3.31Å; K320-K323 PolarHBondContact O-N 3.36Å; L321-K323 VanDerWaalsContact C-N 3.32Å; L321-K323 PolarHBondContact O-N 3.45Å; K323-K327 VanDerWaalsContact O-CB 3.3Å; K323-K327 WeakPolarHBondContact O-CB 3.4Å; K323-K327 PolarHBondContact O-N 3.42Å; K323-K327 VanDerWaalsContact O-N 3.08Å
324	E	63.8	Low	57	Low	113 Å²	113	90.1 Å²	90.1	53%	0.528	45%	0.445	S	S	.	.	H	α-helix	trans	-67.7	-39.1	170.6	-74.6	-164.1	139.2	0	0	112	K320 L321 K327 N328	K320-E324 PolarHBondContact O-N 3.11Å; K320-E324 VanDerWaalsContact O-N 3.09Å; L321-E324 PolarHBondContact O-N 3.22Å; E324-K327 PolarHBondContact O-N 2.88Å; E324-N328 WeakPolarHBondContact O-CB 3.17Å; E324-N328 PolarHBondContact O-N 3.45Å
325	F	55.2	Low	58.3	Low	30 Å²	30	95.2 Å²	95.2	13%	0.132	46%	0.461	C	S	.	.	H	α-helix	trans	-60.4	-51.9	173.8	-177	-99.1	0	0	0	111.8	W255 F282 N283 L286 L321 L322 K327 N328 F329	W255-F325 AromaticContact CH2-CE1 3.96Å; W255-F325 HydrophobicContact CH2-CE1 3.96Å; W255-F325 HydrophobicContact CZ2-CE1 4.37Å; W255-F325 HydrophobicContact CZ3-CE1 4.3Å; F282-F325 HydrophobicContact CE1-CZ 4.41Å; N283-F325 VanDerWaalsContact OD1-CD2 3.31Å; N283-F325 WeakPolarHBondContact OD1-CD2 3.14Å; L286-F325 HydrophobicContact CD1-CE2 3.51Å; L286-F325 HydrophobicContact CD1-CZ 3.64Å; L321-F325 PolarHBondContact O-N 2.85Å; L322-F325 WeakPolarHBondContact O-CB 3.4Å; L322-F325 PolarHBondContact O-N 3.3Å; F325-K327 VanDerWaalsContact C-N 3.31Å; F325-K327 PolarHBondContact O-N 3.28Å; F325-N328 PolarHBondContact O-N 3Å; F325-F329 WeakPolarHBondContact O-CB 3.21Å; F325-F329 PolarHBondContact O-N 2.95Å
326	E	57.8	Low	58.9	Low	120 Å²	120	94.4 Å²	94.4	56%	0.561	45%	0.454	S	S	*	.	H	α-helix	trans	-54.7	-44.3	176.9	-178	178.6	-162.4	0	0	112.4	L322 T330	L322-E326 WeakPolarHBondContact O-CB 3.43Å; L322-E326 PolarHBondContact O-N 3.33Å; E326-T330 WeakPolarHBondContact O-CB 3.39Å; E326-T330 PolarHBondContact O-N 2.86Å; E326-T330 PolarHBondContact O-OG1 2.95Å
327	K	66.7	Low	59.3	Low	137 Å²	137	92.8 Å²	92.8	60%	0.596	45%	0.449	S	S	*	.	H	α-helix	trans	-62.8	-51.7	176.7	-177.2	-176.5	176.9	-171.1	0	112.1	K323 E324 F325 F329 T330 I331	K323-K327 VanDerWaalsContact O-CB 3.3Å; K323-K327 WeakPolarHBondContact O-CB 3.4Å; K323-K327 PolarHBondContact O-N 3.42Å; K323-K327 VanDerWaalsContact O-N 3.08Å; E324-K327 PolarHBondContact O-N 2.88Å; F325-K327 VanDerWaalsContact C-N 3.31Å; F325-K327 PolarHBondContact O-N 3.28Å; K327-F329 VanDerWaalsContact C-N 3.34Å; K327-F329 PolarHBondContact O-N 3.4Å; K327-T330 PolarHBondContact O-N 2.79Å; K327-I331 HydrophobicContact CG-CD1 4.18Å; K327-I331 VanDerWaalsContact O-CG1 3.32Å; K327-I331 WeakPolarHBondContact O-CG1 3.42Å; K327-I331 PolarHBondContact O-N 3.23Å; K327-I331 VanDerWaalsContact O-N 3.09Å
328	N	61.5	Low	59.8	Low	93 Å²	93	93 Å²	93	50%	0.497	45%	0.447	S	S	.	.	H	α-helix	trans	-65.6	-38.5	-179.1	-74	-15.5	0	0	0	111.9	E324 F325 I331 N332	E324-N328 WeakPolarHBondContact O-CB 3.17Å; E324-N328 PolarHBondContact O-N 3.45Å; F325-N328 PolarHBondContact O-N 3Å; N328-I331 PolarHBondContact O-N 3.38Å; N328-N332 PolarHBondContact O-N 2.96Å; N328-N332 VanDerWaalsContact O-N 3.14Å
329	F	54.1	Low	60.8	Low	54 Å²	54	96 Å²	96	24%	0.237	46%	0.456	C	S	.	.	H	α-helix	trans	-61.4	-47.7	174.9	-179.7	-110	0	0	0	111.6	W248 E252 W255 F325 K327 I331 N332 L333	W248-F329 HydrophobicContact CZ2-CZ 4.28Å; E252-F329 WeakPolarHBondContact OE2-CE2 3.4Å; E252-F329 WeakPolarHBondContact OE2-CZ 3.29Å; W255-F329 HydrophobicContact CZ2-CE1 4.44Å; W255-F329 HydrophobicContact CZ2-CE2 4.38Å; W255-F329 HydrophobicContact CZ2-CZ 4.18Å; F325-F329 WeakPolarHBondContact O-CB 3.21Å; F325-F329 PolarHBondContact O-N 2.95Å; K327-F329 VanDerWaalsContact C-N 3.34Å; K327-F329 PolarHBondContact O-N 3.4Å; F329-I331 VanDerWaalsContact C-N 3.31Å; F329-I331 PolarHBondContact O-N 3.45Å; F329-N332 PolarHBondContact O-N 3.32Å; F329-L333 HydrophobicContact CD1-CD1 4.47Å; F329-L333 HydrophobicContact CE1-CD1 3.76Å; F329-L333 HydrophobicContact CZ-CD1 3.96Å; F329-L333 WeakPolarHBondContact O-CB 3.38Å; F329-L333 PolarHBondContact O-N 3.48Å
330	T	61.1	Low	61.2	Low	83 Å²	83	96.3 Å²	96.3	51%	0.509	46%	0.458	S	S	.	.	H	α-helix	trans	-62.5	-37.4	178.9	-60.9	0	0	0	0	112.1	E326 K327 K334	E326-T330 WeakPolarHBondContact O-CB 3.39Å; E326-T330 PolarHBondContact O-N 2.86Å; E326-T330 PolarHBondContact O-OG1 2.95Å; K327-T330 PolarHBondContact O-N 2.79Å; T330-K334 VanDerWaalsContact O-CB 3.25Å; T330-K334 WeakPolarHBondContact O-CB 3.43Å; T330-K334 PolarHBondContact O-N 3.49Å
331	I	68.4	Low	61.3	Low	100 Å²	100	92.4 Å²	92.4	51%	0.513	44%	0.442	S	S	.	.	H	α-helix	trans	-62.2	-46.1	174.4	-69.6	164.2	0	0	0	111.2	K327 N328 F329 K334 Y335	K327-I331 HydrophobicContact CG-CD1 4.18Å; K327-I331 VanDerWaalsContact O-CG1 3.32Å; K327-I331 WeakPolarHBondContact O-CG1 3.42Å; K327-I331 PolarHBondContact O-N 3.23Å; K327-I331 VanDerWaalsContact O-N 3.09Å; N328-I331 PolarHBondContact O-N 3.38Å; F329-I331 VanDerWaalsContact C-N 3.31Å; F329-I331 PolarHBondContact O-N 3.45Å; I331-K334 PolarHBondContact O-N 3.43Å; I331-Y335 PolarHBondContact O-N 3.23Å
332	N	60.5	Low	61.8	Low	83 Å²	83	97.2 Å²	97.2	44%	0.444	46%	0.462	S	S	.	.	H	α-helix	trans	-69.8	-41	-177.8	-163	11.9	0	0	0	112.4	N328 F329 K334 Y335 H336	N328-N332 PolarHBondContact O-N 2.96Å; N328-N332 VanDerWaalsContact O-N 3.14Å; F329-N332 PolarHBondContact O-N 3.32Å; N332-K334 VanDerWaalsContact C-N 3.34Å; N332-K334 PolarHBondContact O-N 2.85Å; N332-Y335 PolarHBondContact O-N 2.86Å; N332-H336 PolarHBondContact O-N 2.93Å; N332-H336 PolarHBondContact OD1-CD2 3.21Å
333	L	60.4	Low	62.4	Low	58 Å²	58	96.6 Å²	96.6	30%	0.304	46%	0.455	S	S	.	.	H	α-helix	trans	-61.8	-42.5	175.6	-152.8	177.1	0	0	0	110.9	W248 F329 T337	W248-L333 HydrophobicContact CH2-CD1 3.82Å; W248-L333 HydrophobicContact CH2-CD2 4.41Å; W248-L333 HydrophobicContact CH2-CG 4.24Å; W248-L333 HydrophobicContact CZ2-CD1 3.61Å; W248-L333 HydrophobicContact CZ2-CD2 4.25Å; W248-L333 HydrophobicContact CZ2-CG 3.74Å; F329-L333 HydrophobicContact CD1-CD1 4.47Å; F329-L333 HydrophobicContact CE1-CD1 3.76Å; F329-L333 HydrophobicContact CZ-CD1 3.96Å; F329-L333 WeakPolarHBondContact O-CB 3.38Å; F329-L333 PolarHBondContact O-N 3.48Å; L333-T337 HydrophobicContact CD2-CG2 4.07Å; L333-T337 WeakPolarHBondContact O-CG2 3.06Å; L333-T337 PolarHBondContact O-N 2.9Å; L333-T337 VanDerWaalsContact O-N 3.09Å; L333-T337 PolarHBondContact O-OG1 3.24Å
334	K	65.5	Low	62.3	Low	118 Å²	118	94.6 Å²	94.6	51%	0.513	45%	0.453	S	S	.	.	H	α-helix	trans	-60.9	-48.3	172.1	-178	-179.2	171.8	-176.4	0	111.9	T330 I331 N332 H336 T337 E338	T330-K334 VanDerWaalsContact O-CB 3.25Å; T330-K334 WeakPolarHBondContact O-CB 3.43Å; T330-K334 PolarHBondContact O-N 3.49Å; I331-K334 PolarHBondContact O-N 3.43Å; N332-K334 VanDerWaalsContact C-N 3.34Å; N332-K334 PolarHBondContact O-N 2.85Å; K334-H336 PolarHBondContact O-N 3.45Å; K334-T337 WeakPolarHBondContact CA-OG1 3.5Å; K334-T337 PolarHBondContact O-N 3.3Å; K334-T337 PolarHBondContact O-OG1 3.41Å; K334-E338 WeakPolarHBondContact CE-OE1 3.34Å; K334-E338 HydrophobicContact CG-CG 4.34Å; K334-E338 IonicContact NZ-OE1 3.55Å; K334-E338 WeakPolarHBondContact O-CB 3.35Å; K334-E338 WeakPolarHBondContact O-CG 3.46Å; K334-E338 PolarHBondContact O-N 2.87Å
335	Y	67	Low	62.4	Low	138 Å²	138	90.2 Å²	90.2	54%	0.541	43%	0.433	S	S	.	.	H	α-helix	trans	-59.3	-45.7	179.7	179.2	-101.3	0	0	0	112.6	I331 N332 E338 Y339	I331-Y335 PolarHBondContact O-N 3.23Å; N332-Y335 PolarHBondContact O-N 2.86Å; Y335-E338 PolarHBondContact O-N 3.13Å; Y335-Y339 WeakPolarHBondContact O-CB 3.47Å; Y335-Y339 PolarHBondContact O-N 2.87Å
336	H	59.2	Low	63	Low	83 Å²	83	91.7 Å²	91.7	38%	0.384	44%	0.441	S	S	.	.	H	α-helix	trans	-66.4	-37.7	178.3	-89.3	-69.5	0	0	0	113.2	N332 K334 I340	N332-H336 PolarHBondContact O-N 2.93Å; N332-H336 PolarHBondContact OD1-CD2 3.21Å; K334-H336 PolarHBondContact O-N 3.45Å; H336-I340 WeakPolarHBondContact O-CG1 3.47Å; H336-I340 PolarHBondContact O-N 3.02Å; H336-I340 VanDerWaalsContact O-N 3.1Å
337	T	59.4	Low	63.3	Low	77 Å²	77	90.5 Å²	90.5	47%	0.472	44%	0.438	S	S	.	.	H	α-helix	trans	-70.1	-41.7	176.5	45.9	0	0	0	0	112.1	L333 K334 I340 M341	L333-T337 HydrophobicContact CD2-CG2 4.07Å; L333-T337 WeakPolarHBondContact O-CG2 3.06Å; L333-T337 PolarHBondContact O-N 2.9Å; L333-T337 VanDerWaalsContact O-N 3.09Å; L333-T337 PolarHBondContact O-OG1 3.24Å; K334-T337 WeakPolarHBondContact CA-OG1 3.5Å; K334-T337 PolarHBondContact O-N 3.3Å; K334-T337 PolarHBondContact O-OG1 3.41Å; T337-I340 PolarHBondContact O-N 2.83Å; T337-M341 WeakPolarHBondContact O-CB 3.39Å; T337-M341 PolarHBondContact O-N 3.45Å
338	E	65.6	Low	63	Low	102 Å²	102	85.6 Å²	85.6	48%	0.477	42%	0.418	S	S	.	.	H	α-helix	trans	-62	-42.4	173.2	-74.1	-179.1	159.9	0	0	111.8	K334 Y335 M341 F342	K334-E338 WeakPolarHBondContact CE-OE1 3.34Å; K334-E338 HydrophobicContact CG-CG 4.34Å; K334-E338 IonicContact NZ-OE1 3.55Å; K334-E338 WeakPolarHBondContact O-CB 3.35Å; K334-E338 WeakPolarHBondContact O-CG 3.46Å; K334-E338 PolarHBondContact O-N 2.87Å; Y335-E338 PolarHBondContact O-N 3.13Å; E338-M341 PolarHBondContact O-N 2.97Å; E338-F342 WeakPolarHBondContact O-CB 3.43Å; E338-F342 PolarHBondContact O-N 3.44Å
339	Y	66.6	Low	63.1	Low	123 Å²	123	84.1 Å²	84.1	48%	0.482	41%	0.408	S	S	.	.	H	α-helix	trans	-62.9	-44.7	177.2	178.3	-99.8	0	0	0	113	Y335 F342 K343	Y335-Y339 WeakPolarHBondContact O-CB 3.47Å; Y335-Y339 PolarHBondContact O-N 2.87Å; Y339-F342 PolarHBondContact O-N 3.12Å; Y339-K343 HydrophobicContact CE1-CG 4.42Å; Y339-K343 PolarHBondContact O-N 3.43Å
340	I	61.9	Low	63.7	Low	102 Å²	102	87.5 Å²	87.5	52%	0.523	42%	0.423	S	S	.	.	H	α-helix	trans	-64	-43.5	177	-69	168.3	0	0	0	110.3	H336 T337 F342 K343 T344	H336-I340 WeakPolarHBondContact O-CG1 3.47Å; H336-I340 PolarHBondContact O-N 3.02Å; H336-I340 VanDerWaalsContact O-N 3.1Å; T337-I340 PolarHBondContact O-N 2.83Å; I340-F342 VanDerWaalsContact C-N 3.32Å; I340-F342 PolarHBondContact O-N 2.62Å; I340-K343 PolarHBondContact O-N 3.42Å; I340-T344 PolarHBondContact O-N 2.91Å; I340-T344 PolarHBondContact O-OG1 2.99Å
341	M	60.8	Low	63.7	Low	62 Å²	62	85.8 Å²	85.8	31%	0.305	41%	0.41	S	S	.	.	H	α-helix	trans	-67.8	-31	178.6	-157.9	-176.7	75.4	0	0	112.6	T337 E338 T344 N345 N375	T337-M341 WeakPolarHBondContact O-CB 3.39Å; T337-M341 PolarHBondContact O-N 3.45Å; E338-M341 PolarHBondContact O-N 2.97Å; M341-T344 PolarHBondContact O-OG1 3.29Å; M341-N345 WeakPolarHBondContact O-CB 3.27Å; M341-N345 VanDerWaalsContact O-CG 3.3Å; M341-N345 PolarHBondContact O-N 3.47Å; M341-N345 PolarHBondContact O-ND2 3.49Å; M341-N375 HydrophobicContact CE-CB 4.18Å; M341-N375 VanDerWaalsContact CE-O 3.25Å; M341-N375 WeakPolarHBondContact CE-O 3.43Å; M341-N375 HydrophobicContact SD-CB 3.75Å
342	F	68.2	Low	63.2	Low	136 Å²	136	81.8 Å²	81.8	60%	0.596	39%	0.389	S	S	*	.	H	α-helix	trans	-65.7	-46.5	171.2	-177.4	-95.3	0	0	0	111.4	E338 Y339 I340 T344 N345 E346	E338-F342 WeakPolarHBondContact O-CB 3.43Å; E338-F342 PolarHBondContact O-N 3.44Å; Y339-F342 PolarHBondContact O-N 3.12Å; I340-F342 VanDerWaalsContact C-N 3.32Å; I340-F342 PolarHBondContact O-N 2.62Å; F342-T344 PolarHBondContact O-N 3.01Å; F342-N345 PolarHBondContact O-N 3.21Å; F342-E346 PolarHBondContact O-N 2.84Å
343	K	65.3	Low	63.2	Low	94 Å²	94	83.2 Å²	83.2	41%	0.409	39%	0.393	S	S	.	.	H	α-helix	trans	-65.5	-35.6	179.9	-92.5	-71.9	169.3	-162	0	114	Y339 I340 E346 L347	Y339-K343 HydrophobicContact CE1-CG 4.42Å; Y339-K343 PolarHBondContact O-N 3.43Å; I340-K343 PolarHBondContact O-N 3.42Å; K343-E346 IonicContact NZ-OE2 3.49Å; K343-E346 PolarHBondContact NZ-OE2 2.91Å; K343-L347 PolarHBondContact O-N 3.2Å
344	T	59.2	Low	63.1	Low	81 Å²	81	84.4 Å²	84.4	50%	0.497	40%	0.403	S	S	.	.	H	α-helix	trans	-72.3	-38.2	175.1	52.9	0	0	0	0	112.2	I340 M341 F342 L347 L348	I340-T344 PolarHBondContact O-N 2.91Å; I340-T344 PolarHBondContact O-OG1 2.99Å; M341-T344 PolarHBondContact O-OG1 3.29Å; F342-T344 PolarHBondContact O-N 3.01Å; T344-L347 PolarHBondContact O-N 3.32Å; T344-L348 WeakPolarHBondContact O-CB 3.38Å; T344-L348 PolarHBondContact O-N 3.39Å; T344-L348 VanDerWaalsContact O-N 3.13Å
345	N	65	Low	62.5	Low	20 Å²	20	80.9 Å²	80.9	11%	0.107	39%	0.392	C	S	.	.	H	α-helix	trans	-59.5	-46.7	172.2	-80.8	-43.8	0	0	0	111.8	M341 F342 L347 L348 E349	M341-N345 WeakPolarHBondContact O-CB 3.27Å; M341-N345 VanDerWaalsContact O-CG 3.3Å; M341-N345 PolarHBondContact O-N 3.47Å; M341-N345 PolarHBondContact O-ND2 3.49Å; F342-N345 PolarHBondContact O-N 3.21Å; N345-L347 VanDerWaalsContact C-N 3.34Å; N345-L347 PolarHBondContact O-N 2.99Å; N345-L348 PolarHBondContact O-N 2.97Å; N345-E349 WeakPolarHBondContact O-CG 3.34Å; N345-E349 PolarHBondContact O-N 3.27Å
346	E	69.3	Low	62	Low	62 Å²	62	75.9 Å²	75.9	29%	0.29	37%	0.372	S	S	.	.	H	α-helix	trans	-56.6	-44.5	179.5	-168.6	-145.3	135.9	0	0	112.9	F342 K343 K350	F342-E346 PolarHBondContact O-N 2.84Å; K343-E346 IonicContact NZ-OE2 3.49Å; K343-E346 PolarHBondContact NZ-OE2 2.91Å; E346-K350 PolarHBondContact O-N 3.43Å; E346-K350 IonicContact OE1-NZ 2.99Å; E346-K350 PolarHBondContact OE1-NZ 3.41Å
347	L	63.3	Low	61.9	Low	94 Å²	94	76.5 Å²	76.5	49%	0.492	38%	0.378	S	S	.	.	H	α-helix	trans	-70.9	-35.2	-178.3	-161.5	153.6	0	0	0	111.2	F233 K343 T344 N345 L351	F233-L347 HydrophobicContact CE1-CD2 4.36Å; F233-L347 HydrophobicContact CZ-CD2 3.97Å; K343-L347 PolarHBondContact O-N 3.2Å; T344-L347 PolarHBondContact O-N 3.32Å; N345-L347 VanDerWaalsContact C-N 3.34Å; N345-L347 PolarHBondContact O-N 2.99Å; L347-L351 PolarHBondContact O-N 3.3Å; L347-L351 VanDerWaalsContact O-N 3.13Å
348	L	60.1	Low	61.6	Low	34 Å²	34	74.6 Å²	74.6	18%	0.178	37%	0.37	C	S	.	.	H	α-helix	trans	-77.6	-31.6	179.3	-173.5	50.4	0	0	0	113	T344 N345 L351 I352 L372 L374	T344-L348 WeakPolarHBondContact O-CB 3.38Å; T344-L348 PolarHBondContact O-N 3.39Å; T344-L348 VanDerWaalsContact O-N 3.13Å; N345-L348 PolarHBondContact O-N 2.97Å; L348-L351 HydrophobicContact CD1-CB 4.33Å; L348-L351 HydrophobicContact CD1-CD2 4.13Å; L348-L351 PolarHBondContact O-N 3.4Å; L348-I352 HydrophobicContact CD1-CD1 4.39Å; L348-I352 HydrophobicContact CD1-CG1 4.36Å; L348-I352 HydrophobicContact CG-CD1 4.16Å; L348-I352 WeakPolarHBondContact O-CB 3.5Å; L348-I352 VanDerWaalsContact O-CG1 3.28Å; L348-I352 WeakPolarHBondContact O-CG1 3.39Å; L348-I352 PolarHBondContact O-N 2.82Å; L348-L372 HydrophobicContact CD1-CD2 3.95Å; L348-L372 HydrophobicContact CD2-CD2 3.86Å; L348-L372 HydrophobicContact CG-CD2 4.29Å; L348-L374 HydrophobicContact CD2-CD1 3.71Å; L348-L374 HydrophobicContact CD2-CD2 3.49Å; L348-L374 VanDerWaalsContact CD2-CD2 3.49Å; L348-L374 HydrophobicContact CD2-CG 4.03Å; L348-L374 HydrophobicContact CG-CD1 4.09Å
349	E	63.8	Low	61	Low	62 Å²	62	71 Å²	71	29%	0.29	36%	0.356	S	S	.	.	H	α-helix	trans	-60.8	-44.6	169	-72.8	-168.3	179.9	0	0	111.2	N345 L351 I352 H353 K378 Y380	N345-E349 WeakPolarHBondContact O-CG 3.34Å; N345-E349 PolarHBondContact O-N 3.27Å; E349-L351 VanDerWaalsContact C-N 3.29Å; E349-L351 PolarHBondContact O-N 3.46Å; E349-I352 PolarHBondContact O-N 3.4Å; E349-H353 PolarHBondContact O-CD2 2.95Å; E349-H353 PolarHBondContact O-N 3.13Å; E349-K378 IonicContact OE1-NZ 2.64Å; E349-K378 PolarHBondContact OE1-NZ 3.27Å; E349-K378 IonicContact OE2-NZ 3.54Å; E349-Y380 VanDerWaalsContact CD-OH 3.3Å; E349-Y380 WeakPolarHBondContact CG-OH 3.46Å; E349-Y380 PolarHBondContact OE1-OH 2.91Å
350	K	67.3	Low	60.4	Low	126 Å²	126	70.6 Å²	70.6	55%	0.548	36%	0.362	S	S	.	.	H	α-helix	trans	-60.7	-36.9	174.3	-73.2	169	174.4	171.4	0	112.6	E346 T354	E346-K350 PolarHBondContact O-N 3.43Å; E346-K350 IonicContact OE1-NZ 2.99Å; E346-K350 PolarHBondContact OE1-NZ 3.41Å; K350-T354 PolarHBondContact O-N 3.15Å; K350-T354 VanDerWaalsContact O-N 3.15Å; K350-T354 PolarHBondContact O-OG1 3.16Å; K350-T354 VanDerWaalsContact O-OG1 3.11Å
351	L	60.5	Low	59.8	Low	47 Å²	47	69.3 Å²	69.3	25%	0.246	37%	0.366	C	S	.	.	H	α-helix	trans	-69.4	-45	175.8	-165	73.9	0	0	0	112.1	F230 L347 L348 E349 H353 T354 T355	F230-L351 HydrophobicContact CD1-CD2 4.45Å; F230-L351 HydrophobicContact CE1-CD1 3.56Å; F230-L351 HydrophobicContact CE1-CD2 3.74Å; F230-L351 HydrophobicContact CE1-CG 4.18Å; F230-L351 HydrophobicContact CZ-CD1 3.82Å; F230-L351 HydrophobicContact CZ-CD2 4.45Å; L347-L351 PolarHBondContact O-N 3.3Å; L347-L351 VanDerWaalsContact O-N 3.13Å; L348-L351 HydrophobicContact CD1-CB 4.33Å; L348-L351 HydrophobicContact CD1-CD2 4.13Å; L348-L351 PolarHBondContact O-N 3.4Å; E349-L351 VanDerWaalsContact C-N 3.29Å; E349-L351 PolarHBondContact O-N 3.46Å; L351-H353 VanDerWaalsContact C-N 3.32Å; L351-H353 PolarHBondContact O-N 2.76Å; L351-T354 PolarHBondContact O-N 2.04Å; L351-T354 PolarHBondContact O-OG1 3.04Å; L351-T355 WeakPolarHBondContact O-CG2 3.35Å; L351-T355 PolarHBondContact O-N 3.4Å; L351-T355 PolarHBondContact O-OG1 3.47Å
352	I	59	Low	59	Low	15 Å²	15	68.3 Å²	68.3	8%	0.077	37%	0.373	C	S	.	.	H	α-helix	trans	-59.7	-44.8	177.4	-71.8	165.6	0	0	0	110.2	L348 E349 T355 Y356 Y380	L348-I352 HydrophobicContact CD1-CD1 4.39Å; L348-I352 HydrophobicContact CD1-CG1 4.36Å; L348-I352 HydrophobicContact CG-CD1 4.16Å; L348-I352 WeakPolarHBondContact O-CB 3.5Å; L348-I352 VanDerWaalsContact O-CG1 3.28Å; L348-I352 WeakPolarHBondContact O-CG1 3.39Å; L348-I352 PolarHBondContact O-N 2.82Å; E349-I352 PolarHBondContact O-N 3.4Å; I352-T355 PolarHBondContact O-N 2.95Å; I352-T355 PolarHBondContact O-OG1 3.42Å; I352-Y356 HydrophobicContact CG2-CD2 3.76Å; I352-Y356 HydrophobicContact CG2-CE2 3.43Å; I352-Y356 VanDerWaalsContact CG2-CE2 3.43Å; I352-Y356 WeakPolarHBondContact O-CD2 3.46Å; I352-Y356 PolarHBondContact O-N 3.11Å; I352-Y380 HydrophobicContact CD1-CD1 4.06Å; I352-Y380 HydrophobicContact CD1-CD2 4.1Å; I352-Y380 HydrophobicContact CD1-CE1 4.34Å; I352-Y380 HydrophobicContact CD1-CE2 4.4Å; I352-Y380 HydrophobicContact CD1-CG 3.95Å; I352-Y380 HydrophobicContact CG2-CD1 3.97Å; I352-Y380 HydrophobicContact CG2-CE1 4.27Å
353	H	59.8	Low	57.9	Low	113 Å²	113	67.7 Å²	67.7	52%	0.523	37%	0.366	S	S	.	.	H	α-helix	trans	-58.3	-50.5	175.1	-88.8	-79.5	0	0	0	112.9	E349 L351 T355 Y356 D357	E349-H353 PolarHBondContact O-CD2 2.95Å; E349-H353 PolarHBondContact O-N 3.13Å; L351-H353 VanDerWaalsContact C-N 3.32Å; L351-H353 PolarHBondContact O-N 2.76Å; H353-T355 VanDerWaalsContact C-N 3.27Å; H353-T355 PolarHBondContact O-N 3.03Å; H353-Y356 WeakPolarHBondContact O-CA 3.35Å; H353-Y356 WeakPolarHBondContact O-CB 3.45Å; H353-Y356 PolarHBondContact O-N 2.74Å; H353-D357 PolarHBondContact O-N 3.3Å
354	T	58.7	Low	57.1	Low	84 Å²	84	69.7 Å²	69.7	52%	0.515	38%	0.375	S	S	.	.	H	α-helix	trans	-64	-29.3	178.9	50	0	0	0	0	113.2	K350 L351 A358	K350-T354 PolarHBondContact O-N 3.15Å; K350-T354 VanDerWaalsContact O-N 3.15Å; K350-T354 PolarHBondContact O-OG1 3.16Å; K350-T354 VanDerWaalsContact O-OG1 3.11Å; L351-T354 PolarHBondContact O-N 2.04Å; L351-T354 PolarHBondContact O-OG1 3.04Å; T354-A358 WeakPolarHBondContact O-CB 3.47Å; T354-A358 PolarHBondContact O-N 3.5Å
355	T	51.7	Low	56.5	Low	44 Å²	44	66.9 Å²	66.9	27%	0.27	36%	0.358	S	S	.	.	H	α-helix	trans	-71.1	-31	170	61.8	0	0	0	0	113.7	L351 I352 H353 C359	L351-T355 WeakPolarHBondContact O-CG2 3.35Å; L351-T355 PolarHBondContact O-N 3.4Å; L351-T355 PolarHBondContact O-OG1 3.47Å; I352-T355 PolarHBondContact O-N 2.95Å; I352-T355 PolarHBondContact O-OG1 3.42Å; H353-T355 VanDerWaalsContact C-N 3.27Å; H353-T355 PolarHBondContact O-N 3.03Å; T355-C359 WeakPolarHBondContact O-CB 3.45Å; T355-C359 PolarHBondContact O-N 3.25Å
356	Y	56.5	Low	55.6	Low	33 Å²	33	70.2 Å²	70.2	13%	0.129	38%	0.379	C	S	.	.	H	α-helix	trans	-72.2	-40.1	171.9	-77.5	-50.9	0	0	0	112.2	I352 H353 A358 C359 N360 P381 T383 Q386	I352-Y356 HydrophobicContact CG2-CD2 3.76Å; I352-Y356 HydrophobicContact CG2-CE2 3.43Å; I352-Y356 VanDerWaalsContact CG2-CE2 3.43Å; I352-Y356 WeakPolarHBondContact O-CD2 3.46Å; I352-Y356 PolarHBondContact O-N 3.11Å; H353-Y356 WeakPolarHBondContact O-CA 3.35Å; H353-Y356 WeakPolarHBondContact O-CB 3.45Å; H353-Y356 PolarHBondContact O-N 2.74Å; Y356-A358 VanDerWaalsContact C-N 3.31Å; Y356-A358 PolarHBondContact O-N 2.92Å; Y356-C359 PolarHBondContact O-N 3.03Å; Y356-C359 VanDerWaalsContact O-N 3.13Å; Y356-N360 WeakPolarHBondContact O-CB 3.5Å; Y356-N360 PolarHBondContact O-N 3.48Å; Y356-N360 PolarHBondContact O-ND2 3.44Å; Y356-P381 PolarHBondContact OH-O 3.13Å; Y356-T383 HydrophobicContact CE1-CG2 4.04Å; Y356-T383 HydrophobicContact CE2-CG2 4.35Å; Y356-Q386 HydrophobicContact CE1-CB 3.9Å; Y356-Q386 HydrophobicContact CE1-CG 4Å; Y356-Q386 PolarHBondContact OH-OE1 2.86Å
357	D	57.1	Low	54.3	Low	96 Å²	96	74 Å²	74	51%	0.513	40%	0.396	S	S	.	.	H	α-helix	trans	-63.4	-39	175.3	-62.7	-34.2	0	0	0	111.5	H353 N360 A361	H353-D357 PolarHBondContact O-N 3.3Å; D357-N360 PolarHBondContact O-N 2.83Å; D357-A361 WeakPolarHBondContact O-CB 3.28Å; D357-A361 PolarHBondContact O-N 3.05Å
358	A	53	Low	53.1	Low	37 Å²	37	72 Å²	72	31%	0.306	39%	0.39	S	S	.	.	H	α-helix	trans	-62.4	-42.3	170.9	0	0	0	0	0	112.5	T354 Y356 A361 G362 W363	T354-A358 WeakPolarHBondContact O-CB 3.47Å; T354-A358 PolarHBondContact O-N 3.5Å; Y356-A358 VanDerWaalsContact C-N 3.31Å; Y356-A358 PolarHBondContact O-N 2.92Å; A358-A361 CarbonylContact O-C 3.59Å; A358-A361 WeakPolarHBondContact O-CB 3.16Å; A358-A361 PolarHBondContact O-N 2.92Å; A358-G362 PolarHBondContact O-N 2.98Å; A358-W363 HydrophobicContact CB-CB 4.31Å; A358-W363 WeakPolarHBondContact O-CB 3.5Å; A358-W363 PolarHBondContact O-N 3.42Å
359	C	52.9	Low	52	Low	25 Å²	25	78 Å²	78	17%	0.169	42%	0.419	C	S	.	.	H	α-helix	trans	-65.8	-39.9	176.4	-174.7	0	0	0	0	112.3	T355 Y356 A361 G362 W363 C387	T355-C359 WeakPolarHBondContact O-CB 3.45Å; T355-C359 PolarHBondContact O-N 3.25Å; Y356-C359 PolarHBondContact O-N 3.03Å; Y356-C359 VanDerWaalsContact O-N 3.13Å; C359-A361 VanDerWaalsContact C-N 3.27Å; C359-A361 PolarHBondContact O-N 3.26Å; C359-G362 WeakPolarHBondContact O-CA 3.47Å; C359-G362 PolarHBondContact O-N 3.06Å; C359-W363 WeakPolarHBondContact CA-O 3.37Å; C359-C387 WeakPolarHBondContact CB-SG 3.25Å; C359-C387 WeakPolarHBondContact SG-CB 3.24Å; C359-C387 CovalentContact SG-SG 2.04Å; C359-C387 PolarHBondContact SG-SG 3.49Å
360	N	54.4	Low	50.9	Low	115 Å²	115	82.1 Å²	82.1	62%	0.615	44%	0.443	S	S	*	.	H	α-helix	trans	-62.7	-33.1	173	-67.9	-27.6	0	0	0	112	Y356 D357 G362	Y356-N360 WeakPolarHBondContact O-CB 3.5Å; Y356-N360 PolarHBondContact O-N 3.48Å; Y356-N360 PolarHBondContact O-ND2 3.44Å; D357-N360 PolarHBondContact O-N 2.83Å; N360-G362 PolarHBondContact O-N 3.27Å
361	A	50.6	Low	49.6	Very low	75 Å²	75	82.6 Å²	82.6	62%	0.62	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	4.7	171.3	0	0	0	0	0	114.2	D357 A358 C359	D357-A361 WeakPolarHBondContact O-CB 3.28Å; D357-A361 PolarHBondContact O-N 3.05Å; A358-A361 CarbonylContact O-C 3.59Å; A358-A361 WeakPolarHBondContact O-CB 3.16Å; A358-A361 PolarHBondContact O-N 2.92Å; C359-A361 VanDerWaalsContact C-N 3.27Å; C359-A361 PolarHBondContact O-N 3.26Å
362	G	44.1	Very low	48.6	Very low	42 Å²	42	85.3 Å²	85.3	43%	0.433	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.3	2.9	175.5	0	0	0	0	0	115.5	A358 C359 N360	A358-G362 PolarHBondContact O-N 2.98Å; C359-G362 WeakPolarHBondContact O-CA 3.47Å; C359-G362 PolarHBondContact O-N 3.06Å; N360-G362 PolarHBondContact O-N 3.27Å
363	W	44.2	Very low	47.6	Very low	123 Å²	123	90 Å²	90	47%	0.466	50%	0.495	S	S	.	.			trans	-70.5	129.1	176.3	-172.5	78.3	0	0	0	111.2	A358 C359 P365	A358-W363 HydrophobicContact CB-CB 4.31Å; A358-W363 WeakPolarHBondContact O-CB 3.5Å; A358-W363 PolarHBondContact O-N 3.42Å; C359-W363 WeakPolarHBondContact CA-O 3.37Å; W363-P365 HydrophobicContact CE3-CB 4.45Å; W363-P365 HydrophobicContact CH2-CB 3.9Å; W363-P365 HydrophobicContact CZ3-CB 3.7Å; W363-P365 HydrophobicContact CZ3-CG 4.27Å
364	K	48.9	Very low	46.4	Very low	135 Å²	135	86.5 Å²	86.5	59%	0.587	48%	0.48	S	S	*	.			trans	-112.8	115.5	-179.4	-66.2	-174.7	179.9	-176.2	0	110.2	V366	K364-V366 PolarHBondContact O-N 2.79Å; K364-V366 VanDerWaalsContact O-N 3.11Å
365	P	45.6	Very low	45.5	Very low	22 Å²	22	88.5 Å²	88.5	14%	0.143	49%	0.488	C	S	.	.			trans	-68.5	109	178.7	25.4	-32.3	0	0	0	111.1	W363 H367	W363-P365 HydrophobicContact CE3-CB 4.45Å; W363-P365 HydrophobicContact CH2-CB 3.9Å; W363-P365 HydrophobicContact CZ3-CB 3.7Å; W363-P365 HydrophobicContact CZ3-CG 4.27Å; P365-H367 PolarHBondContact O-N 3.01Å
366	V	45.8	Very low	45.3	Very low	90 Å²	90	91.6 Å²	91.6	55%	0.545	50%	0.503	S	S	.	.	S	Bend	trans	-77.5	103.4	170.1	-180	0	0	0	0	108.4	K364	K364-V366 PolarHBondContact O-N 2.79Å; K364-V366 VanDerWaalsContact O-N 3.11Å
367	H	42.7	Very low	44.8	Very low	142 Å²	142	100.3 Å²	100.3	66%	0.657	54%	0.541	S	S	*	.			trans	63.7	96.3	180	-49.1	-60.4	0	0	0	116.8	P365	P365-H367 PolarHBondContact O-N 3.01Å
368	S	38.8	Very low	44.3	Very low	51 Å²	51	101.2 Å²	101.2	36%	0.357	54%	0.541	S	S	.	.			trans	-140.4	93.4	154	61.9	0	0	0	0	109.7
369	M	36.4	Very low	43.8	Very low	162 Å²	162	109 Å²	109	80%	0.798	57%	0.568	S	S	*	*			trans	-85.8	-9.8	-170.3	-85.2	179.3	154.8	0	0	115.4
370	N	41.2	Very low	43.4	Very low	148 Å²	148	110.2 Å²	110.2	79%	0.791	57%	0.569	S	S	*	*			trans	-90.6	125.7	-168.6	-63.4	9.3	0	0	0	112.1	L372	N370-L372 PolarHBondContact O-N 3.37Å
371	H	40.5	Very low	43.2	Very low	135 Å²	135	107.9 Å²	107.9	63%	0.625	56%	0.56	S	S	*	*			trans	-68.1	125.6	168.7	-83.8	-105.2	0	0	0	110.7	S373	H371-S373 PolarHBondContact O-N 2.71Å
372	L	39.2	Very low	43.3	Very low	105 Å²	105	105.1 Å²	105.1	55%	0.55	54%	0.535	S	S	.	.			trans	-93.3	90.6	177.4	-163.5	67.1	0	0	0	110.6	L348 N370 L374	L348-L372 HydrophobicContact CD1-CD2 3.95Å; L348-L372 HydrophobicContact CD2-CD2 3.86Å; L348-L372 HydrophobicContact CG-CD2 4.29Å; N370-L372 PolarHBondContact O-N 3.37Å; L372-L374 PolarHBondContact O-N 2.89Å
373	S	36.5	Very low	43.5	Very low	113 Å²	113	105.1 Å²	105.1	79%	0.79	53%	0.527	S	S	*	.			trans	-80.8	110.6	175.8	55.9	0	0	0	0	111.4	H371	H371-S373 PolarHBondContact O-N 2.71Å
374	L	36.5	Very low	43.7	Very low	40 Å²	40	102.8 Å²	102.8	21%	0.209	52%	0.518	C	S	.	.			trans	-91.3	138.6	172.6	-73.8	164.6	0	0	0	112.1	L348 L372 N376 Y380	L348-L374 HydrophobicContact CD2-CD1 3.71Å; L348-L374 HydrophobicContact CD2-CD2 3.49Å; L348-L374 VanDerWaalsContact CD2-CD2 3.49Å; L348-L374 HydrophobicContact CD2-CG 4.03Å; L348-L374 HydrophobicContact CG-CD1 4.09Å; L372-L374 PolarHBondContact O-N 2.89Å; L374-N376 VanDerWaalsContact C-N 3.3Å; L374-N376 PolarHBondContact O-N 3.06Å; L374-Y380 HydrophobicContact CD1-CD2 4.13Å; L374-Y380 HydrophobicContact CD1-CE2 4.09Å
375	N	38.4	Very low	43.8	Very low	126 Å²	126	99.4 Å²	99.4	67%	0.674	51%	0.506	S	S	*	.	S	Bend	trans	-69.3	86.6	169	-88.4	-8.4	0	0	0	109.8	M341	M341-N375 HydrophobicContact CE-CB 4.18Å; M341-N375 VanDerWaalsContact CE-O 3.25Å; M341-N375 WeakPolarHBondContact CE-O 3.43Å; M341-N375 HydrophobicContact SD-CB 3.75Å
376	N	47.2	Very low	44	Very low	109 Å²	109	101.5 Å²	101.5	58%	0.583	51%	0.514	S	S	*	.	S	Bend	trans	176.5	60.1	148	-91.3	-20.3	0	0	0	112.5	L374 K378	L374-N376 VanDerWaalsContact C-N 3.3Å; L374-N376 PolarHBondContact O-N 3.06Å; N376-K378 PolarHBondContact O-N 3.44Å
377	K	46.6	Very low	44.1	Very low	216 Å²	216	98.1 Å²	98.1	94%	0.939	49%	0.494	S	S	*	.	S	Bend	trans	57	-20.3	174.3	-70.8	-175.2	176.2	179.8	0	118.5	K379	K377-K379 PolarHBondContact O-N 3.03Å
378	K	46	Very low	44.3	Very low	115 Å²	115	95.6 Å²	95.6	50%	0.5	48%	0.48	S	S	.	.			trans	-70	93	171.9	-67.3	-170.9	-174.5	177.7	0	110	E349 N376 Y380	E349-K378 IonicContact OE1-NZ 2.64Å; E349-K378 PolarHBondContact OE1-NZ 3.27Å; E349-K378 IonicContact OE2-NZ 3.54Å; N376-K378 PolarHBondContact O-N 3.44Å; K378-Y380 HydrophobicContact CB-CD2 4.36Å; K378-Y380 HydrophobicContact CB-CE2 3.8Å; K378-Y380 HydrophobicContact CD-CE2 4.14Å; K378-Y380 VanDerWaalsContact CD-OH 3.24Å; K378-Y380 WeakPolarHBondContact CD-OH 3.39Å; K378-Y380 PolarHBondContact O-N 2.77Å
379	K	44	Very low	44.7	Very low	200 Å²	200	100.5 Å²	100.5	87%	0.87	50%	0.495	S	S	*	.			trans	-69.5	97.3	160.8	-79.7	-171.8	175.9	-177.6	0	108.4	K377 P381	K377-K379 PolarHBondContact O-N 3.03Å; K379-P381 WeakPolarHBondContact O-CD 3.26Å
380	Y	44.8	Very low	45.2	Very low	51 Å²	51	102.2 Å²	102.2	20%	0.2	49%	0.493	C	S	.	.	P	Polyproline II helix	trans	-61.9	123.6	159.6	-69.8	-82.6	0	0	0	107.7	E349 I352 L374 K378	E349-Y380 VanDerWaalsContact CD-OH 3.3Å; E349-Y380 WeakPolarHBondContact CG-OH 3.46Å; E349-Y380 PolarHBondContact OE1-OH 2.91Å; I352-Y380 HydrophobicContact CD1-CD1 4.06Å; I352-Y380 HydrophobicContact CD1-CD2 4.1Å; I352-Y380 HydrophobicContact CD1-CE1 4.34Å; I352-Y380 HydrophobicContact CD1-CE2 4.4Å; I352-Y380 HydrophobicContact CD1-CG 3.95Å; I352-Y380 HydrophobicContact CG2-CD1 3.97Å; I352-Y380 HydrophobicContact CG2-CE1 4.27Å; L374-Y380 HydrophobicContact CD1-CD2 4.13Å; L374-Y380 HydrophobicContact CD1-CE2 4.09Å; K378-Y380 HydrophobicContact CB-CD2 4.36Å; K378-Y380 HydrophobicContact CB-CE2 3.8Å; K378-Y380 HydrophobicContact CD-CE2 4.14Å; K378-Y380 VanDerWaalsContact CD-OH 3.24Å; K378-Y380 WeakPolarHBondContact CD-OH 3.39Å; K378-Y380 PolarHBondContact O-N 2.77Å
381	P	49.8	Very low	45.3	Very low	66 Å²	66	99.6 Å²	99.6	43%	0.429	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-58.1	147.5	167.4	-19.2	32.7	0	0	0	108.5	Y356 K379 T383 Q386	Y356-P381 PolarHBondContact OH-O 3.13Å; K379-P381 WeakPolarHBondContact O-CD 3.26Å; P381-T383 PolarHBondContact O-N 3.44Å; P381-Q386 HydrophobicContact CB-CB 4.38Å; P381-Q386 VanDerWaalsContact CB-OE1 3.31Å
382	N	52.1	Low	45.4	Very low	17 Å²	17	98.8 Å²	98.8	9%	0.091	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-54.8	127.3	176.5	-178.8	-15.4	0	0	0	108.4	Y384 L385 Q386	N382-Y384 CarbonylContact O-C 3.6Å; N382-Y384 PolarHBondContact O-N 3.06Å; N382-Y384 VanDerWaalsContact O-N 3.16Å; N382-Y384 WeakPolarHBondContact OD1-CB 3.45Å; N382-Y384 PolarHBondContact OD1-N 3.23Å; N382-Y384 VanDerWaalsContact OD1-N 3.15Å; N382-L385 HydrophobicContact CB-CB 4.01Å; N382-L385 CarbonylContact O-C 3.57Å; N382-L385 WeakPolarHBondContact O-CA 3.32Å; N382-L385 WeakPolarHBondContact O-CB 3.08Å; N382-L385 PolarHBondContact O-N 2.97Å; N382-Q386 PolarHBondContact O-N 2.84Å
383	T	47.5	Very low	45.5	Very low	42 Å²	42	94.9 Å²	94.9	26%	0.258	46%	0.461	S	S	.	.	H	α-helix	trans	-55.2	-36.3	-176.7	45	0	0	0	0	111.2	Y356 P381 Q386 C387	Y356-T383 HydrophobicContact CE1-CG2 4.04Å; Y356-T383 HydrophobicContact CE2-CG2 4.35Å; P381-T383 PolarHBondContact O-N 3.44Å; T383-Q386 PolarHBondContact O-N 3.31Å; T383-C387 WeakPolarHBondContact O-CB 3.37Å; T383-C387 PolarHBondContact O-N 3.36Å; T383-C387 PolarHBondContact O-SG 3.46Å
384	Y	49.1	Very low	45.8	Very low	73 Å²	73	93.1 Å²	93.1	29%	0.286	45%	0.446	S	S	.	.	H	α-helix	trans	-55.9	-56.8	168.6	179.5	-95	0	0	0	111.9	N382 Q386 C387 Y388	N382-Y384 CarbonylContact O-C 3.6Å; N382-Y384 PolarHBondContact O-N 3.06Å; N382-Y384 VanDerWaalsContact O-N 3.16Å; N382-Y384 WeakPolarHBondContact OD1-CB 3.45Å; N382-Y384 PolarHBondContact OD1-N 3.23Å; N382-Y384 VanDerWaalsContact OD1-N 3.15Å; Y384-Q386 VanDerWaalsContact C-N 3.27Å; Y384-Q386 PolarHBondContact O-N 3.48Å; Y384-C387 PolarHBondContact O-N 2.88Å; Y384-Y388 HydrophobicContact CD1-CD2 4.42Å; Y384-Y388 HydrophobicContact CD2-CD2 4.11Å; Y384-Y388 AromaticContact CD2-CE2 3.92Å; Y384-Y388 HydrophobicContact CD2-CE2 3.92Å; Y384-Y388 HydrophobicContact CE1-CD2 4.19Å; Y384-Y388 HydrophobicContact CE1-CE2 4.39Å; Y384-Y388 AromaticContact CE2-CD2 3.87Å; Y384-Y388 HydrophobicContact CE2-CD2 3.87Å; Y384-Y388 AromaticContact CE2-CE2 3.38Å; Y384-Y388 HydrophobicContact CE2-CE2 3.38Å; Y384-Y388 HydrophobicContact CG-CD2 4.37Å; Y384-Y388 AromaticContact CZ-CD2 3.91Å; Y384-Y388 AromaticContact CZ-CE2 3.65Å; Y384-Y388 WeakPolarHBondContact O-CD2 3.36Å; Y384-Y388 PolarHBondContact O-N 3.23Å
385	L	50.3	Low	46.1	Very low	65 Å²	65	95.3 Å²	95.3	34%	0.34	46%	0.457	S	S	.	.	H	α-helix	trans	-60.2	-35.5	-179.7	-172.9	69.5	0	0	0	112.1	N382 Y388 K389 L395	N382-L385 HydrophobicContact CB-CB 4.01Å; N382-L385 CarbonylContact O-C 3.57Å; N382-L385 WeakPolarHBondContact O-CA 3.32Å; N382-L385 WeakPolarHBondContact O-CB 3.08Å; N382-L385 PolarHBondContact O-N 2.97Å; L385-Y388 PolarHBondContact O-N 3.05Å; L385-K389 VanDerWaalsContact O-CB 3.27Å; L385-K389 WeakPolarHBondContact O-CB 3.35Å; L385-K389 PolarHBondContact O-N 3.39Å; L385-L395 HydrophobicContact CD1-CD1 4.32Å
386	Q	50.9	Low	46.3	Very low	65 Å²	65	95.8 Å²	95.8	30%	0.304	46%	0.455	S	S	.	.	H	α-helix	trans	-77	-37.1	-178.7	-164.5	159.1	-16.9	0	0	112.2	Y356 P381 N382 T383 Y384 Y388 K389	Y356-Q386 HydrophobicContact CE1-CB 3.9Å; Y356-Q386 HydrophobicContact CE1-CG 4Å; Y356-Q386 PolarHBondContact OH-OE1 2.86Å; P381-Q386 HydrophobicContact CB-CB 4.38Å; P381-Q386 VanDerWaalsContact CB-OE1 3.31Å; N382-Q386 PolarHBondContact O-N 2.84Å; T383-Q386 PolarHBondContact O-N 3.31Å; Y384-Q386 VanDerWaalsContact C-N 3.27Å; Y384-Q386 PolarHBondContact O-N 3.48Å; Q386-Y388 VanDerWaalsContact C-N 3.31Å; Q386-Y388 PolarHBondContact O-N 3.37Å; Q386-K389 PolarHBondContact O-N 2.81Å
387	C	47.5	Very low	46.1	Very low	19 Å²	19	97.4 Å²	97.4	13%	0.128	46%	0.464	C	S	.	.	H	α-helix	trans	-63.1	-34	167.3	-71.6	0	0	0	0	112.5	C359 T383 Y384 N391	C359-C387 WeakPolarHBondContact CB-SG 3.25Å; C359-C387 WeakPolarHBondContact SG-CB 3.24Å; C359-C387 CovalentContact SG-SG 2.04Å; C359-C387 PolarHBondContact SG-SG 3.49Å; T383-C387 WeakPolarHBondContact O-CB 3.37Å; T383-C387 PolarHBondContact O-N 3.36Å; T383-C387 PolarHBondContact O-SG 3.46Å; Y384-C387 PolarHBondContact O-N 2.88Å; C387-N391 PolarHBondContact O-ND2 2.92Å
388	Y	47.1	Very low	45.7	Very low	89 Å²	89	91.4 Å²	91.4	35%	0.349	44%	0.441	S	S	.	.	H	α-helix	trans	-82.1	-28	176.2	-88.1	-95.8	0	0	0	114	Y384 L385 Q386 Y390 N391	Y384-Y388 HydrophobicContact CD1-CD2 4.42Å; Y384-Y388 HydrophobicContact CD2-CD2 4.11Å; Y384-Y388 AromaticContact CD2-CE2 3.92Å; Y384-Y388 HydrophobicContact CD2-CE2 3.92Å; Y384-Y388 HydrophobicContact CE1-CD2 4.19Å; Y384-Y388 HydrophobicContact CE1-CE2 4.39Å; Y384-Y388 AromaticContact CE2-CD2 3.87Å; Y384-Y388 HydrophobicContact CE2-CD2 3.87Å; Y384-Y388 AromaticContact CE2-CE2 3.38Å; Y384-Y388 HydrophobicContact CE2-CE2 3.38Å; Y384-Y388 HydrophobicContact CG-CD2 4.37Å; Y384-Y388 AromaticContact CZ-CD2 3.91Å; Y384-Y388 AromaticContact CZ-CE2 3.65Å; Y384-Y388 WeakPolarHBondContact O-CD2 3.36Å; Y384-Y388 PolarHBondContact O-N 3.23Å; L385-Y388 PolarHBondContact O-N 3.05Å; Q386-Y388 VanDerWaalsContact C-N 3.31Å; Q386-Y388 PolarHBondContact O-N 3.37Å; Y388-Y390 VanDerWaalsContact C-N 3.28Å; Y388-Y390 PolarHBondContact O-N 2.87Å; Y388-N391 WeakPolarHBondContact O-CA 3.47Å; Y388-N391 WeakPolarHBondContact O-CB 3.48Å; Y388-N391 PolarHBondContact O-N 2.68Å
389	K	46.3	Very low	45.2	Very low	155 Å²	155	94.4 Å²	94.4	67%	0.674	46%	0.457	S	S	*	.	H	α-helix	trans	-65.2	-29.7	178.2	-173.6	170.6	-178.2	176.6	0	112.9	L385 Q386 N391 N392	L385-K389 VanDerWaalsContact O-CB 3.27Å; L385-K389 WeakPolarHBondContact O-CB 3.35Å; L385-K389 PolarHBondContact O-N 3.39Å; Q386-K389 PolarHBondContact O-N 2.81Å; K389-N391 PolarHBondContact O-N 3.39Å; K389-N391 VanDerWaalsContact O-N 3.15Å; K389-N392 PolarHBondContact O-N 2.96Å
390	Y	47	Very low	44.8	Very low	197 Å²	197	92.4 Å²	92.4	77%	0.773	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-9.4	168.7	-93.3	-83.3	0	0	0	114.2	Y388	Y388-Y390 VanDerWaalsContact C-N 3.28Å; Y388-Y390 PolarHBondContact O-N 2.87Å
391	N	43.4	Very low	44.3	Very low	93 Å²	93	96.7 Å²	96.7	50%	0.497	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	19.7	177.9	-60.3	-82.6	0	0	0	112.9	C387 Y388 K389 C393	C387-N391 PolarHBondContact O-ND2 2.92Å; Y388-N391 WeakPolarHBondContact O-CA 3.47Å; Y388-N391 WeakPolarHBondContact O-CB 3.48Å; Y388-N391 PolarHBondContact O-N 2.68Å; K389-N391 PolarHBondContact O-N 3.39Å; K389-N391 VanDerWaalsContact O-N 3.15Å; N391-C393 PolarHBondContact O-N 2.8Å; N391-C393 VanDerWaalsContact O-N 3.14Å
392	N	44.2	Very low	43.7	Very low	118 Å²	118	103 Å²	103	63%	0.631	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	14.9	178.1	-73.4	-10.5	0	0	0	117.1	K389	K389-N392 PolarHBondContact O-N 2.96Å
393	C	41.1	Very low	42.9	Very low	23 Å²	23	106.4 Å²	106.4	16%	0.155	53%	0.525	C	S	.	.	B	Isolated β-bridge	trans	-77.5	131.1	175.1	-57.5	0	0	0	0	112.3	N391	N391-C393 PolarHBondContact O-N 2.8Å; N391-C393 VanDerWaalsContact O-N 3.14Å
394	T	42.1	Very low	42.3	Very low	77 Å²	77	110.6 Å²	110.6	47%	0.472	55%	0.546	S	S	.	.			trans	-110.3	129	167	42.6	0	0	0	0	110.9	N420	T394-N420 PolarHBondContact OG1-O 3.38Å
395	L	43.6	Very low	41.7	Very low	86 Å²	86	114 Å²	114	45%	0.45	57%	0.57	S	S	.	*			trans	-94.1	133.1	169.4	-92.6	154.4	0	0	0	109.1	L385	L385-L395 HydrophobicContact CD1-CD1 4.32Å
396	E	41.8	Very low	40.9	Very low	135 Å²	135	118.4 Å²	118.4	63%	0.631	59%	0.593	S	S	*	*			trans	-120.5	122.3	179.7	-171.7	162.8	-134	0	0	108.4
397	N	42.1	Very low	40.1	Very low	144 Å²	144	123.1 Å²	123.1	77%	0.77	62%	0.62	S	S	*	*			trans	-94.3	122.9	178.5	-72.9	2.9	0	0	0	108.7
398	I	39.5	Very low	39.4	Very low	90 Å²	90	128 Å²	128	46%	0.462	66%	0.655	S	S	.	*			trans	-94.7	103.3	178.1	-56.6	175.7	0	0	0	109.2	H400 Q415	I398-H400 PolarHBondContact O-N 2.64Å; I398-Q415 PolarHBondContact O-NE2 2.99Å
399	E	34.4	Very low	38.6	Very low	177 Å²	177	128.3 Å²	128.3	83%	0.827	67%	0.67	S	S	*	*			trans	-75.2	117.6	166.9	-68.3	-177.2	162.4	0	0	109.5
400	H	36.7	Very low	37.9	Very low	159 Å²	159	129.7 Å²	129.7	74%	0.736	68%	0.679	S	S	*	*			trans	-113	101.7	170.6	-101.1	-64.2	0	0	0	110	I398	I398-H400 PolarHBondContact O-N 2.64Å
401	N	34	Very low	37.1	Very low	141 Å²	141	124.9 Å²	124.9	75%	0.754	67%	0.67	S	S	*	*			trans	-72.1	125	161.5	-62.7	-54.9	0	0	0	108.8
402	H	37.1	Very low	36.5	Very low	199 Å²	199	128.9 Å²	128.9	92%	0.921	69%	0.691	S	S	*	*			trans	-160.7	159.7	140.2	-120.2	-81.1	0	0	0	111.1
403	S	34.9	Very low	35.9	Very low	88 Å²	88	131.3 Å²	131.3	62%	0.615	70%	0.699	S	S	*	*			trans	-104.4	160.4	-161.8	-142.4	0	0	0	0	114.6
404	D	35.5	Very low	35.6	Very low	130 Å²	130	137.4 Å²	137.4	70%	0.695	73%	0.729	S	S	*	*			trans	81.5	145.7	149.3	-51.4	-23.9	0	0	0	121.5
405	N	36.3	Very low	35.4	Very low	145 Å²	145	139.1 Å²	139.1	78%	0.775	73%	0.732	S	S	*	*			trans	71.8	86.6	159.5	-59	-35.2	0	0	0	119.4
406	N	34	Very low	35.1	Very low	157 Å²	157	141.4 Å²	141.4	84%	0.84	75%	0.745	S	S	*	*				27.7	102.2	120.5	-60.2	-8.8	0	0	0	117.7
407	D	34.7	Very low	35	Very low	163 Å²	163	138.6 Å²	138.6	87%	0.872	74%	0.737	S	S	*	*				-147.8	128.6	124.4	-124.5	-25.8	0	0	0	110.1	S409	D407-S409 PolarHBondContact O-N 2.89Å
408	S	31.5	Very low	35	Very low	122 Å²	122	136.6 Å²	136.6	85%	0.853	73%	0.73	S	S	*	*			trans	-94.9	68.4	-160.6	63.5	0	0	0	0	113.8
409	S	31.3	Very low	35.1	Very low	96 Å²	96	133.5 Å²	133.5	67%	0.671	72%	0.716	S	S	*	*	S	Bend	trans	-155.8	139.5	158.3	69.5	0	0	0	0	113.8	D407	D407-S409 PolarHBondContact O-N 2.89Å
410	Q	30.1	Very low	35.6	Very low	183 Å²	183	130.8 Å²	130.8	86%	0.855	71%	0.707	S	S	*	*	S	Bend	trans	67	170.5	176	-47.9	-173.8	11	0	0	116.3
411	V	30.6	Very low	35.8	Very low	96 Å²	96	124.7 Å²	124.7	58%	0.582	68%	0.682	S	S	*	*			trans	63.8	86.8	165.7	-164.2	0	0	0	0	117.7	Q413	V411-Q413 HydrophobicContact CG1-CB 3.82Å; V411-Q413 VanDerWaalsContact CG1-CD 3.45Å; V411-Q413 HydrophobicContact CG1-CG 3.42Å; V411-Q413 VanDerWaalsContact CG1-CG 3.42Å
412	N	31.2	Very low	36.3	Very low	177 Å²	177	123.6 Å²	123.6	95%	0.947	68%	0.676	S	S	*	*			trans	-90.3	87.2	146	-97.6	-17.4	0	0	0	109.1	L414	N412-L414 PolarHBondContact O-N 3.34Å
413	Q	32	Very low	36.9	Very low	169 Å²	169	120.7 Å²	120.7	79%	0.79	67%	0.667	S	S	*	*			trans	-75.7	108.6	172	-100.6	162.8	9.6	0	0	110.3	V411	V411-Q413 HydrophobicContact CG1-CB 3.82Å; V411-Q413 VanDerWaalsContact CG1-CD 3.45Å; V411-Q413 HydrophobicContact CG1-CG 3.42Å; V411-Q413 VanDerWaalsContact CG1-CG 3.42Å
414	L	34.6	Very low	37	Very low	152 Å²	152	125.7 Å²	125.7	80%	0.796	68%	0.68	S	S	*	*			trans	-156.5	120.8	171.2	-150.4	78.3	0	0	0	110.4	N412	N412-L414 PolarHBondContact O-N 3.34Å
415	Q	38.2	Very low	37.5	Very low	113 Å²	113	123.7 Å²	123.7	53%	0.528	67%	0.673	S	S	.	*			cis	-156.8	155.2	-20	-123.4	170.9	-13.1	0	0	106.2	I398 T417	I398-Q415 PolarHBondContact O-NE2 2.99Å; Q415-T417 PolarHBondContact O-N 2.95Å
416	N	36.8	Very low	37.8	Very low	134 Å²	134	123.5 Å²	123.5	72%	0.717	67%	0.665	S	S	*	*			trans	-73.1	100.4	-176.1	-74.5	-34.9	0	0	0	112.5	T418	N416-T418 PolarHBondContact O-N 3.42Å; N416-T418 VanDerWaalsContact O-N 3.1Å
417	T	40.6	Very low	38.1	Very low	76 Å²	76	118 Å²	118	47%	0.466	64%	0.638	S	S	.	*			trans	-83.9	73.5	177.4	44	0	0	0	0	112.8	Q415 C419	Q415-T417 PolarHBondContact O-N 2.95Å; T417-C419 PolarHBondContact O-N 3.28Å
418	T	41.8	Very low	38.5	Very low	101 Å²	101	115.4 Å²	115.4	62%	0.62	62%	0.624	S	S	*	*			trans	-73.6	106.3	172.8	48.2	0	0	0	0	111.7	N416	N416-T418 PolarHBondContact O-N 3.42Å; N416-T418 VanDerWaalsContact O-N 3.1Å
419	C	40.7	Very low	38.9	Very low	26 Å²	26	111.8 Å²	111.8	18%	0.176	60%	0.598	C	S	.	*			trans	-77.7	122.7	170.4	-56.5	0	0	0	0	111.5	T417 C429	T417-C419 PolarHBondContact O-N 3.28Å; C419-C429 HydrophobicContact CB-CB 3.61Å; C419-C429 WeakPolarHBondContact CB-SG 3.49Å; C419-C429 WeakPolarHBondContact SG-CB 3.5Å; C419-C429 CovalentContact SG-SG 2.02Å; C419-C429 PolarHBondContact SG-SG 3.3Å
420	N	45.1	Very low	39.3	Very low	120 Å²	120	112.5 Å²	112.5	64%	0.642	59%	0.594	S	S	*	*			trans	-81.2	135.5	156.4	-89.1	-41.8	0	0	0	109.6	T394	T394-N420 PolarHBondContact OG1-O 3.38Å
421	C	41.6	Very low	39.8	Very low	31 Å²	31	110 Å²	110	21%	0.209	59%	0.587	C	S	.	*	B	Isolated β-bridge	trans	-115.6	124.8	166.9	-91	0	0	0	0	109.3	C427	C421-C427 HydrophobicContact CB-CB 3.86Å; C421-C427 WeakPolarHBondContact CB-SG 3.24Å; C421-C427 WeakPolarHBondContact SG-CB 3.28Å; C421-C427 CovalentContact SG-SG 2.03Å; C421-C427 PolarHBondContact SG-SG 3.27Å
422	L	44.2	Very low	40.2	Very low	118 Å²	118	116 Å²	116	62%	0.618	60%	0.599	S	S	*	*	S	Bend	trans	-70.9	143.9	173	-71.4	87.4	0	0	0	109.8
423	N	48.4	Very low	40.7	Very low	138 Å²	138	115.4 Å²	115.4	74%	0.738	59%	0.594	S	S	*	*	S	Bend	trans	66.4	69.1	176.5	-56.4	-13.6	0	0	0	116.1	T425	N423-T425 PolarHBondContact O-N 2.97Å; N423-T425 PolarHBondContact O-OG1 3.15Å
424	E	38.7	Very low	41.2	Very low	193 Å²	193	113.9 Å²	113.9	90%	0.902	59%	0.587	S	S	*	*	S	Bend	trans	55.1	-7.4	157.4	-59.1	-159.4	136.9	0	0	119.8	K426	E424-K426 PolarHBondContact O-N 2.87Å
425	T	44.4	Very low	41.4	Very low	88 Å²	88	111 Å²	111	54%	0.54	59%	0.585	S	S	.	*			trans	-78.5	114.4	174.9	47.3	0	0	0	0	109.8	N423 C427	N423-T425 PolarHBondContact O-N 2.97Å; N423-T425 PolarHBondContact O-OG1 3.15Å; T425-C427 VanDerWaalsContact C-N 3.33Å; T425-C427 PolarHBondContact O-N 3.25Å
426	K	43.6	Very low	41.4	Very low	141 Å²	141	112.6 Å²	112.6	61%	0.613	60%	0.597	S	S	*	*			trans	-66.2	89.8	173.9	-82.3	-161.6	171.5	-163.8	0	110.8	E424 L428	E424-K426 PolarHBondContact O-N 2.87Å; K426-L428 PolarHBondContact O-N 3.01Å
427	C	39.7	Very low	41.7	Very low	40 Å²	40	112.1 Å²	112.1	27%	0.27	59%	0.594	S	S	.	*			trans	-66.6	125.5	165.6	-60.3	0	0	0	0	110.1	C421 T425 C429	C421-C427 HydrophobicContact CB-CB 3.86Å; C421-C427 WeakPolarHBondContact CB-SG 3.24Å; C421-C427 WeakPolarHBondContact SG-CB 3.28Å; C421-C427 CovalentContact SG-SG 2.03Å; C421-C427 PolarHBondContact SG-SG 3.27Å; T425-C427 VanDerWaalsContact C-N 3.33Å; T425-C427 PolarHBondContact O-N 3.25Å; C427-C429 PolarHBondContact O-N 3.04Å
428	L	43	Very low	41.7	Very low	110 Å²	110	113 Å²	113	58%	0.576	59%	0.59	S	S	*	*			trans	-79.1	104.2	165	-91.1	159.2	0	0	0	108.3	K426 Y438	K426-L428 PolarHBondContact O-N 3.01Å; L428-Y438 HydrophobicContact CD1-CD1 3.71Å; L428-Y438 HydrophobicContact CD1-CD2 4.28Å; L428-Y438 HydrophobicContact CD1-CE1 4.02Å; L428-Y438 HydrophobicContact CD1-CG 3.85Å; L428-Y438 HydrophobicContact CD2-CD2 4.04Å; L428-Y438 HydrophobicContact CD2-CE1 4.27Å; L428-Y438 HydrophobicContact CD2-CE2 3.74Å; L428-Y438 HydrophobicContact CD2-CG 4.43Å; L428-Y438 HydrophobicContact CG-CD1 4.22Å; L428-Y438 HydrophobicContact CG-CE1 4.01Å; L428-Y438 HydrophobicContact CG-CE2 4.37Å; L428-Y438 HydrophobicContact CG-CG 4.5Å
429	C	41.3	Very low	41.9	Very low	46 Å²	46	111.8 Å²	111.8	31%	0.311	59%	0.585	S	S	.	*			trans	-97.1	149.9	155.1	-79.8	0	0	0	0	109.9	C419 C427	C419-C429 HydrophobicContact CB-CB 3.61Å; C419-C429 WeakPolarHBondContact CB-SG 3.49Å; C419-C429 WeakPolarHBondContact SG-CB 3.5Å; C419-C429 CovalentContact SG-SG 2.02Å; C419-C429 PolarHBondContact SG-SG 3.3Å; C427-C429 PolarHBondContact O-N 3.04Å
430	D	37.9	Very low	42	Very low	110 Å²	110	117.2 Å²	117.2	59%	0.588	61%	0.613	S	S	*	*			trans	-76.9	134.5	-154.8	-161.9	-4.5	0	0	0	112.5	R432	D430-R432 PolarHBondContact OD1-N 3.13Å
431	N	41.7	Very low	42	Very low	130 Å²	130	119.8 Å²	119.8	70%	0.695	61%	0.614	S	S	*	*			trans	-154.2	109.1	150.1	-112.8	-36.2	0	0	0	108.1	I433	N431-I433 PolarHBondContact O-N 3.11Å
432	R	39.7	Very low	42	Very low	224 Å²	224	123.8 Å²	123.8	85%	0.845	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-46.5	108.9	172.6	-75.9	173.1	162.5	-179.2	-5.6	110.5	D430	D430-R432 PolarHBondContact OD1-N 3.13Å
433	I	41.8	Very low	41.8	Very low	163 Å²	163	123.1 Å²	123.1	84%	0.836	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	176.7	-31.5	150.2	-96.1	151.5	0	0	0	111.9	N431 A435	N431-I433 PolarHBondContact O-N 3.11Å; I433-A435 PolarHBondContact O-N 3.15Å
434	Q	42.3	Very low	41.6	Very low	138 Å²	138	120.6 Å²	120.6	65%	0.645	63%	0.631	S	S	*	*			trans	-101.3	55.8	-172.6	-63.9	-160.7	5.4	0	0	116	N436	Q434-N436 PolarHBondContact O-N 3.17Å
435	A	37.3	Very low	41.6	Very low	90 Å²	90	116.4 Å²	116.4	74%	0.744	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-65.1	-18.6	176.5	0	0	0	0	0	114.6	I433 N437	I433-A435 PolarHBondContact O-N 3.15Å; A435-N437 PolarHBondContact O-N 3.46Å
436	N	39.1	Very low	41.4	Very low	148 Å²	148	115 Å²	115	79%	0.791	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-85.9	-5.2	-161.1	-64.8	-2.8	0	0	0	116.2	Q434	Q434-N436 PolarHBondContact O-N 3.17Å
437	N	43.9	Very low	41.3	Very low	123 Å²	123	113.4 Å²	113.4	66%	0.658	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-119.8	2	-169.1	-77.5	-34.7	0	0	0	116.1	A435	A435-N437 PolarHBondContact O-N 3.46Å
438	Y	40.4	Very low	41.5	Very low	95 Å²	95	115.3 Å²	115.3	37%	0.373	63%	0.634	S	S	.	*			trans	-105.2	10.7	-168.3	-89.8	-78.1	0	0	0	116.9	L428 N440	L428-Y438 HydrophobicContact CD1-CD1 3.71Å; L428-Y438 HydrophobicContact CD1-CD2 4.28Å; L428-Y438 HydrophobicContact CD1-CE1 4.02Å; L428-Y438 HydrophobicContact CD1-CG 3.85Å; L428-Y438 HydrophobicContact CD2-CD2 4.04Å; L428-Y438 HydrophobicContact CD2-CE1 4.27Å; L428-Y438 HydrophobicContact CD2-CE2 3.74Å; L428-Y438 HydrophobicContact CD2-CG 4.43Å; L428-Y438 HydrophobicContact CG-CD1 4.22Å; L428-Y438 HydrophobicContact CG-CE1 4.01Å; L428-Y438 HydrophobicContact CG-CE2 4.37Å; L428-Y438 HydrophobicContact CG-CG 4.5Å; Y438-N440 PolarHBondContact O-N 2.92Å; Y438-N440 VanDerWaalsContact O-N 3.12Å
439	S	45.1	Very low	41.4	Very low	75 Å²	75	116.2 Å²	116.2	52%	0.524	64%	0.635	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61	-19	177.6	48.2	0	0	0	0	115.6	R452	S439-R452 PolarHBondContact O-NH2 3.45Å
440	N	43	Very low	41.7	Very low	140 Å²	140	121.5 Å²	121.5	75%	0.749	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	13.6	-160.5	-69.3	-19.3	0	0	0	116.2	Y438	Y438-N440 PolarHBondContact O-N 2.92Å; Y438-N440 VanDerWaalsContact O-N 3.12Å
441	R	44.3	Very low	42.5	Very low	175 Å²	175	121.2 Å²	121.2	66%	0.66	65%	0.647	S	S	*	*			trans	-133.7	-2.2	177.8	-68.7	-167	-178.7	-151	-1.5	116.7	S443	R441-S443 PolarHBondContact O-N 2.86Å; R441-S443 VanDerWaalsContact O-N 3.09Å
442	L	43	Very low	43.4	Very low	115 Å²	115	121.3 Å²	121.3	60%	0.602	64%	0.637	S	S	*	*			trans	-83.6	90.7	-179.8	-141.2	74.1	0	0	0	111	R452	L442-R452 PolarHBondContact O-NH1 3.22Å
443	S	40	Very low	44.9	Very low	104 Å²	104	113 Å²	113	73%	0.727	61%	0.61	S	S	*	*			trans	-129.8	89.5	174.1	-68.9	0	0	0	0	109.2	R441	R441-S443 PolarHBondContact O-N 2.86Å; R441-S443 VanDerWaalsContact O-N 3.09Å
444	S	44	Very low	46.6	Very low	85 Å²	85	107 Å²	107	59%	0.594	58%	0.582	S	S	*	*			trans	-136.6	106.2	171.1	-55.5	0	0	0	0	107
445	S	39.2	Very low	48.8	Very low	105 Å²	105	100.5 Å²	100.5	73%	0.734	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	156.1	-158.3	-57.4	0	0	0	0	114.2
446	G	39.7	Very low	51.2	Low	57 Å²	57	99 Å²	99	59%	0.588	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	111.9	-93.4	177.7	0	0	0	0	0	112.3
447	V	41.2	Very low	53.7	Low	109 Å²	109	96.2 Å²	96.2	66%	0.661	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-23.9	-164.1	-172.6	0	0	0	0	114
448	I	42.7	Very low	55.9	Low	80 Å²	80	95.6 Å²	95.6	41%	0.41	52%	0.518	S	S	.	.	S	Bend	trans	-88.1	-18.8	-174.3	-56.3	177.3	0	0	0	112.3	E450 Y451	I448-E450 PolarHBondContact O-N 3.24Å; I448-Y451 PolarHBondContact O-N 3.42Å
449	E	42.2	Very low	58.4	Low	129 Å²	129	91.5 Å²	91.5	60%	0.603	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-70.4	-30.5	-173.5	-67.2	-172.3	177	0	0	113.6	Y451 R452	E449-Y451 PolarHBondContact O-N 2.93Å; E449-R452 PolarHBondContact O-N 3.32Å
450	E	47.4	Very low	60.7	Low	157 Å²	157	88 Å²	88	73%	0.734	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-69	-15.2	179.3	-166.6	161.5	-141.4	0	0	113.4	I448	I448-E450 PolarHBondContact O-N 3.24Å
451	Y	54.4	Low	63.2	Low	104 Å²	104	84.7 Å²	84.7	41%	0.408	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-112.9	6.8	-178.9	-77.7	-83.5	0	0	0	114.9	Y215 I448 E449	Y215-Y451 HydrophobicContact CD2-CE1 4.46Å; Y215-Y451 HydrophobicContact CG-CE1 4.26Å; I448-Y451 PolarHBondContact O-N 3.42Å; E449-Y451 PolarHBondContact O-N 2.93Å
452	R	60.2	Low	65.6	Low	131 Å²	131	79.5 Å²	79.5	49%	0.494	45%	0.447	S	S	.	.	S	Bend	trans	-86.6	128.9	172.3	-170	175.1	-168.8	132.9	8	109.4	S439 L442 E449 P454	S439-R452 PolarHBondContact O-NH2 3.45Å; L442-R452 PolarHBondContact O-NH1 3.22Å; E449-R452 PolarHBondContact O-N 3.32Å; R452-P454 VanDerWaalsContact O-CD 3.23Å; R452-P454 WeakPolarHBondContact O-CD 3.31Å
453	D	71.6	Confident	68.1	Low	51 Å²	51	74.8 Å²	74.8	27%	0.273	42%	0.421	S	S	.	.			trans	-51.8	114.5	176.1	174	18.2	0	0	0	110.5	I212 W455	I212-D453 HydrophobicContact CD1-CB 4.28Å; D453-W455 VanDerWaalsContact C-N 3.29Å; D453-W455 PolarHBondContact O-N 3.49Å; D453-W455 PolarHBondContact OD1-N 2.86Å
454	P	78.5	Confident	70.8	Confident	37 Å²	37	69.8 Å²	69.8	24%	0.24	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-26.1	-179.6	26.1	-31.5	0	0	0	112.2	Q208 R452 T456 I476	Q208-P454 HydrophobicContact CG-CG 4.19Å; R452-P454 VanDerWaalsContact O-CD 3.23Å; R452-P454 WeakPolarHBondContact O-CD 3.31Å; P454-T456 PolarHBondContact O-N 2.9Å; P454-T456 VanDerWaalsContact O-N 3.16Å; P454-I476 HydrophobicContact CB-CD1 4.13Å; P454-I476 HydrophobicContact CB-CG1 3.83Å; P454-I476 HydrophobicContact CB-CG2 4.31Å
455	W	87.4	Confident	73.2	Confident	1 Å²	1	68 Å²	68	0%	0.004	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	35.7	-174.8	-56.3	104.2	0	0	0	113.4	F200 R201 E204 Q205 Q208 D453 A460 Y463 I476	F200-W455 HydrophobicContact CB-CE3 4.18Å; F200-W455 HydrophobicContact CB-CH2 4.35Å; F200-W455 HydrophobicContact CB-CZ3 3.68Å; R201-W455 WeakPolarHBondContact CG-O 3.3Å; R201-W455 PolarHBondContact NE-O 2.89Å; E204-W455 VanDerWaalsContact CB-CD1 3.49Å; E204-W455 HydrophobicContact CB-CD2 3.81Å; E204-W455 VanDerWaalsContact CB-CE2 3.47Å; E204-W455 HydrophobicContact CB-CG 3.85Å; E204-W455 HydrophobicContact CB-CZ2 4.04Å; E204-W455 VanDerWaalsContact CB-NE1 3.26Å; E204-W455 HydrophobicContact CG-CD2 4.37Å; E204-W455 HydrophobicContact CG-CH2 4.39Å; E204-W455 HydrophobicContact CG-CZ2 3.74Å; Q205-W455 HydrophobicContact CG-CB 3.88Å; Q208-W455 VanDerWaalsContact CG-CD1 3.44Å; D453-W455 VanDerWaalsContact C-N 3.29Å; D453-W455 PolarHBondContact O-N 3.49Å; D453-W455 PolarHBondContact OD1-N 2.86Å; W455-A460 HydrophobicContact CE3-CB 3.91Å; W455-A460 HydrophobicContact CZ3-CB 4.5Å; W455-Y463 AromaticContact CH2-CD1 3.77Å; W455-Y463 HydrophobicContact CH2-CD1 3.77Å; W455-Y463 HydrophobicContact CH2-CD2 4.26Å; W455-Y463 HydrophobicContact CH2-CE1 4.07Å; W455-Y463 AromaticContact CH2-CG 3.87Å; W455-Y463 HydrophobicContact CH2-CG 3.87Å; W455-Y463 AromaticContact CZ3-CD1 3.66Å; W455-Y463 HydrophobicContact CZ3-CD1 3.66Å; W455-Y463 HydrophobicContact CZ3-CE1 4.34Å; W455-Y463 AromaticContact CZ3-CG 3.83Å; W455-Y463 HydrophobicContact CZ3-CG 3.83Å; W455-I476 HydrophobicContact CD2-CG2 4.34Å; W455-I476 HydrophobicContact CE3-CG2 4.25Å; W455-I476 HydrophobicContact CH2-CG2 3.59Å; W455-I476 HydrophobicContact CZ2-CG2 3.66Å; W455-I476 HydrophobicContact CZ3-CG2 3.89Å
456	T	88.5	Confident	75.9	Confident	59 Å²	59	63.5 Å²	63.5	36%	0.362	34%	0.34	S	S	.	.	S	Bend	trans	-52.6	155.2	153.5	62.3	0	0	0	0	110.4	P454 T458 G459 A460	P454-T456 PolarHBondContact O-N 2.9Å; P454-T456 VanDerWaalsContact O-N 3.16Å; T456-T458 PolarHBondContact O-N 2.88Å; T456-G459 PolarHBondContact O-N 2.9Å; T456-G459 VanDerWaalsContact O-N 3.1Å; T456-G459 PolarHBondContact OG1-N 3.36Å; T456-G459 VanDerWaalsContact OG1-N 3.08Å; T456-A460 WeakPolarHBondContact O-CB 3.32Å; T456-A460 PolarHBondContact O-N 3.37Å
457	L	90.4	Very high	78.6	Confident	88 Å²	88	61.9 Å²	61.9	46%	0.461	32%	0.319	S	S	.	.	H	α-helix	trans	-54.6	-39.5	177.8	-176.4	63.7	0	0	0	112.2	L198 L461	L198-L457 HydrophobicContact CD2-CD1 4.15Å; L457-L461 VanDerWaalsContact O-CB 3.25Å; L457-L461 WeakPolarHBondContact O-CB 3.5Å; L457-L461 PolarHBondContact O-N 2.88Å
458	T	91.9	Very high	81.3	Confident	111 Å²	111	56.8 Å²	56.8	68%	0.681	29%	0.288	S	S	*	.	H	α-helix	trans	-68.6	-43.1	177	-45.5	0	0	0	0	112.3	T456 L461 L462	T456-T458 PolarHBondContact O-N 2.88Å; T458-L461 PolarHBondContact O-N 2.9Å; T458-L462 VanDerWaalsContact O-CB 3.3Å; T458-L462 WeakPolarHBondContact O-CB 3.5Å; T458-L462 PolarHBondContact O-N 3.27Å
459	G	91.4	Very high	83.7	Confident	9 Å²	9	55.2 Å²	55.2	9%	0.093	28%	0.282	C	S	.	.	H	α-helix	trans	-66.1	-42.2	177.4	0	0	0	0	0	112.6	T456 L462 Y463	T456-G459 PolarHBondContact O-N 2.9Å; T456-G459 VanDerWaalsContact O-N 3.1Å; T456-G459 PolarHBondContact OG1-N 3.36Å; T456-G459 VanDerWaalsContact OG1-N 3.08Å; G459-L462 PolarHBondContact O-N 2.86Å; G459-Y463 WeakPolarHBondContact O-CB 3.33Å; G459-Y463 PolarHBondContact O-N 3.34Å
460	A	94.3	Very high	86.3	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-65.4	-37.2	174.7	0	0	0	0	0	112.6	A197 R201 W455 T456 A464	A197-A460 HydrophobicContact CB-CB 4.43Å; A197-A460 WeakPolarHBondContact O-CB 3.3Å; R201-A460 HydrophobicContact CB-CB 3.95Å; W455-A460 HydrophobicContact CE3-CB 3.91Å; W455-A460 HydrophobicContact CZ3-CB 4.5Å; T456-A460 WeakPolarHBondContact O-CB 3.32Å; T456-A460 PolarHBondContact O-N 3.37Å; A460-A464 VanDerWaalsContact O-CB 3.25Å; A460-A464 WeakPolarHBondContact O-CB 3.46Å; A460-A464 PolarHBondContact O-N 3.47Å
461	L	95.3	Very high	88.6	Confident	71 Å²	71	51 Å²	51	37%	0.372	27%	0.271	S	S	.	.	H	α-helix	trans	-68.8	-44	173.8	-174.2	155	0	0	0	111.8	A197 L457 T458 Y463 A464 V465	A197-L461 HydrophobicContact CB-CB 3.81Å; A197-L461 HydrophobicContact CB-CG 4.44Å; L457-L461 VanDerWaalsContact O-CB 3.25Å; L457-L461 WeakPolarHBondContact O-CB 3.5Å; L457-L461 PolarHBondContact O-N 2.88Å; T458-L461 PolarHBondContact O-N 2.9Å; L461-Y463 VanDerWaalsContact C-N 3.33Å; L461-Y463 PolarHBondContact O-N 3.17Å; L461-A464 PolarHBondContact O-N 2.59Å; L461-V465 HydrophobicContact CD2-CG2 4.02Å; L461-V465 WeakPolarHBondContact O-CB 3.2Å; L461-V465 WeakPolarHBondContact O-CG2 3.42Å; L461-V465 PolarHBondContact O-N 3.35Å
462	L	94.5	Very high	90.4	Very high	67 Å²	67	48.6 Å²	48.6	35%	0.351	28%	0.278	S	S	.	.	H	α-helix	trans	-60.4	-45.1	175.4	-173	152.7	0	0	0	110.5	T458 G459 V465 T466 Y473	T458-L462 VanDerWaalsContact O-CB 3.3Å; T458-L462 WeakPolarHBondContact O-CB 3.5Å; T458-L462 PolarHBondContact O-N 3.27Å; G459-L462 PolarHBondContact O-N 2.86Å; L462-V465 PolarHBondContact O-N 3.45Å; L462-T466 HydrophobicContact CD2-CG2 3.99Å; L462-T466 WeakPolarHBondContact O-CG2 3.32Å; L462-T466 PolarHBondContact O-N 2.88Å; L462-T466 PolarHBondContact O-OG1 3.36Å; L462-Y473 HydrophobicContact CD2-CD2 4.01Å; L462-Y473 HydrophobicContact CD2-CE2 4.34Å
463	Y	95.4	Very high	91.9	Very high	15 Å²	15	49.2 Å²	49.2	6%	0.059	28%	0.282	C	S	.	.	H	α-helix	trans	-55.5	-56.3	171.7	177.9	-102.2	0	0	0	111.5	F200 W455 G459 L461 V465 T466 V467 I476 P478 T487	F200-Y463 HydrophobicContact CB-CD1 4.37Å; F200-Y463 AromaticContact CD1-CE1 3.96Å; F200-Y463 HydrophobicContact CD1-CE1 3.96Å; F200-Y463 AromaticContact CD2-CD1 3.71Å; F200-Y463 HydrophobicContact CD2-CD1 3.71Å; F200-Y463 AromaticContact CD2-CE1 3.73Å; F200-Y463 HydrophobicContact CD2-CE1 3.73Å; F200-Y463 HydrophobicContact CE1-CE1 4.04Å; F200-Y463 HydrophobicContact CE2-CD1 4.15Å; F200-Y463 AromaticContact CE2-CE1 3.82Å; F200-Y463 HydrophobicContact CE2-CE1 3.82Å; F200-Y463 AromaticContact CG-CD1 3.96Å; F200-Y463 HydrophobicContact CG-CD1 3.96Å; F200-Y463 AromaticContact CG-CE1 3.83Å; F200-Y463 HydrophobicContact CG-CE1 3.83Å; F200-Y463 AromaticContact CZ-CE1 3.98Å; F200-Y463 HydrophobicContact CZ-CE1 3.98Å; W455-Y463 AromaticContact CH2-CD1 3.77Å; W455-Y463 HydrophobicContact CH2-CD1 3.77Å; W455-Y463 HydrophobicContact CH2-CD2 4.26Å; W455-Y463 HydrophobicContact CH2-CE1 4.07Å; W455-Y463 AromaticContact CH2-CG 3.87Å; W455-Y463 HydrophobicContact CH2-CG 3.87Å; W455-Y463 AromaticContact CZ3-CD1 3.66Å; W455-Y463 HydrophobicContact CZ3-CD1 3.66Å; W455-Y463 HydrophobicContact CZ3-CE1 4.34Å; W455-Y463 AromaticContact CZ3-CG 3.83Å; W455-Y463 HydrophobicContact CZ3-CG 3.83Å; G459-Y463 WeakPolarHBondContact O-CB 3.33Å; G459-Y463 PolarHBondContact O-N 3.34Å; L461-Y463 VanDerWaalsContact C-N 3.33Å; L461-Y463 PolarHBondContact O-N 3.17Å; Y463-V465 VanDerWaalsContact C-N 3.26Å; Y463-V465 PolarHBondContact O-N 3.19Å; Y463-T466 PolarHBondContact O-N 3.49Å; Y463-T466 PolarHBondContact O-OG1 3.22Å; Y463-V467 HydrophobicContact CD1-CG2 4.4Å; Y463-V467 HydrophobicContact CD2-CG2 4.38Å; Y463-V467 HydrophobicContact CE1-CG2 3.89Å; Y463-V467 HydrophobicContact CE2-CG2 3.85Å; Y463-V467 WeakPolarHBondContact O-CG2 3.48Å; Y463-V467 PolarHBondContact O-N 3.25Å; Y463-I476 HydrophobicContact CD2-CG2 4.21Å; Y463-I476 VanDerWaalsContact CD2-O 3.28Å; Y463-I476 WeakPolarHBondContact CD2-O 2.8Å; Y463-I476 HydrophobicContact CG-CG2 4.34Å; Y463-P478 WeakPolarHBondContact OH-CD 3.34Å; Y463-T487 WeakPolarHBondContact OH-CG2 3.42Å; Y463-T487 PolarHBondContact OH-OG1 3.1Å
464	A	96	Very high	92.8	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-57.7	-34.2	-178.8	0	0	0	0	0	113.4	F200 A460 L461 Y490	F200-A464 HydrophobicContact CD2-CB 4.41Å; A460-A464 VanDerWaalsContact O-CB 3.25Å; A460-A464 WeakPolarHBondContact O-CB 3.46Å; A460-A464 PolarHBondContact O-N 3.47Å; L461-A464 PolarHBondContact O-N 2.59Å; A464-Y490 HydrophobicContact CB-CE1 4.35Å; A464-Y490 WeakPolarHBondContact O-CE1 3.39Å; A464-Y490 PolarHBondContact O-OH 3.02Å
465	V	95.7	Very high	93.1	Very high	48 Å²	48	53.5 Å²	53.5	29%	0.291	31%	0.31	S	S	.	.	H	α-helix	trans	-70.8	-47.5	171.9	169.9	0	0	0	0	111.2	C193 L461 L462 Y463 V467 I468 T469	C193-V465 HydrophobicContact CB-CG2 4.13Å; L461-V465 HydrophobicContact CD2-CG2 4.02Å; L461-V465 WeakPolarHBondContact O-CB 3.2Å; L461-V465 WeakPolarHBondContact O-CG2 3.42Å; L461-V465 PolarHBondContact O-N 3.35Å; L462-V465 PolarHBondContact O-N 3.45Å; Y463-V465 VanDerWaalsContact C-N 3.26Å; Y463-V465 PolarHBondContact O-N 3.19Å; V465-V467 VanDerWaalsContact C-N 3.26Å; V465-V467 PolarHBondContact O-N 3.35Å; V465-I468 WeakPolarHBondContact O-CG1 3.5Å; V465-I468 PolarHBondContact O-N 3.41Å; V465-T469 HydrophobicContact CG1-CG2 4.09Å; V465-T469 WeakPolarHBondContact O-CB 3.18Å; V465-T469 WeakPolarHBondContact O-CG2 3.46Å; V465-T469 PolarHBondContact O-N 3.13Å; V465-T469 PolarHBondContact O-OG1 3.2Å
466	T	96	Very high	93.1	Very high	10 Å²	10	54.5 Å²	54.5	6%	0.061	32%	0.315	C	S	.	.	H	α-helix	trans	-66.6	-24.6	-176.3	60.1	0	0	0	0	114	L462 Y463 T469 T470 I471 G472 Y473	L462-T466 HydrophobicContact CD2-CG2 3.99Å; L462-T466 WeakPolarHBondContact O-CG2 3.32Å; L462-T466 PolarHBondContact O-N 2.88Å; L462-T466 PolarHBondContact O-OG1 3.36Å; Y463-T466 PolarHBondContact O-N 3.49Å; Y463-T466 PolarHBondContact O-OG1 3.22Å; T466-T469 WeakPolarHBondContact CA-OG1 3.25Å; T466-T470 PolarHBondContact O-N 3.38Å; T466-I471 HydrophobicContact CG2-CB 4.4Å; T466-I471 HydrophobicContact CG2-CG2 4.46Å; T466-I471 PolarHBondContact O-N 2.87Å; T466-G472 PolarHBondContact O-N 3.25Å; T466-G472 VanDerWaalsContact O-N 3.1Å; T466-Y473 HydrophobicContact CG2-CD2 3.41Å; T466-Y473 VanDerWaalsContact CG2-CD2 3.41Å; T466-Y473 HydrophobicContact CG2-CE2 3.58Å; T466-Y473 HydrophobicContact CG2-CG 4.36Å
467	V	96.4	Very high	93.3	Very high	22 Å²	22	54.3 Å²	54.3	13%	0.133	31%	0.314	C	S	.	.	H	α-helix	trans	-69.7	-55.4	171.1	174.2	0	0	0	0	110.8	Y463 V465 T469 T470 T487 Y490 A491	Y463-V467 HydrophobicContact CD1-CG2 4.4Å; Y463-V467 HydrophobicContact CD2-CG2 4.38Å; Y463-V467 HydrophobicContact CE1-CG2 3.89Å; Y463-V467 HydrophobicContact CE2-CG2 3.85Å; Y463-V467 WeakPolarHBondContact O-CG2 3.48Å; Y463-V467 PolarHBondContact O-N 3.25Å; V465-V467 VanDerWaalsContact C-N 3.26Å; V465-V467 PolarHBondContact O-N 3.35Å; V467-T469 VanDerWaalsContact C-N 3.31Å; V467-T469 PolarHBondContact O-N 3.04Å; V467-T470 PolarHBondContact O-N 3.43Å; V467-T470 VanDerWaalsContact O-N 3.09Å; V467-T487 HydrophobicContact CG1-CG2 4.23Å; V467-T487 HydrophobicContact CG2-CG2 4.29Å; V467-Y490 HydrophobicContact CB-CD1 4.36Å; V467-Y490 HydrophobicContact CB-CE1 4.22Å; V467-Y490 HydrophobicContact CG1-CD1 3.9Å; V467-Y490 HydrophobicContact CG1-CE1 4.21Å; V467-A491 HydrophobicContact CG1-CB 3.94Å
468	I	96.2	Very high	93.4	Very high	3 Å²	3	50.6 Å²	50.6	2%	0.015	30%	0.295	C	S	.	.	H	α-helix	trans	-72	-25	-175.1	68.3	173	0	0	0	113.5	V189 Y192 C193 V465 T470 Y490 V498	V189-I468 HydrophobicContact CG1-CD1 4.27Å; Y192-I468 HydrophobicContact CD1-CD1 4.5Å; Y192-I468 HydrophobicContact CD1-CG2 4.26Å; Y192-I468 HydrophobicContact CE1-CG2 3.97Å; C193-I468 WeakPolarHBondContact SG-CD1 3.21Å; V465-I468 WeakPolarHBondContact O-CG1 3.5Å; V465-I468 PolarHBondContact O-N 3.41Å; I468-T470 VanDerWaalsContact C-N 3.31Å; I468-Y490 HydrophobicContact CG2-CD1 4.12Å; I468-Y490 HydrophobicContact CG2-CE1 3.39Å; I468-V498 HydrophobicContact CB-CG2 3.85Å; I468-V498 HydrophobicContact CD1-CG2 3.55Å; I468-V498 HydrophobicContact CG1-CG2 3.66Å
469	T	95	Very high	93.4	Very high	47 Å²	47	50 Å²	50	29%	0.288	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-1.4	173.2	55.1	0	0	0	0	113.2	V465 T466 V467 I471	V465-T469 HydrophobicContact CG1-CG2 4.09Å; V465-T469 WeakPolarHBondContact O-CB 3.18Å; V465-T469 WeakPolarHBondContact O-CG2 3.46Å; V465-T469 PolarHBondContact O-N 3.13Å; V465-T469 PolarHBondContact O-OG1 3.2Å; T466-T469 WeakPolarHBondContact CA-OG1 3.25Å; V467-T469 VanDerWaalsContact C-N 3.31Å; V467-T469 PolarHBondContact O-N 3.04Å; T469-I471 PolarHBondContact O-N 3.29Å; T469-I471 WeakPolarHBondContact OG1-CD1 3.28Å; T469-I471 WeakPolarHBondContact OG1-CG1 3.28Å
470	T	96	Very high	93.5	Very high	104 Å²	104	50.9 Å²	50.9	64%	0.638	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	18	-177.8	63.2	0	0	0	0	115.5	T466 V467 I468 I495	T466-T470 PolarHBondContact O-N 3.38Å; V467-T470 PolarHBondContact O-N 3.43Å; V467-T470 VanDerWaalsContact O-N 3.09Å; I468-T470 VanDerWaalsContact C-N 3.31Å; T470-I495 HydrophobicContact CG2-CD1 3.69Å; T470-I495 HydrophobicContact CG2-CG1 3.88Å; T470-I495 HydrophobicContact CG2-CG2 4.38Å
471	I	95.7	Very high	93.5	Very high	92 Å²	92	56.4 Å²	56.4	47%	0.472	32%	0.316	S	S	.	.			trans	-74.5	-40	179	-63	173.1	0	0	0	112.1	T466 T469 Y473	T466-I471 HydrophobicContact CG2-CB 4.4Å; T466-I471 HydrophobicContact CG2-CG2 4.46Å; T466-I471 PolarHBondContact O-N 2.87Å; T469-I471 PolarHBondContact O-N 3.29Å; T469-I471 WeakPolarHBondContact OG1-CD1 3.28Å; T469-I471 WeakPolarHBondContact OG1-CG1 3.28Å; I471-Y473 HydrophobicContact CG2-CD1 3.79Å; I471-Y473 HydrophobicContact CG2-CD2 4.32Å; I471-Y473 HydrophobicContact CG2-CE1 3.5Å; I471-Y473 VanDerWaalsContact CG2-CE1 3.5Å; I471-Y473 HydrophobicContact CG2-CE2 4.07Å; I471-Y473 HydrophobicContact CG2-CG 4.19Å; I471-Y473 PolarHBondContact O-N 2.81Å
472	G	92.3	Very high	93.5	Very high	54 Å²	54	58 Å²	58	56%	0.557	33%	0.325	S	S	*	.			trans	52.9	48.8	168	0	0	0	0	0	117.9	T466 G474	T466-G472 PolarHBondContact O-N 3.25Å; T466-G472 VanDerWaalsContact O-N 3.1Å; G472-G474 PolarHBondContact O-N 2.94Å
473	Y	92.5	Very high	93.5	Very high	145 Å²	145	54.9 Å²	54.9	57%	0.569	31%	0.308	S	S	*	.			trans	-55.5	-13.8	-174.9	-65.8	-54.6	0	0	0	117.5	L462 T466 I471 H475	L462-Y473 HydrophobicContact CD2-CD2 4.01Å; L462-Y473 HydrophobicContact CD2-CE2 4.34Å; T466-Y473 HydrophobicContact CG2-CD2 3.41Å; T466-Y473 VanDerWaalsContact CG2-CD2 3.41Å; T466-Y473 HydrophobicContact CG2-CE2 3.58Å; T466-Y473 HydrophobicContact CG2-CG 4.36Å; I471-Y473 HydrophobicContact CG2-CD1 3.79Å; I471-Y473 HydrophobicContact CG2-CD2 4.32Å; I471-Y473 HydrophobicContact CG2-CE1 3.5Å; I471-Y473 VanDerWaalsContact CG2-CE1 3.5Å; I471-Y473 HydrophobicContact CG2-CE2 4.07Å; I471-Y473 HydrophobicContact CG2-CG 4.19Å; I471-Y473 PolarHBondContact O-N 2.81Å; Y473-H475 VanDerWaalsContact CB-ND1 3.31Å; Y473-H475 WeakPolarHBondContact CB-ND1 3.48Å; Y473-H475 AromaticContact CD2-CE1 3.93Å; Y473-H475 PolarHBondContact O-N 3.47Å
474	G	88.9	Confident	93.6	Very high	50 Å²	50	59.9 Å²	59.9	52%	0.515	33%	0.327	S	S	.	.	S	Bend	trans	71.9	-16.2	173.1	0	0	0	0	0	118	G472	G472-G474 PolarHBondContact O-N 2.94Å
475	H	84.5	Confident	93.6	Very high	127 Å²	127	62.5 Å²	62.5	59%	0.588	35%	0.349	S	S	*	.	S	Bend	trans	-68.9	-32.6	179.6	68.5	-78.5	0	0	0	113.5	Y473	Y473-H475 VanDerWaalsContact CB-ND1 3.31Å; Y473-H475 WeakPolarHBondContact CB-ND1 3.48Å; Y473-H475 AromaticContact CD2-CE1 3.93Å; Y473-H475 PolarHBondContact O-N 3.47Å
476	I	89.1	Confident	93.6	Very high	22 Å²	22	62.2 Å²	62.2	11%	0.113	35%	0.345	C	S	.	.	S	Bend	trans	-113.5	123.9	168.1	-62.5	171.5	0	0	0	107.6	P454 W455 Y463	P454-I476 HydrophobicContact CB-CD1 4.13Å; P454-I476 HydrophobicContact CB-CG1 3.83Å; P454-I476 HydrophobicContact CB-CG2 4.31Å; W455-I476 HydrophobicContact CD2-CG2 4.34Å; W455-I476 HydrophobicContact CE3-CG2 4.25Å; W455-I476 HydrophobicContact CH2-CG2 3.59Å; W455-I476 HydrophobicContact CZ2-CG2 3.66Å; W455-I476 HydrophobicContact CZ3-CG2 3.89Å; Y463-I476 HydrophobicContact CD2-CG2 4.21Å; Y463-I476 VanDerWaalsContact CD2-O 3.28Å; Y463-I476 WeakPolarHBondContact CD2-O 2.8Å; Y463-I476 HydrophobicContact CG-CG2 4.34Å
477	V	91.9	Very high	93.6	Very high	56 Å²	56	62.9 Å²	62.9	34%	0.339	35%	0.349	S	S	.	.			trans	-146.6	144.6	176.7	-66.6	0	0	0	0	110.5	K479	V477-K479 HydrophobicContact CG2-CD 4.36Å; V477-K479 PolarHBondContact O-N 3.19Å
478	P	93.3	Very high	93.6	Very high	10 Å²	10	66.2 Å²	66.2	7%	0.065	37%	0.37	C	S	.	.			trans	-64.3	132	176.7	26.7	-35.1	0	0	0	111.1	E204 Y463 R484	E204-P478 VanDerWaalsContact CD-CA 3.48Å; E204-P478 HydrophobicContact CG-CB 4.22Å; E204-P478 WeakPolarHBondContact OE1-CA 3.17Å; E204-P478 WeakPolarHBondContact OE1-CB 3.45Å; Y463-P478 WeakPolarHBondContact OH-CD 3.34Å; P478-R484 HydrophobicContact CB-CG 4.45Å; P478-R484 HydrophobicContact CG-CG 4.16Å; P478-R484 PolarHBondContact O-NE 2.67Å
479	K	91.3	Very high	93.7	Very high	97 Å²	97	70.8 Å²	70.8	42%	0.422	39%	0.393	S	S	.	.			trans	-96.7	-26.2	178.1	-57	-56.8	-177.6	178.3	0	111.7	E204 Y207 V477 R484	E204-K479 VanDerWaalsContact CD-N 3.29Å; E204-K479 PolarHBondContact OE1-N 2.93Å; E204-K479 PolarHBondContact OE2-N 2.92Å; Y207-K479 HydrophobicContact CD1-CB 3.91Å; Y207-K479 HydrophobicContact CE1-CB 3.42Å; Y207-K479 VanDerWaalsContact CE1-CB 3.42Å; Y207-K479 HydrophobicContact CE1-CG 4Å; V477-K479 HydrophobicContact CG2-CD 4.36Å; V477-K479 PolarHBondContact O-N 3.19Å; K479-R484 PolarHBondContact O-NH2 3Å
480	T	93.8	Very high	93.8	Very high	29 Å²	29	69.1 Å²	69.1	18%	0.178	38%	0.381	C	S	.	.	S	Bend	trans	-77.3	144.4	174.8	68.6	0	0	0	0	111.5	E204 Y207 L482 G483 R484	E204-T480 VanDerWaalsContact OE1-CB 3.29Å; E204-T480 WeakPolarHBondContact OE1-CB 3.25Å; E204-T480 WeakPolarHBondContact OE1-CG2 3.25Å; E204-T480 PolarHBondContact OE1-N 3.43Å; E204-T480 PolarHBondContact OE1-OG1 3.42Å; Y207-T480 HydrophobicContact CD2-CG2 3.9Å; Y207-T480 HydrophobicContact CG-CG2 3.83Å; T480-L482 VanDerWaalsContact C-N 3.29Å; T480-L482 PolarHBondContact O-N 2.93Å; T480-G483 PolarHBondContact O-N 3.45Å; T480-G483 PolarHBondContact OG1-N 2.88Å; T480-R484 WeakPolarHBondContact O-CG 3.48Å; T480-R484 PolarHBondContact O-N 3.43Å
481	D	94.8	Very high	93.8	Very high	116 Å²	116	65.1 Å²	65.1	62%	0.62	36%	0.359	S	S	*	.	H	α-helix	trans	-67.6	-31.2	178.6	-60.1	-57.1	0	0	0	112.8	R484 A485	D481-R484 PolarHBondContact O-N 2.92Å; D481-R484 IonicContact OD1-CZ 3.67Å; D481-R484 IonicContact OD1-NH1 2.68Å; D481-R484 PolarHBondContact OD1-NH1 2.81Å; D481-A485 WeakPolarHBondContact O-CB 3.39Å; D481-A485 PolarHBondContact O-N 3.48Å
482	L	94.8	Very high	93.9	Very high	105 Å²	105	66.4 Å²	66.4	55%	0.55	37%	0.366	S	S	.	.	H	α-helix	trans	-65.6	-42.6	171.5	-176.5	143.7	0	0	0	111.7	I203 T480 A485 I486	I203-L482 HydrophobicContact CB-CD2 4.36Å; I203-L482 HydrophobicContact CD1-CD2 3.89Å; I203-L482 HydrophobicContact CG1-CD2 3.78Å; I203-L482 HydrophobicContact CG2-CD2 3.62Å; T480-L482 VanDerWaalsContact C-N 3.29Å; T480-L482 PolarHBondContact O-N 2.93Å; L482-A485 PolarHBondContact O-N 2.81Å; L482-I486 HydrophobicContact CD2-CD1 3.63Å; L482-I486 HydrophobicContact CG-CD1 4.13Å; L482-I486 WeakPolarHBondContact O-CB 3.45Å; L482-I486 WeakPolarHBondContact O-CG1 3.44Å; L482-I486 PolarHBondContact O-N 3.49Å
483	G	94.8	Very high	94	Very high	0 Å²	0	70.7 Å²	70.7	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-61	-43.1	173	0	0	0	0	0	112.2	T480 I486 T487	T480-G483 PolarHBondContact O-N 3.45Å; T480-G483 PolarHBondContact OG1-N 2.88Å; G483-I486 PolarHBondContact O-N 2.85Å; G483-T487 PolarHBondContact O-N 3.49Å; G483-T487 PolarHBondContact O-OG1 2.94Å
484	R	96	Very high	94.2	Very high	121 Å²	121	63.8 Å²	63.8	46%	0.457	34%	0.343	S	S	.	.	H	α-helix	trans	-61.7	-48	175.1	-66.5	166.7	-174.2	167.2	-5.5	112.3	P478 K479 T480 D481 I486 T487 V488	P478-R484 HydrophobicContact CB-CG 4.45Å; P478-R484 HydrophobicContact CG-CG 4.16Å; P478-R484 PolarHBondContact O-NE 2.67Å; K479-R484 PolarHBondContact O-NH2 3Å; T480-R484 WeakPolarHBondContact O-CG 3.48Å; T480-R484 PolarHBondContact O-N 3.43Å; D481-R484 PolarHBondContact O-N 2.92Å; D481-R484 IonicContact OD1-CZ 3.67Å; D481-R484 IonicContact OD1-NH1 2.68Å; D481-R484 PolarHBondContact OD1-NH1 2.81Å; R484-I486 PolarHBondContact O-N 3.09Å; R484-T487 WeakPolarHBondContact O-CB 3.33Å; R484-T487 PolarHBondContact O-N 2.91Å; R484-V488 PolarHBondContact O-N 3.24Å
485	A	96.4	Very high	94.6	Very high	55 Å²	55	64 Å²	64	46%	0.455	33%	0.332	S	S	.	.	H	α-helix	trans	-61.8	-43.6	178.7	0	0	0	0	0	111.8	D481 L482 T487 V488 I489	D481-A485 WeakPolarHBondContact O-CB 3.39Å; D481-A485 PolarHBondContact O-N 3.48Å; L482-A485 PolarHBondContact O-N 2.81Å; A485-T487 VanDerWaalsContact C-N 3.32Å; A485-T487 PolarHBondContact O-N 2.97Å; A485-V488 PolarHBondContact O-N 3.43Å; A485-I489 PolarHBondContact O-N 3.01Å
486	I	96.2	Very high	95.1	Very high	42 Å²	42	61.5 Å²	61.5	22%	0.215	33%	0.327	C	S	.	.	H	α-helix	trans	-65.8	-33.6	176.4	-73.2	175.7	0	0	0	111.7	L199 F200 I203 L482 G483 R484 V488 I489 Y490	L199-I486 HydrophobicContact CD2-CG2 3.6Å; L199-I486 HydrophobicContact CG-CG2 4.17Å; F200-I486 HydrophobicContact CE1-CG2 3.91Å; F200-I486 HydrophobicContact CZ-CG2 4.34Å; I203-I486 HydrophobicContact CD1-CD1 3.62Å; I203-I486 HydrophobicContact CD1-CG2 4.27Å; L482-I486 HydrophobicContact CD2-CD1 3.63Å; L482-I486 HydrophobicContact CG-CD1 4.13Å; L482-I486 WeakPolarHBondContact O-CB 3.45Å; L482-I486 WeakPolarHBondContact O-CG1 3.44Å; L482-I486 PolarHBondContact O-N 3.49Å; G483-I486 PolarHBondContact O-N 2.85Å; R484-I486 PolarHBondContact O-N 3.09Å; I486-V488 VanDerWaalsContact C-N 3.32Å; I486-V488 PolarHBondContact O-N 3.36Å; I486-I489 PolarHBondContact O-N 3.46Å; I486-Y490 VanDerWaalsContact O-CB 3.23Å; I486-Y490 WeakPolarHBondContact O-CB 3.38Å; I486-Y490 PolarHBondContact O-N 3.04Å
487	T	96.5	Very high	95.4	Very high	24 Å²	24	62.2 Å²	62.2	15%	0.147	33%	0.33	C	S	.	.	H	α-helix	trans	-58.8	-40.7	172.1	-64.9	0	0	0	0	112.5	F200 Y463 V467 G483 R484 A485 Y490 A491	F200-T487 VanDerWaalsContact CE1-OG1 3.24Å; F200-T487 WeakPolarHBondContact CE1-OG1 3.38Å; Y463-T487 WeakPolarHBondContact OH-CG2 3.42Å; Y463-T487 PolarHBondContact OH-OG1 3.1Å; V467-T487 HydrophobicContact CG1-CG2 4.23Å; V467-T487 HydrophobicContact CG2-CG2 4.29Å; G483-T487 PolarHBondContact O-N 3.49Å; G483-T487 PolarHBondContact O-OG1 2.94Å; R484-T487 WeakPolarHBondContact O-CB 3.33Å; R484-T487 PolarHBondContact O-N 2.91Å; A485-T487 VanDerWaalsContact C-N 3.32Å; A485-T487 PolarHBondContact O-N 2.97Å; T487-Y490 PolarHBondContact O-N 3.3Å; T487-A491 VanDerWaalsContact O-CB 3.31Å; T487-A491 WeakPolarHBondContact O-CB 3.16Å; T487-A491 PolarHBondContact O-N 2.65Å
488	V	96.7	Very high	95.5	Very high	92 Å²	92	60.4 Å²	60.4	56%	0.558	32%	0.319	S	S	*	.	H	α-helix	trans	-64	-45.1	177.9	179.7	0	0	0	0	110.9	R484 A485 I486 A491 L492	R484-V488 PolarHBondContact O-N 3.24Å; A485-V488 PolarHBondContact O-N 3.43Å; I486-V488 VanDerWaalsContact C-N 3.32Å; I486-V488 PolarHBondContact O-N 3.36Å; V488-A491 PolarHBondContact O-N 3.36Å; V488-L492 HydrophobicContact CG1-CD1 4.44Å; V488-L492 WeakPolarHBondContact O-CG 3.46Å; V488-L492 PolarHBondContact O-N 2.82Å
489	I	96.7	Very high	95.6	Very high	98 Å²	98	64.8 Å²	64.8	50%	0.503	34%	0.342	S	S	.	.	H	α-helix	trans	-65.2	-42.4	178.3	-60.3	170	0	0	0	110.9	A485 I486 L492 F493	A485-I489 PolarHBondContact O-N 3.01Å; I486-I489 PolarHBondContact O-N 3.46Å; I489-L492 PolarHBondContact O-N 2.76Å; I489-F493 HydrophobicContact CG2-CD2 4.34Å; I489-F493 HydrophobicContact CG2-CE2 4.15Å; I489-F493 WeakPolarHBondContact O-CD2 3.28Å; I489-F493 PolarHBondContact O-N 3.49Å
490	Y	97.2	Very high	95.7	Very high	12 Å²	12	64.7 Å²	64.7	5%	0.047	35%	0.345	C	S	.	.	H	α-helix	trans	-66.8	-37.1	177.8	178.4	-98.8	0	0	0	112.3	Y192 F200 A464 V467 I468 I486 T487 G494	Y192-Y490 HydrophobicContact CD1-CD2 4.44Å; Y192-Y490 AromaticContact CD1-CE2 3.62Å; Y192-Y490 HydrophobicContact CD1-CE2 3.62Å; Y192-Y490 AromaticContact CD1-CZ 3.91Å; Y192-Y490 AromaticContact CE1-CD2 3.54Å; Y192-Y490 HydrophobicContact CE1-CD2 3.54Å; Y192-Y490 HydrophobicContact CE1-CE1 4.36Å; Y192-Y490 AromaticContact CE1-CE2 3.13Å; Y192-Y490 HydrophobicContact CE1-CE2 3.13Å; Y192-Y490 HydrophobicContact CE1-CG 4.28Å; Y192-Y490 AromaticContact CE1-CZ 3.59Å; Y192-Y490 HydrophobicContact CE2-CE2 4.49Å; Y192-Y490 HydrophobicContact CG-CE2 4.47Å; Y192-Y490 AromaticContact CZ-CD2 3.61Å; Y192-Y490 AromaticContact CZ-CE2 3.64Å; Y192-Y490 WeakPolarHBondContact OH-CD2 3.32Å; Y192-Y490 PolarHBondContact OH-O 3.26Å; F200-Y490 AromaticContact CE2-CD1 3.66Å; F200-Y490 HydrophobicContact CE2-CD1 3.66Å; F200-Y490 HydrophobicContact CE2-CD2 4.35Å; F200-Y490 AromaticContact CE2-CE1 3.88Å; F200-Y490 HydrophobicContact CE2-CE1 3.88Å; F200-Y490 AromaticContact CE2-CG 3.93Å; F200-Y490 HydrophobicContact CE2-CG 3.93Å; F200-Y490 AromaticContact CZ-CD1 3.81Å; F200-Y490 HydrophobicContact CZ-CD1 3.81Å; F200-Y490 HydrophobicContact CZ-CE1 4.48Å; F200-Y490 AromaticContact CZ-CG 3.89Å; F200-Y490 HydrophobicContact CZ-CG 3.89Å; A464-Y490 HydrophobicContact CB-CE1 4.35Å; A464-Y490 WeakPolarHBondContact O-CE1 3.39Å; A464-Y490 PolarHBondContact O-OH 3.02Å; V467-Y490 HydrophobicContact CB-CD1 4.36Å; V467-Y490 HydrophobicContact CB-CE1 4.22Å; V467-Y490 HydrophobicContact CG1-CD1 3.9Å; V467-Y490 HydrophobicContact CG1-CE1 4.21Å; I468-Y490 HydrophobicContact CG2-CD1 4.12Å; I468-Y490 HydrophobicContact CG2-CE1 3.39Å; I486-Y490 VanDerWaalsContact O-CB 3.23Å; I486-Y490 WeakPolarHBondContact O-CB 3.38Å; I486-Y490 PolarHBondContact O-N 3.04Å; T487-Y490 PolarHBondContact O-N 3.3Å; Y490-G494 WeakPolarHBondContact O-CA 3.39Å; Y490-G494 PolarHBondContact O-N 2.68Å
491	A	96.8	Very high	95.6	Very high	21 Å²	21	64 Å²	64	17%	0.174	34%	0.342	C	S	.	.	H	α-helix	trans	-65.5	-42.6	173.5	0	0	0	0	0	112.2	V467 T487 V488 F493 G494 I495	V467-A491 HydrophobicContact CG1-CB 3.94Å; T487-A491 VanDerWaalsContact O-CB 3.31Å; T487-A491 WeakPolarHBondContact O-CB 3.16Å; T487-A491 PolarHBondContact O-N 2.65Å; V488-A491 PolarHBondContact O-N 3.36Å; A491-F493 VanDerWaalsContact C-N 3.32Å; A491-F493 PolarHBondContact O-N 3.27Å; A491-G494 PolarHBondContact O-N 2.86Å; A491-I495 HydrophobicContact CB-CD1 4.1Å; A491-I495 WeakPolarHBondContact O-CB 3.3Å; A491-I495 WeakPolarHBondContact O-CG1 3.28Å; A491-I495 PolarHBondContact O-N 3.47Å
492	L	96.9	Very high	95.5	Very high	119 Å²	119	63.4 Å²	63.4	62%	0.623	34%	0.338	S	S	*	.	H	α-helix	trans	-56.5	-39.7	-179.5	-87.1	166.7	0	0	0	113.6	V488 I489 P496	V488-L492 HydrophobicContact CG1-CD1 4.44Å; V488-L492 WeakPolarHBondContact O-CG 3.46Å; V488-L492 PolarHBondContact O-N 2.82Å; I489-L492 PolarHBondContact O-N 2.76Å; L492-P496 WeakPolarHBondContact O-CD 3.37Å; L492-P496 WeakPolarHBondContact O-CG 3.32Å
493	F	95.8	Very high	95.4	Very high	144 Å²	144	63.1 Å²	63.1	63%	0.632	34%	0.341	S	S	*	.	H	α-helix	trans	-91.4	-34.6	177	-65	-71.9	0	0	0	113.1	I489 A491 L497	I489-F493 HydrophobicContact CG2-CD2 4.34Å; I489-F493 HydrophobicContact CG2-CE2 4.15Å; I489-F493 WeakPolarHBondContact O-CD2 3.28Å; I489-F493 PolarHBondContact O-N 3.49Å; A491-F493 VanDerWaalsContact C-N 3.32Å; A491-F493 PolarHBondContact O-N 3.27Å; F493-L497 WeakPolarHBondContact O-CB 3.3Å; F493-L497 PolarHBondContact O-N 3.27Å
494	G	96.4	Very high	95.1	Very high	0 Å²	0	66 Å²	66	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-69.6	-39.6	-176.9	0	0	0	0	0	114.4	Y192 Y490 A491 L497 V498	Y192-G494 VanDerWaalsContact CE1-CA 3.48Å; Y490-G494 WeakPolarHBondContact O-CA 3.39Å; Y490-G494 PolarHBondContact O-N 2.68Å; A491-G494 PolarHBondContact O-N 2.86Å; G494-L497 PolarHBondContact O-N 2.93Å; G494-V498 WeakPolarHBondContact O-CG2 3.46Å; G494-V498 PolarHBondContact O-N 2.82Å
495	I	96.4	Very high	94.8	Very high	55 Å²	55	63.5 Å²	63.5	28%	0.282	35%	0.351	S	S	.	.	H	α-helix	trans	-65.7	-49.7	-178.1	-64.8	167.1	0	0	0	111.4	T470 A491 L497 V498 L499	T470-I495 HydrophobicContact CG2-CD1 3.69Å; T470-I495 HydrophobicContact CG2-CG1 3.88Å; T470-I495 HydrophobicContact CG2-CG2 4.38Å; A491-I495 HydrophobicContact CB-CD1 4.1Å; A491-I495 WeakPolarHBondContact O-CB 3.3Å; A491-I495 WeakPolarHBondContact O-CG1 3.28Å; A491-I495 PolarHBondContact O-N 3.47Å; I495-L497 VanDerWaalsContact C-N 3.3Å; I495-L497 PolarHBondContact O-N 3.45Å; I495-V498 PolarHBondContact O-N 3.41Å; I495-L499 HydrophobicContact CG2-CD1 4.07Å; I495-L499 HydrophobicContact CG2-CG 4.45Å; I495-L499 WeakPolarHBondContact O-CG 3.44Å; I495-L499 PolarHBondContact O-N 3.2Å
496	P	96.2	Very high	94.5	Very high	74 Å²	74	62.5 Å²	62.5	48%	0.481	35%	0.346	S	S	.	.	H	α-helix	trans	-58.5	-38.3	173.6	-26	35.7	0	0	0	113.6	L492 L499 L500	L492-P496 WeakPolarHBondContact O-CD 3.37Å; L492-P496 WeakPolarHBondContact O-CG 3.32Å; P496-L499 PolarHBondContact O-N 3.21Å; P496-L500 WeakPolarHBondContact O-CB 3.22Å; P496-L500 PolarHBondContact O-N 3.08Å
497	L	94.7	Very high	94.1	Very high	37 Å²	37	62.2 Å²	62.2	19%	0.194	35%	0.353	C	S	.	.	H	α-helix	trans	-63.1	-42.4	177.6	-173.8	72.4	0	0	0	111.7	L185 V188 V189 Y192 F493 G494 I495 C501	L185-L497 HydrophobicContact CD1-CD1 4.34Å; V188-L497 HydrophobicContact CG1-CD1 4Å; V188-L497 HydrophobicContact CG1-CD2 4.25Å; V189-L497 HydrophobicContact CG2-CD2 4.12Å; V189-L497 HydrophobicContact CG2-CG 3.93Å; Y192-L497 HydrophobicContact CD1-CD2 4.31Å; Y192-L497 HydrophobicContact CD2-CD2 4.29Å; Y192-L497 HydrophobicContact CG-CD2 3.9Å; F493-L497 WeakPolarHBondContact O-CB 3.3Å; F493-L497 PolarHBondContact O-N 3.27Å; G494-L497 PolarHBondContact O-N 2.93Å; I495-L497 VanDerWaalsContact C-N 3.3Å; I495-L497 PolarHBondContact O-N 3.45Å; L497-C501 WeakPolarHBondContact O-CB 3.15Å; L497-C501 PolarHBondContact O-N 3.45Å
498	V	94.3	Very high	93.6	Very high	17 Å²	17	64.4 Å²	64.4	10%	0.103	36%	0.361	C	S	.	.	H	α-helix	trans	-66.8	-42.5	174.5	169.9	0	0	0	0	111.5	V189 I468 G494 I495 L500 C501 L502	V189-V498 HydrophobicContact CG1-CG2 4.39Å; I468-V498 HydrophobicContact CB-CG2 3.85Å; I468-V498 HydrophobicContact CD1-CG2 3.55Å; I468-V498 HydrophobicContact CG1-CG2 3.66Å; G494-V498 WeakPolarHBondContact O-CG2 3.46Å; G494-V498 PolarHBondContact O-N 2.82Å; I495-V498 PolarHBondContact O-N 3.41Å; V498-L500 VanDerWaalsContact C-N 3.34Å; V498-L500 PolarHBondContact O-N 2.86Å; V498-C501 CarbonylContact O-C 3.59Å; V498-C501 WeakPolarHBondContact O-CB 3.32Å; V498-C501 PolarHBondContact O-N 2.75Å; V498-L502 HydrophobicContact CG1-CD1 3.78Å; V498-L502 HydrophobicContact CG1-CG 4.13Å; V498-L502 WeakPolarHBondContact O-CB 3.11Å; V498-L502 WeakPolarHBondContact O-CG 3.2Å; V498-L502 PolarHBondContact O-N 3.37Å
499	L	94.9	Very high	93.2	Very high	103 Å²	103	64.6 Å²	64.6	54%	0.539	36%	0.359	S	S	.	.	H	α-helix	trans	-61.8	-39.9	177	-70	171.6	0	0	0	112.4	I495 P496 L502 T503	I495-L499 HydrophobicContact CG2-CD1 4.07Å; I495-L499 HydrophobicContact CG2-CG 4.45Å; I495-L499 WeakPolarHBondContact O-CG 3.44Å; I495-L499 PolarHBondContact O-N 3.2Å; P496-L499 PolarHBondContact O-N 3.21Å; L499-L502 PolarHBondContact O-N 3.4Å; L499-T503 WeakPolarHBondContact O-CB 3.02Å; L499-T503 PolarHBondContact O-N 2.96Å; L499-T503 PolarHBondContact O-OG1 3.36Å
500	L	93.3	Very high	92.9	Very high	94 Å²	94	62 Å²	62	49%	0.492	35%	0.352	S	S	.	.	H	α-helix	trans	-65.5	-42.6	174.5	-156.1	164.1	0	0	0	110.8	L185 P496 V498 T503 N504	L185-L500 HydrophobicContact CD1-CD2 4.19Å; L185-L500 HydrophobicContact CD2-CD2 3.46Å; L185-L500 VanDerWaalsContact CD2-CD2 3.46Å; L185-L500 HydrophobicContact CG-CD2 4.49Å; P496-L500 WeakPolarHBondContact O-CB 3.22Å; P496-L500 PolarHBondContact O-N 3.08Å; V498-L500 VanDerWaalsContact C-N 3.34Å; V498-L500 PolarHBondContact O-N 2.86Å; L500-T503 PolarHBondContact O-N 3.27Å; L500-N504 WeakPolarHBondContact CD2-ND2 3.15Å; L500-N504 PolarHBondContact O-N 3.49Å; L500-N504 VanDerWaalsContact O-N 3.13Å
501	C	92	Very high	92.4	Very high	16 Å²	16	64.3 Å²	64.3	11%	0.108	37%	0.365	C	S	.	.	H	α-helix	trans	-62.4	-45.5	174.2	-170.1	0	0	0	0	112.6	L185 V189 L497 V498 T503 N504 L505	L185-C501 HydrophobicContact CD2-CB 4.3Å; L185-C501 HydrophobicContact CG-CB 4.17Å; V189-C501 HydrophobicContact CG2-CB 3.75Å; L497-C501 WeakPolarHBondContact O-CB 3.15Å; L497-C501 PolarHBondContact O-N 3.45Å; V498-C501 CarbonylContact O-C 3.59Å; V498-C501 WeakPolarHBondContact O-CB 3.32Å; V498-C501 PolarHBondContact O-N 2.75Å; C501-T503 PolarHBondContact O-N 3.34Å; C501-N504 PolarHBondContact O-N 3.09Å; C501-L505 WeakPolarHBondContact O-CB 3.31Å; C501-L505 PolarHBondContact O-N 3.43Å
502	L	92.7	Very high	91.8	Very high	103 Å²	103	65.5 Å²	65.5	54%	0.539	37%	0.37	S	S	.	.	H	α-helix	trans	-64	-38.8	178	-74.3	172.8	0	0	0	112	V498 L499 G506	V498-L502 HydrophobicContact CG1-CD1 3.78Å; V498-L502 HydrophobicContact CG1-CG 4.13Å; V498-L502 WeakPolarHBondContact O-CB 3.11Å; V498-L502 WeakPolarHBondContact O-CG 3.2Å; V498-L502 PolarHBondContact O-N 3.37Å; L499-L502 PolarHBondContact O-N 3.4Å; L502-G506 WeakPolarHBondContact O-CA 3.33Å; L502-G506 PolarHBondContact O-N 2.94Å
503	T	92.3	Very high	91.5	Very high	99 Å²	99	64.4 Å²	64.4	61%	0.607	37%	0.368	S	S	*	.	H	α-helix	trans	-61.8	-49.5	175.9	-57.2	0	0	0	0	110.8	L499 L500 C501 G507	L499-T503 WeakPolarHBondContact O-CB 3.02Å; L499-T503 PolarHBondContact O-N 2.96Å; L499-T503 PolarHBondContact O-OG1 3.36Å; L500-T503 PolarHBondContact O-N 3.27Å; C501-T503 PolarHBondContact O-N 3.34Å; T503-G507 PolarHBondContact O-N 2.86Å
504	N	88.8	Confident	91.2	Very high	60 Å²	60	63 Å²	63	32%	0.321	36%	0.358	S	S	.	.	H	α-helix	trans	-69.7	-38.5	-179.8	-76.4	-19	0	0	0	112.8	H182 L185 L500 C501 F508	H182-N504 PolarHBondContact CE1-O 2.96Å; H182-N504 PolarHBondContact ND1-O 3.46Å; L185-N504 HydrophobicContact CD2-CB 4.05Å; L185-N504 WeakPolarHBondContact CD2-ND2 3.45Å; L500-N504 WeakPolarHBondContact CD2-ND2 3.15Å; L500-N504 PolarHBondContact O-N 3.49Å; L500-N504 VanDerWaalsContact O-N 3.13Å; C501-N504 PolarHBondContact O-N 3.09Å; N504-F508 PolarHBondContact O-N 2.99Å; N504-F508 VanDerWaalsContact O-N 3.09Å
505	L	89.6	Confident	90.7	Very high	69 Å²	69	67.6 Å²	67.6	36%	0.361	38%	0.382	S	S	.	.	H	α-helix	trans	-69	-41.6	176	-175.8	61.8	0	0	0	111.4	C501 F508 L509	C501-L505 WeakPolarHBondContact O-CB 3.31Å; C501-L505 PolarHBondContact O-N 3.43Å; L505-F508 HydrophobicContact CD1-CD1 4.31Å; L505-F508 PolarHBondContact O-N 3.38Å; L505-L509 HydrophobicContact CG-CD1 4.11Å; L505-L509 WeakPolarHBondContact O-CB 3.25Å; L505-L509 VanDerWaalsContact O-CG 3.31Å; L505-L509 WeakPolarHBondContact O-CG 3.35Å; L505-L509 PolarHBondContact O-N 3.17Å
506	G	90	Very high	90.2	Very high	34 Å²	34	69.8 Å²	69.8	35%	0.351	39%	0.394	S	S	.	.	H	α-helix	trans	-61.6	-43.2	174.5	0	0	0	0	0	112.4	L502 F508 L509 A510	L502-G506 WeakPolarHBondContact O-CA 3.33Å; L502-G506 PolarHBondContact O-N 2.94Å; G506-F508 PolarHBondContact O-N 2.95Å; G506-L509 PolarHBondContact O-N 3.14Å; G506-A510 VanDerWaalsContact O-CB 3.29Å; G506-A510 WeakPolarHBondContact O-CB 3.37Å; G506-A510 PolarHBondContact O-N 2.99Å
507	G	87.4	Confident	89.8	Confident	35 Å²	35	74.4 Å²	74.4	36%	0.361	40%	0.403	S	S	.	.	H	α-helix	trans	-60.5	-41.1	172.7	0	0	0	0	0	113.2	T503 N511	T503-G507 PolarHBondContact O-N 2.86Å; G507-N511 WeakPolarHBondContact O-CB 3.29Å; G507-N511 VanDerWaalsContact O-CG 3.31Å; G507-N511 PolarHBondContact O-N 3.41Å; G507-N511 PolarHBondContact O-ND2 3.46Å
508	F	85.9	Confident	89.5	Confident	71 Å²	71	75.7 Å²	75.7	31%	0.311	41%	0.414	S	S	.	.	H	α-helix	trans	-64.8	-46.8	173.6	170.7	-127.9	0	0	0	112.5	F178 N504 L505 G506 N511 T512	F178-F508 AromaticContact CE1-CD2 3.35Å; F178-F508 HydrophobicContact CE1-CD2 3.35Å; F178-F508 AromaticContact CE1-CE2 3.59Å; F178-F508 HydrophobicContact CE1-CE2 3.59Å; F178-F508 AromaticContact CE1-CG 3.95Å; F178-F508 HydrophobicContact CE1-CG 3.95Å; F178-F508 HydrophobicContact CE1-CZ 4.38Å; F178-F508 HydrophobicContact CZ-CB 3.95Å; F178-F508 AromaticContact CZ-CD2 3.28Å; F178-F508 HydrophobicContact CZ-CD2 3.28Å; F178-F508 AromaticContact CZ-CE2 4Å; F178-F508 HydrophobicContact CZ-CE2 4Å; F178-F508 AromaticContact CZ-CG 3.8Å; F178-F508 HydrophobicContact CZ-CG 3.8Å; N504-F508 PolarHBondContact O-N 2.99Å; N504-F508 VanDerWaalsContact O-N 3.09Å; L505-F508 HydrophobicContact CD1-CD1 4.31Å; L505-F508 PolarHBondContact O-N 3.38Å; G506-F508 PolarHBondContact O-N 2.95Å; F508-N511 PolarHBondContact O-N 2.69Å; F508-T512 WeakPolarHBondContact CD2-OG1 3.5Å; F508-T512 WeakPolarHBondContact CE2-OG1 3.45Å; F508-T512 WeakPolarHBondContact O-CB 3.28Å; F508-T512 PolarHBondContact O-N 3.18Å; F508-T512 PolarHBondContact O-OG1 2.73Å
509	L	88.8	Confident	88.9	Confident	96 Å²	96	79 Å²	79	50%	0.503	43%	0.432	S	S	.	.	H	α-helix	trans	-61.8	-46.8	178.5	-72.4	168.5	0	0	0	111	L505 G506 N511 T512 V513	L505-L509 HydrophobicContact CG-CD1 4.11Å; L505-L509 WeakPolarHBondContact O-CB 3.25Å; L505-L509 VanDerWaalsContact O-CG 3.31Å; L505-L509 WeakPolarHBondContact O-CG 3.35Å; L505-L509 PolarHBondContact O-N 3.17Å; G506-L509 PolarHBondContact O-N 3.14Å; L509-N511 PolarHBondContact O-N 3.26Å; L509-T512 PolarHBondContact O-N 2.82Å; L509-V513 WeakPolarHBondContact O-CG2 3.45Å; L509-V513 PolarHBondContact O-N 3.21Å
510	A	91.1	Very high	88.1	Confident	44 Å²	44	77.3 Å²	77.3	36%	0.364	43%	0.429	S	S	.	.	H	α-helix	trans	-59.3	-43.5	176.4	0	0	0	0	0	112.2	G506 R514	G506-A510 VanDerWaalsContact O-CB 3.29Å; G506-A510 WeakPolarHBondContact O-CB 3.37Å; G506-A510 PolarHBondContact O-N 2.99Å; A510-R514 WeakPolarHBondContact O-CB 3.35Å; A510-R514 WeakPolarHBondContact O-CD 3.29Å; A510-R514 WeakPolarHBondContact O-CG 3.37Å; A510-R514 PolarHBondContact O-N 3.43Å
511	N	86.2	Confident	87.5	Confident	60 Å²	60	75.9 Å²	75.9	32%	0.321	43%	0.426	S	S	.	.	H	α-helix	trans	-69.5	-35.1	176.4	-73.1	-24.1	0	0	0	112.7	G507 F508 L509 R514 I515	G507-N511 WeakPolarHBondContact O-CB 3.29Å; G507-N511 VanDerWaalsContact O-CG 3.31Å; G507-N511 PolarHBondContact O-N 3.41Å; G507-N511 PolarHBondContact O-ND2 3.46Å; F508-N511 PolarHBondContact O-N 2.69Å; L509-N511 PolarHBondContact O-N 3.26Å; N511-R514 PolarHBondContact O-N 2.97Å; N511-R514 PolarHBondContact OD1-NH1 2.9Å; N511-I515 WeakPolarHBondContact O-CB 3.48Å; N511-I515 WeakPolarHBondContact O-CD1 3.31Å; N511-I515 VanDerWaalsContact O-CG1 3.22Å; N511-I515 WeakPolarHBondContact O-CG1 3.48Å; N511-I515 PolarHBondContact O-N 2.81Å
512	T	83.6	Confident	86.8	Confident	46 Å²	46	81.2 Å²	81.2	28%	0.282	45%	0.447	S	S	.	.	H	α-helix	trans	-65.2	-45.8	174.3	-60.3	0	0	0	0	111.2	F508 L509 R514 I515 I516	F508-T512 WeakPolarHBondContact CD2-OG1 3.5Å; F508-T512 WeakPolarHBondContact CE2-OG1 3.45Å; F508-T512 WeakPolarHBondContact O-CB 3.28Å; F508-T512 PolarHBondContact O-N 3.18Å; F508-T512 PolarHBondContact O-OG1 2.73Å; L509-T512 PolarHBondContact O-N 2.82Å; T512-R514 PolarHBondContact O-N 2.96Å; T512-I515 PolarHBondContact O-N 3.33Å; T512-I516 HydrophobicContact CG2-CD1 3.94Å; T512-I516 WeakPolarHBondContact O-CG1 3.28Å; T512-I516 PolarHBondContact O-N 3.44Å
513	V	90.3	Very high	85.8	Confident	96 Å²	96	83 Å²	83	58%	0.582	45%	0.451	S	S	*	.	H	α-helix	trans	-61.4	-43.7	173.7	171.6	0	0	0	0	111	L509 I515 I516 Y517	L509-V513 WeakPolarHBondContact O-CG2 3.45Å; L509-V513 PolarHBondContact O-N 3.21Å; V513-I515 VanDerWaalsContact C-N 3.31Å; V513-I515 PolarHBondContact O-N 3.17Å; V513-I516 PolarHBondContact O-N 2.86Å; V513-Y517 VanDerWaalsContact O-CB 3.29Å; V513-Y517 WeakPolarHBondContact O-CB 3.39Å; V513-Y517 PolarHBondContact O-N 3.19Å
514	R	90.3	Very high	84.8	Confident	113 Å²	113	86.2 Å²	86.2	43%	0.426	45%	0.453	S	S	.	.	H	α-helix	trans	-58.4	-39.8	173.5	-75.4	164.6	173.7	171.3	-6.2	112.4	A510 N511 T512 S518 Y619	A510-R514 WeakPolarHBondContact O-CB 3.35Å; A510-R514 WeakPolarHBondContact O-CD 3.29Å; A510-R514 WeakPolarHBondContact O-CG 3.37Å; A510-R514 PolarHBondContact O-N 3.43Å; N511-R514 PolarHBondContact O-N 2.97Å; N511-R514 PolarHBondContact OD1-NH1 2.9Å; T512-R514 PolarHBondContact O-N 2.96Å; R514-S518 VanDerWaalsContact O-CB 3.25Å; R514-S518 WeakPolarHBondContact O-CB 3.34Å; R514-S518 PolarHBondContact O-N 3.45Å; R514-S518 PolarHBondContact O-OG 2.84Å; R514-Y619 VanDerWaalsContact NH1-CE2 3.34Å; R514-Y619 PolarHBondContact NH1-OH 2.98Å
515	I	85.6	Confident	84.2	Confident	98 Å²	98	88.4 Å²	88.4	50%	0.503	46%	0.461	S	S	.	.	H	α-helix	trans	-70.7	-40.2	177.1	-70.6	163.7	0	0	0	111.6	N511 T512 V513 S518 N519	N511-I515 WeakPolarHBondContact O-CB 3.48Å; N511-I515 WeakPolarHBondContact O-CD1 3.31Å; N511-I515 VanDerWaalsContact O-CG1 3.22Å; N511-I515 WeakPolarHBondContact O-CG1 3.48Å; N511-I515 PolarHBondContact O-N 2.81Å; T512-I515 PolarHBondContact O-N 3.33Å; V513-I515 VanDerWaalsContact C-N 3.31Å; V513-I515 PolarHBondContact O-N 3.17Å; I515-S518 PolarHBondContact O-OG 3.49Å; I515-N519 WeakPolarHBondContact CG2-ND2 3.4Å; I515-N519 VanDerWaalsContact O-CB 3.29Å; I515-N519 WeakPolarHBondContact O-CB 3.4Å; I515-N519 VanDerWaalsContact O-CG 3.31Å; I515-N519 PolarHBondContact O-N 2.99Å; I515-N519 PolarHBondContact O-ND2 2.81Å
516	I	86.2	Confident	83.5	Confident	101 Å²	101	88.6 Å²	88.6	52%	0.518	46%	0.46	S	S	.	.	H	α-helix	trans	-65.3	-45.2	175.8	-68.9	165.5	0	0	0	110.1	T512 V513 S520	T512-I516 HydrophobicContact CG2-CD1 3.94Å; T512-I516 WeakPolarHBondContact O-CG1 3.28Å; T512-I516 PolarHBondContact O-N 3.44Å; V513-I516 PolarHBondContact O-N 2.86Å; I516-S520 WeakPolarHBondContact O-CB 3.18Å; I516-S520 PolarHBondContact O-N 3.46Å; I516-S520 PolarHBondContact O-OG 3.44Å
517	Y	88.8	Confident	82.6	Confident	171 Å²	171	94 Å²	94	67%	0.671	48%	0.476	S	S	*	.	H	α-helix	trans	-65.2	-46.1	178.2	-175.2	-99.6	0	0	0	112.2	V513 S520 C521	V513-Y517 VanDerWaalsContact O-CB 3.29Å; V513-Y517 WeakPolarHBondContact O-CB 3.39Å; V513-Y517 PolarHBondContact O-N 3.19Å; Y517-S520 PolarHBondContact O-N 3.43Å; Y517-C521 WeakPolarHBondContact O-CB 3.29Å; Y517-C521 PolarHBondContact O-N 3.18Å
518	S	87.1	Confident	82	Confident	63 Å²	63	99.3 Å²	99.3	44%	0.441	49%	0.485	S	S	.	.	H	α-helix	trans	-67	-39	179.1	68.3	0	0	0	0	112.4	R514 I515 S520 C521 F522	R514-S518 VanDerWaalsContact O-CB 3.25Å; R514-S518 WeakPolarHBondContact O-CB 3.34Å; R514-S518 PolarHBondContact O-N 3.45Å; R514-S518 PolarHBondContact O-OG 2.84Å; I515-S518 PolarHBondContact O-OG 3.49Å; S518-S520 VanDerWaalsContact C-N 3.33Å; S518-S520 PolarHBondContact O-N 3.16Å; S518-C521 PolarHBondContact O-N 2.93Å; S518-F522 WeakPolarHBondContact O-CB 3.36Å; S518-F522 PolarHBondContact O-N 3.45Å
519	N	82.3	Confident	81.5	Confident	88 Å²	88	99.1 Å²	99.1	47%	0.471	49%	0.489	S	S	.	.	H	α-helix	trans	-64.5	-37	172.8	-78.7	-51.3	0	0	0	112.5	I515 K523	I515-N519 WeakPolarHBondContact CG2-ND2 3.4Å; I515-N519 VanDerWaalsContact O-CB 3.29Å; I515-N519 WeakPolarHBondContact O-CB 3.4Å; I515-N519 VanDerWaalsContact O-CG 3.31Å; I515-N519 PolarHBondContact O-N 2.99Å; I515-N519 PolarHBondContact O-ND2 2.81Å; N519-K523 WeakPolarHBondContact O-CB 3.43Å; N519-K523 WeakPolarHBondContact O-CG 3.36Å; N519-K523 PolarHBondContact O-N 3.46Å
520	S	78.7	Confident	80.6	Confident	67 Å²	67	100.7 Å²	100.7	47%	0.469	49%	0.492	S	S	.	.	H	α-helix	trans	-68.9	-45.6	177	-58.1	0	0	0	0	111.3	I516 Y517 S518 K523 Y524	I516-S520 WeakPolarHBondContact O-CB 3.18Å; I516-S520 PolarHBondContact O-N 3.46Å; I516-S520 PolarHBondContact O-OG 3.44Å; Y517-S520 PolarHBondContact O-N 3.43Å; S518-S520 VanDerWaalsContact C-N 3.33Å; S518-S520 PolarHBondContact O-N 3.16Å; S520-K523 PolarHBondContact O-N 2.98Å; S520-Y524 WeakPolarHBondContact O-CB 3.49Å; S520-Y524 PolarHBondContact O-N 3.38Å
521	C	79.3	Confident	79.6	Confident	64 Å²	64	106.1 Å²	106.1	43%	0.432	51%	0.507	S	S	.	.	H	α-helix	trans	-63.5	-40.8	174.3	-170.7	0	0	0	0	111.9	Y517 S518 Y524 H525	Y517-C521 WeakPolarHBondContact O-CB 3.29Å; Y517-C521 PolarHBondContact O-N 3.18Å; S518-C521 PolarHBondContact O-N 2.93Å; C521-Y524 PolarHBondContact O-N 3.36Å; C521-H525 WeakPolarHBondContact O-CB 3.36Å; C521-H525 PolarHBondContact O-N 3.24Å
522	F	77.2	Confident	78.8	Confident	128 Å²	128	109.1 Å²	109.1	56%	0.561	52%	0.518	S	S	*	.	H	α-helix	trans	-64.6	-46	176.7	-172.9	-87.8	0	0	0	111.8	S518 Y524 H525 E526	S518-F522 WeakPolarHBondContact O-CB 3.36Å; S518-F522 PolarHBondContact O-N 3.45Å; F522-Y524 VanDerWaalsContact C-N 3.33Å; F522-Y524 PolarHBondContact O-N 3.37Å; F522-H525 PolarHBondContact O-N 3.09Å; F522-E526 HydrophobicContact CE1-CB 4.39Å; F522-E526 WeakPolarHBondContact CE1-OE2 3.33Å; F522-E526 WeakPolarHBondContact O-CB 3.33Å; F522-E526 PolarHBondContact O-N 3.33Å
523	K	71.6	Confident	77.9	Confident	141 Å²	141	112.3 Å²	112.3	61%	0.613	53%	0.532	S	S	*	.	H	α-helix	trans	-58.2	-45	173.3	-77.4	177.8	177.7	-178.5	0	111.6	N519 S520 E526 H527	N519-K523 WeakPolarHBondContact O-CB 3.43Å; N519-K523 WeakPolarHBondContact O-CG 3.36Å; N519-K523 PolarHBondContact O-N 3.46Å; S520-K523 PolarHBondContact O-N 2.98Å; K523-E526 PolarHBondContact O-N 2.91Å; K523-H527 PolarHBondContact O-CD2 2.98Å; K523-H527 PolarHBondContact O-N 3.29Å
524	Y	72	Confident	76.5	Confident	165 Å²	165	111.1 Å²	111.1	65%	0.647	53%	0.529	S	S	*	.	H	α-helix	trans	-61.1	-44.1	177	-175	-104	0	0	0	111.8	S520 C521 F522 R528	S520-Y524 WeakPolarHBondContact O-CB 3.49Å; S520-Y524 PolarHBondContact O-N 3.38Å; C521-Y524 PolarHBondContact O-N 3.36Å; F522-Y524 VanDerWaalsContact C-N 3.33Å; F522-Y524 PolarHBondContact O-N 3.37Å; Y524-R528 WeakPolarHBondContact O-CB 3.34Å; Y524-R528 PolarHBondContact O-N 2.96Å
525	H	76.6	Confident	75.1	Confident	106 Å²	106	112.3 Å²	112.3	49%	0.491	54%	0.537	S	S	.	.	H	α-helix	trans	-67.7	-43	177.5	-167.3	-105.7	0	0	0	112.5	C521 F522 H527 R528 V529	C521-H525 WeakPolarHBondContact O-CB 3.36Å; C521-H525 PolarHBondContact O-N 3.24Å; F522-H525 PolarHBondContact O-N 3.09Å; H525-H527 PolarHBondContact O-N 2.98Å; H525-R528 CarbonylContact O-C 3.57Å; H525-R528 WeakPolarHBondContact O-CA 3.41Å; H525-R528 WeakPolarHBondContact O-CB 3.26Å; H525-R528 PolarHBondContact O-N 3Å; H525-V529 VanDerWaalsContact CE1-CG2 3.42Å; H525-V529 WeakPolarHBondContact CE1-CG2 3.33Å; H525-V529 WeakPolarHBondContact O-CG2 3.25Å; H525-V529 PolarHBondContact O-N 3.35Å
526	E	74.5	Confident	73.9	Confident	74 Å²	74	113.3 Å²	113.3	35%	0.346	54%	0.539	S	S	.	.	H	α-helix	trans	-61.2	-43.3	177.6	-169	-174	164.1	0	0	111.4	F522 K523 R528 V529 K530	F522-E526 HydrophobicContact CE1-CB 4.39Å; F522-E526 WeakPolarHBondContact CE1-OE2 3.33Å; F522-E526 WeakPolarHBondContact O-CB 3.33Å; F522-E526 PolarHBondContact O-N 3.33Å; K523-E526 PolarHBondContact O-N 2.91Å; E526-R528 VanDerWaalsContact C-N 3.35Å; E526-R528 PolarHBondContact O-N 3.48Å; E526-V529 PolarHBondContact O-N 2.92Å; E526-K530 HydrophobicContact CG-CD 4.34Å; E526-K530 WeakPolarHBondContact O-CB 3.35Å; E526-K530 WeakPolarHBondContact O-CG 3.35Å; E526-K530 PolarHBondContact O-N 2.93Å; E526-K530 WeakPolarHBondContact OE1-CE 3.27Å; E526-K530 IonicContact OE1-NZ 2.6Å; E526-K530 PolarHBondContact OE1-NZ 3.17Å
527	H	72.1	Confident	72.5	Confident	148 Å²	148	114.7 Å²	114.7	69%	0.685	54%	0.543	S	S	*	.	H	α-helix	trans	-60.5	-41.9	171.1	-90.4	-92.7	0	0	0	112.1	K523 H525 K531	K523-H527 PolarHBondContact O-CD2 2.98Å; K523-H527 PolarHBondContact O-N 3.29Å; H525-H527 PolarHBondContact O-N 2.98Å; H527-K531 WeakPolarHBondContact O-CB 3.48Å; H527-K531 PolarHBondContact O-N 3.45Å; H527-K531 VanDerWaalsContact O-N 3.13Å
528	R	73.7	Confident	71.1	Confident	146 Å²	146	111.3 Å²	111.3	55%	0.551	54%	0.536	S	S	*	.	H	α-helix	trans	-67.1	-39.4	179	-159	177.3	-169.8	-163.5	3.9	112.4	Y524 H525 E526 K532	Y524-R528 WeakPolarHBondContact O-CB 3.34Å; Y524-R528 PolarHBondContact O-N 2.96Å; H525-R528 CarbonylContact O-C 3.57Å; H525-R528 WeakPolarHBondContact O-CA 3.41Å; H525-R528 WeakPolarHBondContact O-CB 3.26Å; H525-R528 PolarHBondContact O-N 3Å; E526-R528 VanDerWaalsContact C-N 3.35Å; E526-R528 PolarHBondContact O-N 3.48Å; R528-K532 PolarHBondContact O-N 2.8Å
529	V	74.9	Confident	69.7	Low	66 Å²	66	114.8 Å²	114.8	40%	0.4	55%	0.545	S	S	.	.	H	α-helix	trans	-69.7	-48.1	177.2	171.6	0	0	0	0	111.2	H525 E526 K531 K532 L533	H525-V529 VanDerWaalsContact CE1-CG2 3.42Å; H525-V529 WeakPolarHBondContact CE1-CG2 3.33Å; H525-V529 WeakPolarHBondContact O-CG2 3.25Å; H525-V529 PolarHBondContact O-N 3.35Å; E526-V529 PolarHBondContact O-N 2.92Å; V529-K531 VanDerWaalsContact C-N 3.25Å; V529-K531 PolarHBondContact O-N 3.44Å; V529-K532 WeakPolarHBondContact O-CB 3.37Å; V529-K532 PolarHBondContact O-N 2.74Å; V529-L533 PolarHBondContact O-N 3.27Å
530	K	70.6	Confident	68.6	Low	129 Å²	129	113.7 Å²	113.7	56%	0.561	54%	0.544	S	S	*	.	H	α-helix	trans	-57.5	-39.4	176.5	-73.5	177.1	-177.3	172.6	0	111.9	E526 K532 L533 S534	E526-K530 HydrophobicContact CG-CD 4.34Å; E526-K530 WeakPolarHBondContact O-CB 3.35Å; E526-K530 WeakPolarHBondContact O-CG 3.35Å; E526-K530 PolarHBondContact O-N 2.93Å; E526-K530 WeakPolarHBondContact OE1-CE 3.27Å; E526-K530 IonicContact OE1-NZ 2.6Å; E526-K530 PolarHBondContact OE1-NZ 3.17Å; K530-K532 VanDerWaalsContact C-N 3.35Å; K530-K532 PolarHBondContact O-N 3.36Å; K530-L533 PolarHBondContact O-N 3.33Å; K530-S534 WeakPolarHBondContact O-CB 3.33Å; K530-S534 PolarHBondContact O-N 3.47Å; K530-S534 VanDerWaalsContact O-N 3.11Å
531	K	70.1	Confident	67.7	Low	158 Å²	158	114.2 Å²	114.2	69%	0.687	54%	0.541	S	S	*	.	H	α-helix	trans	-69.5	-24.8	175.9	-164.7	170.4	-175.5	175.4	0	113.8	H527 V529	H527-K531 WeakPolarHBondContact O-CB 3.48Å; H527-K531 PolarHBondContact O-N 3.45Å; H527-K531 VanDerWaalsContact O-N 3.13Å; V529-K531 VanDerWaalsContact C-N 3.25Å; V529-K531 PolarHBondContact O-N 3.44Å
532	K	69	Low	66.6	Low	123 Å²	123	115.6 Å²	115.6	54%	0.535	54%	0.544	S	S	.	.	H	α-helix	trans	-76.9	-50.9	169.3	-80.9	-171.7	173.2	-173.8	0	111.8	R528 V529 K530 S534 K535 Q536	R528-K532 PolarHBondContact O-N 2.8Å; V529-K532 WeakPolarHBondContact O-CB 3.37Å; V529-K532 PolarHBondContact O-N 2.74Å; K530-K532 VanDerWaalsContact C-N 3.35Å; K530-K532 PolarHBondContact O-N 3.36Å; K532-S534 VanDerWaalsContact C-N 3.31Å; K532-S534 PolarHBondContact O-N 3.36Å; K532-K535 WeakPolarHBondContact O-CB 3.45Å; K532-K535 PolarHBondContact O-N 2.87Å; K532-Q536 PolarHBondContact O-N 2.83Å; K532-Q536 VanDerWaalsContact O-N 3.11Å
533	L	64.8	Low	65.4	Low	113 Å²	113	112.7 Å²	112.7	59%	0.592	54%	0.538	S	S	*	.	H	α-helix	trans	-62.1	-39.2	-174	-156.9	77.3	0	0	0	112	V529 K530 K535 Q536 H537	V529-L533 PolarHBondContact O-N 3.27Å; K530-L533 PolarHBondContact O-N 3.33Å; L533-K535 VanDerWaalsContact C-N 3.31Å; L533-K535 PolarHBondContact O-N 3.35Å; L533-Q536 PolarHBondContact O-N 3.16Å; L533-H537 PolarHBondContact O-N 3.32Å
534	S	60.6	Low	64.8	Low	72 Å²	72	111 Å²	111	50%	0.503	54%	0.539	S	S	.	.	H	α-helix	trans	-57.3	-39.3	173.2	167	0	0	0	0	113.2	K530 K532 I538	K530-S534 WeakPolarHBondContact O-CB 3.33Å; K530-S534 PolarHBondContact O-N 3.47Å; K530-S534 VanDerWaalsContact O-N 3.11Å; K532-S534 VanDerWaalsContact C-N 3.31Å; K532-S534 PolarHBondContact O-N 3.36Å; S534-I538 WeakPolarHBondContact O-CD1 3.45Å; S534-I538 WeakPolarHBondContact O-CG1 3.41Å; S534-I538 PolarHBondContact O-N 3.32Å
535	K	61.2	Low	64	Low	137 Å²	137	108.9 Å²	108.9	60%	0.596	54%	0.537	S	S	*	.	H	α-helix	trans	-70.3	-44.4	176.1	-71.9	-169.7	170.4	-159.3	0	112	K532 L533 H537 I538 Q539	K532-K535 WeakPolarHBondContact O-CB 3.45Å; K532-K535 PolarHBondContact O-N 2.87Å; L533-K535 VanDerWaalsContact C-N 3.31Å; L533-K535 PolarHBondContact O-N 3.35Å; K535-H537 PolarHBondContact O-N 3.31Å; K535-I538 PolarHBondContact O-N 3.16Å; K535-Q539 PolarHBondContact O-N 3.4Å
536	Q	60.2	Low	62.8	Low	119 Å²	119	112.2 Å²	112.2	56%	0.556	55%	0.546	S	S	*	.	H	α-helix	trans	-62.4	-41.9	-179.1	-72.1	177	-56.4	0	0	112.1	K532 L533 I538 Q539 S540	K532-Q536 PolarHBondContact O-N 2.83Å; K532-Q536 VanDerWaalsContact O-N 3.11Å; L533-Q536 PolarHBondContact O-N 3.16Å; Q536-I538 VanDerWaalsContact C-N 3.33Å; Q536-I538 PolarHBondContact O-N 3.35Å; Q536-Q539 PolarHBondContact O-N 3.09Å; Q536-S540 PolarHBondContact O-N 3.24Å; Q536-S540 PolarHBondContact O-OG 3.16Å
537	H	57.6	Low	61.5	Low	130 Å²	130	115 Å²	115	60%	0.602	56%	0.563	S	S	*	*	H	α-helix	trans	-65.9	-35.5	-179.8	-142.7	58.7	0	0	0	112.7	L533 K535 S540 I541	L533-H537 PolarHBondContact O-N 3.32Å; K535-H537 PolarHBondContact O-N 3.31Å; H537-S540 WeakPolarHBondContact CA-OG 3.45Å; H537-S540 PolarHBondContact O-OG 3.15Å; H537-I541 WeakPolarHBondContact O-CD1 3.5Å; H537-I541 VanDerWaalsContact O-CG1 3.31Å; H537-I541 WeakPolarHBondContact O-CG1 3.09Å; H537-I541 PolarHBondContact O-N 3.47Å
538	I	59	Low	60.5	Low	101 Å²	101	116.1 Å²	116.1	52%	0.518	57%	0.569	S	S	.	*	H	α-helix	trans	-67.5	-43.5	172.3	-66.6	169.5	0	0	0	110.4	S534 K535 Q536 S540 I541 L542	S534-I538 WeakPolarHBondContact O-CD1 3.45Å; S534-I538 WeakPolarHBondContact O-CG1 3.41Å; S534-I538 PolarHBondContact O-N 3.32Å; K535-I538 PolarHBondContact O-N 3.16Å; Q536-I538 VanDerWaalsContact C-N 3.33Å; Q536-I538 PolarHBondContact O-N 3.35Å; I538-S540 PolarHBondContact O-N 2.74Å; I538-I541 PolarHBondContact O-N 3.45Å; I538-L542 HydrophobicContact CG2-CD1 3.89Å; I538-L542 HydrophobicContact CG2-CG 4.36Å; I538-L542 WeakPolarHBondContact O-CG 3.43Å; I538-L542 PolarHBondContact O-N 3.34Å; I538-L542 VanDerWaalsContact O-N 3.08Å
539	Q	59	Low	59	Low	136 Å²	136	117.9 Å²	117.9	64%	0.636	58%	0.58	S	S	*	*	H	α-helix	trans	-67.9	-29.2	178.8	-78.4	179.2	-71.3	0	0	114	K535 Q536 P543	K535-Q539 PolarHBondContact O-N 3.4Å; Q536-Q539 PolarHBondContact O-N 3.09Å; Q539-P543 WeakPolarHBondContact O-CD 3.21Å
540	S	57.9	Low	57.3	Low	64 Å²	64	122.4 Å²	122.4	45%	0.448	60%	0.6	S	S	.	*	H	α-helix	trans	-74.4	-24	173.6	50.9	0	0	0	0	114	Q536 H537 I538	Q536-S540 PolarHBondContact O-N 3.24Å; Q536-S540 PolarHBondContact O-OG 3.16Å; H537-S540 WeakPolarHBondContact CA-OG 3.45Å; H537-S540 PolarHBondContact O-OG 3.15Å; I538-S540 PolarHBondContact O-N 2.74Å
541	I	59.1	Low	55.9	Low	79 Å²	79	124 Å²	124	41%	0.405	61%	0.614	S	S	.	*	H	α-helix	trans	-90.7	-30.8	-178.8	-67.3	169.4	0	0	0	111.6	H537 I538 P543 V544 I545	H537-I541 WeakPolarHBondContact O-CD1 3.5Å; H537-I541 VanDerWaalsContact O-CG1 3.31Å; H537-I541 WeakPolarHBondContact O-CG1 3.09Å; H537-I541 PolarHBondContact O-N 3.47Å; I538-I541 PolarHBondContact O-N 3.45Å; I541-P543 VanDerWaalsContact C-CD 3.49Å; I541-V544 PolarHBondContact O-N 2.87Å; I541-I545 HydrophobicContact CG2-CD1 3.44Å; I541-I545 VanDerWaalsContact CG2-CD1 3.44Å; I541-I545 HydrophobicContact CG2-CG1 3.94Å; I541-I545 PolarHBondContact O-N 3.27Å; I541-I545 VanDerWaalsContact O-N 3.16Å
542	L	56.4	Low	54.4	Low	93 Å²	93	121.7 Å²	121.7	49%	0.487	62%	0.615	S	S	.	*	H	α-helix	trans	-56.3	-31.5	179.7	-87.4	167.8	0	0	0	117.6	I538	I538-L542 HydrophobicContact CG2-CD1 3.89Å; I538-L542 HydrophobicContact CG2-CG 4.36Å; I538-L542 WeakPolarHBondContact O-CG 3.43Å; I538-L542 PolarHBondContact O-N 3.34Å; I538-L542 VanDerWaalsContact O-N 3.08Å
543	P	52.8	Low	52.9	Low	67 Å²	67	123.2 Å²	123.2	44%	0.435	63%	0.629	S	S	.	*	H	α-helix	trans	-79.3	-40.8	170.6	28.2	-32.4	0	0	0	112.1	Q539 I541 I545 R546	Q539-P543 WeakPolarHBondContact O-CD 3.21Å; I541-P543 VanDerWaalsContact C-CD 3.49Å; P543-I545 VanDerWaalsContact C-N 3.29Å; P543-I545 PolarHBondContact O-N 3.24Å; P543-R546 WeakPolarHBondContact O-CA 3.47Å; P543-R546 WeakPolarHBondContact O-CB 2.78Å; P543-R546 PolarHBondContact O-N 2.78Å
544	V	59.1	Low	51.6	Low	105 Å²	105	122.6 Å²	122.6	64%	0.636	64%	0.635	S	S	*	*	H	α-helix	trans	-61.4	-37	-176.7	-176	0	0	0	0	112	I541 R546	I541-V544 PolarHBondContact O-N 2.87Å; V544-R546 PolarHBondContact O-N 3.43Å
545	I	54.7	Low	50.4	Low	120 Å²	120	125 Å²	125	62%	0.615	65%	0.652	S	S	*	*	H	α-helix	trans	-74.5	-11.7	175.6	-65.5	-178	0	0	0	112.7	I541 P543	I541-I545 HydrophobicContact CG2-CD1 3.44Å; I541-I545 VanDerWaalsContact CG2-CD1 3.44Å; I541-I545 HydrophobicContact CG2-CG1 3.94Å; I541-I545 PolarHBondContact O-N 3.27Å; I541-I545 VanDerWaalsContact O-N 3.16Å; P543-I545 VanDerWaalsContact C-N 3.29Å; P543-I545 PolarHBondContact O-N 3.24Å
546	R	51.3	Low	49.3	Very low	176 Å²	176	128.9 Å²	128.9	66%	0.664	67%	0.668	S	S	*	*	H	α-helix	trans	-82.6	-35	-174.9	-163.9	172.9	-62.6	-163.3	-1.5	113.2	P543 V544	P543-R546 WeakPolarHBondContact O-CA 3.47Å; P543-R546 WeakPolarHBondContact O-CB 2.78Å; P543-R546 PolarHBondContact O-N 2.78Å; V544-R546 PolarHBondContact O-N 3.43Å
547	D	48.6	Very low	48.3	Very low	133 Å²	133	134.4 Å²	134.4	71%	0.711	68%	0.684	S	S	*	*	H	α-helix	trans	-89.8	-15.8	-169.9	-58.4	-25.5	0	0	0	113.1	K549	D547-K549 PolarHBondContact O-N 3.02Å
548	E	50.3	Low	47.2	Very low	172 Å²	172	137.4 Å²	137.4	80%	0.804	70%	0.695	S	S	*	*			trans	-78.4	25.7	-178.2	-149.7	174.9	-164.3	0	0	114	I550	E548-I550 PolarHBondContact O-N 2.96Å
549	K	41.3	Very low	46.1	Very low	183 Å²	183	140.9 Å²	140.9	80%	0.796	71%	0.714	S	S	*	*			trans	-95.9	51.5	179.4	-82.5	-166.1	173.2	-173.6	0	113.7	D547	D547-K549 PolarHBondContact O-N 3.02Å
550	I	40.4	Very low	45.2	Very low	160 Å²	160	141.8 Å²	141.8	82%	0.821	72%	0.722	S	S	*	*	S	Bend	trans	-121	121.5	161.2	-61.3	-176.9	0	0	0	108.1	E548	E548-I550 PolarHBondContact O-N 2.96Å
551	L	40.3	Very low	44.3	Very low	163 Å²	163	145 Å²	145	85%	0.853	73%	0.734	S	S	*	*			trans	-74.2	165.4	-170.6	-107.7	72	0	0	0	112.9
552	P	39.1	Very low	43.1	Very low	109 Å²	109	148.9 Å²	148.9	71%	0.708	76%	0.756	S	S	*	*			trans	-106.7	-177.8	-145.3	41.5	-39.9	0	0	0	113.8
553	N	37.6	Very low	42.1	Very low	155 Å²	155	153.8 Å²	153.8	83%	0.829	77%	0.768	S	S	*	*			trans	-148.4	149.5	156.6	-124.1	-35.7	0	0	0	115
554	S	38	Very low	41.3	Very low	101 Å²	101	160.2 Å²	160.2	71%	0.706	79%	0.789	S	S	*	*			trans	60.5	102.1	167.8	67.3	0	0	0	0	120.4
555	S	34.8	Very low	40.1	Very low	123 Å²	123	160.5 Å²	160.5	86%	0.86	79%	0.791	S	S	*	*				54.5	85.7	119.3	-55	0	0	0	0	120.5
556	K	38.8	Very low	39	Very low	217 Å²	217	164.9 Å²	164.9	94%	0.943	81%	0.806	S	S	*	*			trans	-134.5	126.7	145.6	-115.6	164	-170.5	168.8	0	114.2
557	R	37.4	Very low	38.3	Very low	236 Å²	236	162.3 Å²	162.3	89%	0.891	81%	0.811	S	S	*	*			trans	-64.5	145.7	-164.1	-68.1	166.1	170.5	164.1	-4.7	114.9
558	K	35.7	Very low	37.7	Very low	192 Å²	192	161.4 Å²	161.4	84%	0.835	82%	0.815	S	S	*	*			trans	52.6	102.9	142.3	-64.6	-177.5	176.7	-174	0	118.6
559	L	36.6	Very low	36.9	Very low	174 Å²	174	162.1 Å²	162.1	91%	0.911	82%	0.816	S	S	*	*			trans	-151.8	89.3	131.8	-123.8	158.5	0	0	0	111.1
560	L	38.5	Very low	36.5	Very low	155 Å²	155	159.2 Å²	159.2	81%	0.812	81%	0.808	S	S	*	*			trans	-76.3	123.6	168.7	-67.7	160.7	0	0	0	107.3
561	L	38.6	Very low	36.3	Very low	133 Å²	133	158.7 Å²	158.7	70%	0.696	80%	0.802	S	S	*	*				72.2	92.2	61.3	-156.6	165.3	0	0	0	112	R563	L561-R563 HydrophobicContact CD2-CB 4.1Å
562	N	35.4	Very low	36	Very low	160 Å²	160	156.7 Å²	156.7	86%	0.856	79%	0.793	S	S	*	*			trans	-143.9	81.6	173.7	-158	10.9	0	0	0	107.6
563	R	35.8	Very low	35.8	Very low	195 Å²	195	157.5 Å²	157.5	74%	0.736	80%	0.795	S	S	*	*				79.6	93.8	61	-161.6	-179.5	-166.5	-175.4	5	113.2	L561 T565	L561-R563 HydrophobicContact CD2-CB 4.1Å; R563-T565 HydrophobicContact CG-CG2 3.97Å
564	K	35.3	Very low	35.6	Very low	203 Å²	203	156.1 Å²	156.1	88%	0.883	79%	0.787	S	S	*	*			trans	-167.9	77	157.7	-103.7	172.1	-173.6	-179.3	0	108.8
565	T	34.4	Very low	35.3	Very low	111 Å²	111	158.6 Å²	158.6	68%	0.681	79%	0.787	S	S	*	*				65.5	107.1	77	68.4	0	0	0	0	116.9	R563	R563-T565 HydrophobicContact CG-CG2 3.97Å
566	K	31.3	Very low	35.2	Very low	212 Å²	212	159.5 Å²	159.5	92%	0.922	78%	0.778	S	S	*	*				-165.4	138.5	127.7	-107	177.8	-179.6	-174.6	0	110.7
567	P	35.6	Very low	34.9	Very low	121 Å²	121	154.6 Å²	154.6	79%	0.786	77%	0.766	S	S	*	*			trans	-126.8	-158.2	-171.1	45.3	-32.4	0	0	0	115.1
568	S	35.4	Very low	34.5	Very low	114 Å²	114	149.2 Å²	149.2	80%	0.797	76%	0.76	S	S	*	*			trans	85.2	149.6	178.2	81.7	0	0	0	0	115.2
569	K	35	Very low	34.4	Very low	187 Å²	187	148.1 Å²	148.1	81%	0.813	76%	0.757	S	S	*	*			cis	-156.2	171.8	6.1	-122.2	-166.9	178.8	-179.6	0	106.6
570	L	32	Very low	34.2	Very low	122 Å²	122	144.9 Å²	144.9	64%	0.639	75%	0.745	S	S	*	*			cis	-169.1	141	-10.5	-173.6	63.1	0	0	0	110.4
571	H	36.5	Very low	33.8	Very low	150 Å²	150	142.5 Å²	142.5	69%	0.694	74%	0.742	S	S	*	*			trans	60.2	170.8	159.1	-85.9	-140.4	0	0	0	120.2
572	N	33.8	Very low	33.5	Very low	121 Å²	121	143 Å²	143	65%	0.647	74%	0.743	S	S	*	*			cis	-173.1	174.7	-46.8	-100.4	12.5	0	0	0	109
573	T	34.3	Very low	33.3	Very low	125 Å²	125	140.8 Å²	140.8	77%	0.767	74%	0.736	S	S	*	*			trans	81	145.6	157.6	-45.3	0	0	0	0	117.4
574	I	33.3	Very low	33.2	Very low	126 Å²	126	137.6 Å²	137.6	65%	0.646	73%	0.733	S	S	*	*			cis	-178.7	149.2	-46.8	-104.6	164.8	0	0	0	109.8
575	Q	31.8	Very low	33	Very low	153 Å²	153	133.9 Å²	133.9	72%	0.715	72%	0.723	S	S	*	*			trans	61.9	160.1	166.2	-78.2	162.7	-77.7	0	0	117.1
576	E	33.6	Very low	32.6	Very low	143 Å²	143	137.7 Å²	137.7	67%	0.668	73%	0.726	S	S	*	*			cis	-159	170.2	-2.9	-129.8	154.1	-168.9	0	0	114.5
577	T	32	Very low	32.6	Very low	113 Å²	113	132.8 Å²	132.8	69%	0.693	71%	0.71	S	S	*	*			trans	48.9	133.1	158	54.1	0	0	0	0	121.1
578	T	28.6	Very low	32.4	Very low	124 Å²	124	133.5 Å²	133.5	76%	0.761	71%	0.707	S	S	*	*			cis	68.9	142	38.6	77.1	0	0	0	0	114.2
579	E	34.3	Very low	32.1	Very low	168 Å²	168	131.7 Å²	131.7	79%	0.785	69%	0.694	S	S	*	*			cis	-132.1	-151.9	-0.2	-70.4	-165.8	73.3	0	0	109.6
580	T	32	Very low	31.8	Very low	106 Å²	106	130 Å²	130	65%	0.65	69%	0.694	S	S	*	*			cis	-162.1	158	2.1	-19.5	0	0	0	0	111.6
581	S	30.1	Very low	31.6	Very low	106 Å²	106	132 Å²	132	74%	0.741	70%	0.698	S	S	*	*			trans	66.6	179.6	148.9	85.4	0	0	0	0	117.2
582	I	33.7	Very low	31.2	Very low	143 Å²	143	133.4 Å²	133.4	73%	0.733	70%	0.698	S	S	*	*			cis	-156.3	139.5	-36.1	-107.5	169.8	0	0	0	103.9
583	V	31	Very low	31	Very low	114 Å²	114	133.1 Å²	133.1	69%	0.691	70%	0.701	S	S	*	*			cis	113.7	144	32.1	161.6	0	0	0	0	111.4
584	N	32.5	Very low	30.7	Very low	127 Å²	127	132 Å²	132	68%	0.679	70%	0.699	S	S	*	*			trans	99.1	119	-177.3	-60.9	-53.5	0	0	0	115.1
585	N	31.2	Very low	30.5	Very low	126 Å²	126	134.6 Å²	134.6	67%	0.674	71%	0.705	S	S	*	*				83.5	136	51.1	-65.3	-27.9	0	0	0	111.4
586	Y	27.5	Very low	30.6	Very low	190 Å²	190	136 Å²	136	75%	0.745	71%	0.711	S	S	*	*			cis	-154	172.4	10.1	-143.3	-134.7	0	0	0	111.5
587	N	29.7	Very low	30.5	Very low	109 Å²	109	134.9 Å²	134.9	58%	0.583	72%	0.72	S	S	*	*			trans	1.9	158.8	151.1	-68.2	40.2	0	0	0	120.7
588	D	32	Very low	30.5	Very low	137 Å²	137	135.8 Å²	135.8	73%	0.733	72%	0.719	S	S	*	*			cis	-166.5	-178.9	5.1	-123.1	-39.1	0	0	0	108.7
589	S	28.4	Very low	30.7	Very low	75 Å²	75	134.8 Å²	134.8	52%	0.524	71%	0.709	S	S	.	*			cis	-158.9	160.7	-9.1	58.5	0	0	0	0	108.9
590	N	28.8	Very low	30.8	Very low	152 Å²	152	134.8 Å²	134.8	81%	0.813	71%	0.709	S	S	*	*			trans	63.5	143.2	167.1	-56.8	-69.2	0	0	0	115.5
591	K	27.9	Very low	31	Very low	164 Å²	164	136 Å²	136	71%	0.713	71%	0.711	S	S	*	*			cis	-166.5	162.8	36.4	-149.8	170.6	178.3	175.9	0	109.3
592	Y	29.2	Very low	31.4	Very low	180 Å²	180	138 Å²	138	71%	0.706	71%	0.708	S	S	*	*			trans	65.4	89	168.5	-63.2	-64.8	0	0	0	120.7
593	T	28.2	Very low	31.6	Very low	114 Å²	114	136.9 Å²	136.9	70%	0.699	70%	0.701	S	S	*	*				49.2	90.7	117.7	59.4	0	0	0	0	120.7
594	S	28.2	Very low	31.9	Very low	103 Å²	103	136.2 Å²	136.2	72%	0.72	69%	0.694	S	S	*	*				39.3	103.9	121.1	63.8	0	0	0	0	120.4
595	K	30.9	Very low	32.7	Very low	180 Å²	180	135.3 Å²	135.3	78%	0.783	69%	0.689	S	S	*	*			trans	-174.5	-10.7	135.8	-108.8	159.9	-174.8	172.4	0	117.6	S597	K595-S597 PolarHBondContact O-N 3.11Å
596	E	32.4	Very low	33.3	Very low	181 Å²	181	136.7 Å²	136.7	85%	0.846	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-11.1	-156	-60.2	-168.3	115.1	0	0	117.5	I598	E596-I598 PolarHBondContact O-N 3.04Å
597	S	31.5	Very low	34.2	Very low	120 Å²	120	132.6 Å²	132.6	84%	0.839	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-5.7	-177.9	54.5	0	0	0	0	115.8	K595	K595-S597 PolarHBondContact O-N 3.11Å
598	I	32.7	Very low	35.4	Very low	132 Å²	132	131.7 Å²	131.7	68%	0.677	67%	0.672	S	S	*	*	S	Bend	trans	-102.7	-21.7	-172.6	-66.7	176.3	0	0	0	113.2	E596 Q600	E596-I598 PolarHBondContact O-N 3.04Å; I598-Q600 PolarHBondContact O-N 3.16Å
599	N	33.6	Very low	36.4	Very low	103 Å²	103	127.4 Å²	127.4	55%	0.551	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-11.4	-166	-74.5	-23.2	0	0	0	116.2	L601 H602	N599-L601 VanDerWaalsContact C-N 3.26Å; N599-L601 PolarHBondContact O-N 3.02Å; N599-H602 PolarHBondContact O-N 3.16Å
600	Q	35.7	Very low	37.5	Very low	169 Å²	169	130.3 Å²	130.3	79%	0.79	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	-19	179.9	-69.9	-166.3	-0.4	0	0	114.2	I598	I598-Q600 PolarHBondContact O-N 3.16Å
601	L	36.7	Very low	38.5	Very low	132 Å²	132	129.9 Å²	129.9	69%	0.691	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-32.9	176.5	-125.6	72.5	0	0	0	113.1	N599	N599-L601 VanDerWaalsContact C-N 3.26Å; N599-L601 PolarHBondContact O-N 3.02Å
602	H	38.6	Very low	39.6	Very low	147 Å²	147	127.9 Å²	127.9	68%	0.681	64%	0.639	S	S	*	*	H	α-helix	trans	-80.2	-18.7	-173.2	-116.9	-90.6	0	0	0	114.5	N599 N604 Y606	N599-H602 PolarHBondContact O-N 3.16Å; H602-N604 VanDerWaalsContact C-N 3.34Å; H602-N604 PolarHBondContact O-N 3.42Å; H602-Y606 PolarHBondContact O-N 3.44Å
603	M	36.1	Very low	40.5	Very low	120 Å²	120	127 Å²	127	59%	0.591	64%	0.639	S	S	*	*	H	α-helix	trans	-67.3	-30.4	-179.5	-79.1	-66.4	-171.1	0	0	113.9	Y606 H607	M603-Y606 PolarHBondContact O-N 3.33Å; M603-H607 PolarHBondContact O-CD2 3.43Å; M603-H607 PolarHBondContact O-N 2.87Å; M603-H607 VanDerWaalsContact O-N 3.14Å
604	N	39	Very low	41.3	Very low	99 Å²	99	128.6 Å²	128.6	53%	0.529	63%	0.632	S	S	.	*	H	α-helix	trans	-67	-44.6	-179.1	-77.2	-81.5	0	0	0	111.7	H602 Y606 H607 T608	H602-N604 VanDerWaalsContact C-N 3.34Å; H602-N604 PolarHBondContact O-N 3.42Å; N604-Y606 VanDerWaalsContact C-N 3.3Å; N604-Y606 PolarHBondContact O-N 3Å; N604-H607 PolarHBondContact O-N 3.39Å; N604-T608 PolarHBondContact O-N 2.77Å; N604-T608 VanDerWaalsContact O-N 3.08Å; N604-T608 PolarHBondContact O-OG1 3.48Å
605	D	48.3	Very low	42.3	Very low	108 Å²	108	126.5 Å²	126.5	58%	0.578	62%	0.621	S	S	*	*	H	α-helix	trans	-68.4	-32.3	178.7	-60.8	-26.6	0	0	0	111.4	H607 T608 A609	D605-H607 PolarHBondContact O-N 2.84Å; D605-T608 PolarHBondContact O-N 2.68Å; D605-A609 WeakPolarHBondContact O-CB 3.43Å; D605-A609 PolarHBondContact O-N 3.11Å
606	Y	43.5	Very low	43.2	Very low	156 Å²	156	124 Å²	124	61%	0.612	61%	0.612	S	S	*	*	H	α-helix	trans	-63.5	-39.4	173.7	-155	-100.1	0	0	0	112.3	H602 M603 N604 R610	H602-Y606 PolarHBondContact O-N 3.44Å; M603-Y606 PolarHBondContact O-N 3.33Å; N604-Y606 VanDerWaalsContact C-N 3.3Å; N604-Y606 PolarHBondContact O-N 3Å; Y606-R610 WeakPolarHBondContact O-CB 3.37Å; Y606-R610 PolarHBondContact O-N 3.48Å
607	H	48	Very low	43.7	Very low	104 Å²	104	118.8 Å²	118.8	48%	0.481	60%	0.596	S	S	.	*	H	α-helix	trans	-67.7	-44.6	173.4	-89.2	-98.8	0	0	0	112.2	M603 N604 D605 R610 F611	M603-H607 PolarHBondContact O-CD2 3.43Å; M603-H607 PolarHBondContact O-N 2.87Å; M603-H607 VanDerWaalsContact O-N 3.14Å; N604-H607 PolarHBondContact O-N 3.39Å; D605-H607 PolarHBondContact O-N 2.84Å; H607-R610 PolarHBondContact O-N 2.94Å; H607-F611 VanDerWaalsContact O-CD2 3.3Å; H607-F611 WeakPolarHBondContact O-CD2 3.38Å; H607-F611 PolarHBondContact O-N 3.07Å
608	T	54.5	Low	44.6	Very low	89 Å²	89	118.7 Å²	118.7	55%	0.546	59%	0.585	S	S	.	*	H	α-helix	trans	-62.1	-46.6	178.7	-61.1	0	0	0	0	111.9	N604 D605 R610 F611 E612	N604-T608 PolarHBondContact O-N 2.77Å; N604-T608 VanDerWaalsContact O-N 3.08Å; N604-T608 PolarHBondContact O-OG1 3.48Å; D605-T608 PolarHBondContact O-N 2.68Å; T608-R610 VanDerWaalsContact C-N 3.3Å; T608-R610 PolarHBondContact O-N 2.99Å; T608-F611 PolarHBondContact O-N 2.81Å; T608-F611 VanDerWaalsContact O-N 3.15Å; T608-E612 PolarHBondContact O-N 3.46Å
609	A	51.5	Low	45.1	Very low	48 Å²	48	119.3 Å²	119.3	40%	0.397	58%	0.58	S	S	.	*	H	α-helix	trans	-64.3	-32.3	175.8	0	0	0	0	0	113	D605 K613	D605-A609 WeakPolarHBondContact O-CB 3.43Å; D605-A609 PolarHBondContact O-N 3.11Å; A609-K613 PolarHBondContact O-N 3.24Å; A609-K613 VanDerWaalsContact O-N 3.13Å
610	R	52.1	Low	45.7	Very low	136 Å²	136	121.5 Å²	121.5	51%	0.513	59%	0.59	S	S	.	*	H	α-helix	trans	-71.7	-30.9	174.6	-167.2	173.4	-169	174.2	3.7	112.4	Y606 H607 T608 R614	Y606-R610 WeakPolarHBondContact O-CB 3.37Å; Y606-R610 PolarHBondContact O-N 3.48Å; H607-R610 PolarHBondContact O-N 2.94Å; T608-R610 VanDerWaalsContact C-N 3.3Å; T608-R610 PolarHBondContact O-N 2.99Å; R610-R614 PolarHBondContact O-N 3.29Å
611	F	49.8	Very low	45.7	Very low	142 Å²	142	124.9 Å²	124.9	62%	0.623	61%	0.605	S	S	*	*	H	α-helix	trans	-72.1	-41.1	171.2	-87	-68.7	0	0	0	112.5	H607 T608 K613 R614 A615	H607-F611 VanDerWaalsContact O-CD2 3.3Å; H607-F611 WeakPolarHBondContact O-CD2 3.38Å; H607-F611 PolarHBondContact O-N 3.07Å; T608-F611 PolarHBondContact O-N 2.81Å; T608-F611 VanDerWaalsContact O-N 3.15Å; F611-K613 PolarHBondContact O-N 3.48Å; F611-R614 PolarHBondContact O-N 3.42Å; F611-A615 WeakPolarHBondContact O-CB 3.39Å; F611-A615 PolarHBondContact O-N 2.95Å
612	E	51.4	Low	46.2	Very low	123 Å²	123	124.5 Å²	124.5	58%	0.575	60%	0.6	S	S	*	*	H	α-helix	trans	-61	-45.5	174.4	-71.9	-166.9	129.4	0	0	112.1	T608 R614 A615 Q616	T608-E612 PolarHBondContact O-N 3.46Å; E612-R614 VanDerWaalsContact C-N 3.3Å; E612-R614 PolarHBondContact O-N 2.96Å; E612-A615 PolarHBondContact O-N 3.37Å; E612-Q616 WeakPolarHBondContact O-CG 3.31Å; E612-Q616 PolarHBondContact O-N 3.44Å
613	K	49	Very low	46.6	Very low	161 Å²	161	123.3 Å²	123.3	70%	0.7	60%	0.596	S	S	*	*	H	α-helix	trans	-62.7	-33.6	176.1	-73.7	-174.9	176.3	-178.1	0	113	A609 F611 S617	A609-K613 PolarHBondContact O-N 3.24Å; A609-K613 VanDerWaalsContact O-N 3.13Å; F611-K613 PolarHBondContact O-N 3.48Å; K613-S617 PolarHBondContact O-N 2.88Å; K613-S617 VanDerWaalsContact O-N 3.07Å
614	R	45.2	Very low	47.2	Very low	148 Å²	148	123.5 Å²	123.5	56%	0.558	60%	0.597	S	S	*	*	H	α-helix	trans	-74.9	-34.7	173.6	-81.8	-178.3	164.2	178.2	-6.8	113.4	R610 F611 E612 Q616 S617 I618	R610-R614 PolarHBondContact O-N 3.29Å; F611-R614 PolarHBondContact O-N 3.42Å; E612-R614 VanDerWaalsContact C-N 3.3Å; E612-R614 PolarHBondContact O-N 2.96Å; R614-Q616 VanDerWaalsContact C-N 3.28Å; R614-Q616 PolarHBondContact O-N 2.98Å; R614-S617 WeakPolarHBondContact CA-OG 3.47Å; R614-S617 PolarHBondContact O-N 3.45Å; R614-S617 PolarHBondContact O-OG 3.45Å; R614-I618 WeakPolarHBondContact O-CD1 3.29Å; R614-I618 WeakPolarHBondContact O-CG1 3.37Å; R614-I618 PolarHBondContact O-N 3.49Å
615	A	48.9	Very low	47.6	Very low	58 Å²	58	124.9 Å²	124.9	48%	0.479	60%	0.601	S	S	.	*	H	α-helix	trans	-65.5	-33.5	172.8	0	0	0	0	0	111.8	F611 E612	F611-A615 WeakPolarHBondContact O-CB 3.39Å; F611-A615 PolarHBondContact O-N 2.95Å; E612-A615 PolarHBondContact O-N 3.37Å
616	Q	50	Low	47.6	Very low	127 Å²	127	126 Å²	126	59%	0.593	60%	0.602	S	S	*	*	H	α-helix	trans	-74.1	-35.8	173.5	-69.8	173.4	7.7	0	0	112.8	E612 R614 I618 Y619	E612-Q616 WeakPolarHBondContact O-CG 3.31Å; E612-Q616 PolarHBondContact O-N 3.44Å; R614-Q616 VanDerWaalsContact C-N 3.28Å; R614-Q616 PolarHBondContact O-N 2.98Å; Q616-I618 PolarHBondContact O-N 2.87Å; Q616-Y619 WeakPolarHBondContact O-CB 3.49Å; Q616-Y619 PolarHBondContact O-N 3.11Å
617	S	43	Very low	47.9	Very low	72 Å²	72	124 Å²	124	50%	0.503	60%	0.601	S	S	.	*	H	α-helix	trans	-68.8	-19.7	174.9	62.5	0	0	0	0	114	K613 R614 Y619	K613-S617 PolarHBondContact O-N 2.88Å; K613-S617 VanDerWaalsContact O-N 3.07Å; R614-S617 WeakPolarHBondContact CA-OG 3.47Å; R614-S617 PolarHBondContact O-N 3.45Å; R614-S617 PolarHBondContact O-OG 3.45Å; S617-Y619 PolarHBondContact O-N 2.63Å
618	I	49.1	Very low	47.9	Very low	119 Å²	119	125.4 Å²	125.4	61%	0.61	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	2.1	172.6	-64.9	163.9	0	0	0	111.5	R614 Q616	R614-I618 WeakPolarHBondContact O-CD1 3.29Å; R614-I618 WeakPolarHBondContact O-CG1 3.37Å; R614-I618 PolarHBondContact O-N 3.49Å; Q616-I618 PolarHBondContact O-N 2.87Å
619	Y	44.1	Very low	47.3	Very low	145 Å²	145	128.2 Å²	128.2	57%	0.569	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.2	8.4	179.6	-120.4	-71.1	0	0	0	113.8	R514 Q616 S617	R514-Y619 VanDerWaalsContact NH1-CE2 3.34Å; R514-Y619 PolarHBondContact NH1-OH 2.98Å; Q616-Y619 WeakPolarHBondContact O-CB 3.49Å; Q616-Y619 PolarHBondContact O-N 3.11Å; S617-Y619 PolarHBondContact O-N 2.63Å
620	I	46.3	Very low	47	Very low	149 Å²	149	134.9 Å²	134.9	76%	0.764	63%	0.633	S	S	*	*			trans	-130.7	18.6	-174.5	-55.1	179.8	0	0	0	110.3
621	H	35.4	Very low	46.5	Very low	239 Å²	239	134.8 Å²	134.8	100%	1.106	64%	0.644	S	S	*	*			trans	-139.8	0	179.5	-132.5	-49	0	0	0	111.1

Retrieved 621 of 621 residues in 507.6 ms (Link to these results)

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